   FDMNES program, Revision 3 July 2009           
   Date = 25 11 2009                              
   Time = 16 h 54 mn 29 s                         

 Vanadium K-edge in V2O3, antiferromagnetic, monoclinic                                                                             

 Threshold: Vanadium K1 edge                                                                                                        
 Radius =  3.00
 icheck = 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
 Range = -16.000   0.100 -10.000   0.200   0.000   0.500  10.000   1.000  40.000
            2.000  50.000
 Dipole component
 Quadrupole component
 Relativistic calculation
 Magnetic calculation with spin-orbit interaction
 Real bases
 Multiple scattering calculation (Green)
    Tau normalization
    Optimized type muffin-tin radius
    Overlap of the muffin-tin radius  =  0.10
    Limitation on the maximum value of l

 Calculation in double precision

 DAFS : (h, k, l)  Polarization   Angle_i   Angle_o  Azimuth
         1  1  1   sigma sigma     0.000     0.000     0.000
         1  1  1   sigma sigma     0.000     0.000    90.000
         1  1  1   sigma pi        0.000    90.000     0.000
         1  1  1   sigma pi        0.000    90.000    90.000

 ngroup =   20, ntype = 2
   Crystal
   a, b, c =  7.25500  5.00200  5.54800
   alfa, beta, gamma =   90.000   96.750   90.000
    typ    posx      posy      posz      popats
     1   0.34380   0.00080   0.29910    2.0000  0.0000  1.0000  1.0000  0.5000  0.5000
     1   0.65620   0.99920   0.70090    2.0000  0.0000  1.0000  1.0000  0.5000  0.5000
     1   0.84380   0.99920   0.29910    2.0000  0.0000  1.0000  1.0000  0.5000  0.5000
     1   0.15620   0.00080   0.70090    2.0000  0.0000  1.0000  1.0000  0.5000  0.5000
     1   0.84380   0.50080   0.79910    2.0000  0.0000  1.0000  1.0000  0.5000  0.5000
     1   0.15620   0.49920   0.20090    2.0000  0.0000  1.0000  1.0000  0.5000  0.5000
     1   0.34380   0.49920   0.79910    2.0000  0.0000  1.0000  1.0000  0.5000  0.5000
     1   0.65620   0.50080   0.20090    2.0000  0.0000  1.0000  1.0000  0.5000  0.5000
     2   0.40700   0.84500   0.65200
     2   0.09300   0.84500   0.34800
     2   0.59300   0.15500   0.34800
     2   0.90700   0.15500   0.65200
     2   0.90700   0.34500   0.15200
     2   0.59300   0.34500   0.84800
     2   0.09300   0.65500   0.84800
     2   0.40700   0.65500   0.15200
     2   0.25000   0.19100   0.00000
     2   0.75000   0.80900   0.00000
     2   0.75000   0.69100   0.50000
     2   0.25000   0.30900   0.50000

 Hedin and Lundqvist exchange-correlation potential

 Self consistent calculation
   Radius used for the self-consistent part =   3.000 A
   Maximum number of iteration =   1
   Weight = 0.000
   Delta energy for convergence =  1.000 eV / atom
   Non excited absorbing atom in this part

 General Z axis = -0.65093  0.00000 -0.83949
 Euler angles   =  180.000  139.728    0.000

       local matrix rotation       local Z axis   Atom =  1
     0.76299  0.00000 -0.64642      -0.65093
     0.00000 -1.00000  0.00000       0.00000
    -0.64642  0.00000 -0.76299      -0.83949

       local matrix rotation       local Z axis   Atom =  2
     0.76299  0.00000 -0.64642      -0.65093
     0.00000 -1.00000  0.00000       0.00000
    -0.64642  0.00000 -0.76299      -0.83949

       local matrix rotation       local Z axis   Atom =  3
     0.76299  0.00000 -0.64642      -0.65093
     0.00000 -1.00000  0.00000       0.00000
    -0.64642  0.00000 -0.76299      -0.83949

       local matrix rotation       local Z axis   Atom =  4
     0.76299  0.00000 -0.64642      -0.65093
     0.00000 -1.00000  0.00000       0.00000
    -0.64642  0.00000 -0.76299      -0.83949

       local matrix rotation       local Z axis   Atom =  5
     0.76299  0.00000  0.64642       0.65093
     0.00000  1.00000  0.00000       0.00000
    -0.64642  0.00000  0.76299       0.83949

       local matrix rotation       local Z axis   Atom =  6
     0.76299  0.00000  0.64642       0.65093
     0.00000  1.00000  0.00000       0.00000
    -0.64642  0.00000  0.76299       0.83949

       local matrix rotation       local Z axis   Atom =  7
     0.76299  0.00000  0.64642       0.65093
     0.00000  1.00000  0.00000       0.00000
    -0.64642  0.00000  0.76299       0.83949

       local matrix rotation       local Z axis   Atom =  8
     0.76299  0.00000  0.64642       0.65093
     0.00000  1.00000  0.00000       0.00000
    -0.64642  0.00000  0.76299       0.83949

       local matrix rotation       local Z axis   Atom =  9
     0.76299  0.00000 -0.64642      -0.65093
     0.00000 -1.00000  0.00000       0.00000
    -0.64642  0.00000 -0.76299      -0.83949

       local matrix rotation       local Z axis   Atom = 10
     0.76299  0.00000 -0.64642      -0.65093
     0.00000 -1.00000  0.00000       0.00000
    -0.64642  0.00000 -0.76299      -0.83949

       local matrix rotation       local Z axis   Atom = 11
     0.76299  0.00000 -0.64642      -0.65093
     0.00000 -1.00000  0.00000       0.00000
    -0.64642  0.00000 -0.76299      -0.83949

       local matrix rotation       local Z axis   Atom = 12
     0.76299  0.00000 -0.64642      -0.65093
     0.00000 -1.00000  0.00000       0.00000
    -0.64642  0.00000 -0.76299      -0.83949

       local matrix rotation       local Z axis   Atom = 13
     0.76299  0.00000 -0.64642      -0.65093
     0.00000 -1.00000  0.00000       0.00000
    -0.64642  0.00000 -0.76299      -0.83949

       local matrix rotation       local Z axis   Atom = 14
     0.76299  0.00000 -0.64642      -0.65093
     0.00000 -1.00000  0.00000       0.00000
    -0.64642  0.00000 -0.76299      -0.83949

       local matrix rotation       local Z axis   Atom = 15
     0.76299  0.00000 -0.64642      -0.65093
     0.00000 -1.00000  0.00000       0.00000
    -0.64642  0.00000 -0.76299      -0.83949

       local matrix rotation       local Z axis   Atom = 16
     0.76299  0.00000 -0.64642      -0.65093
     0.00000 -1.00000  0.00000       0.00000
    -0.64642  0.00000 -0.76299      -0.83949

       local matrix rotation       local Z axis   Atom = 17
     0.76299  0.00000 -0.64642      -0.65093
     0.00000 -1.00000  0.00000       0.00000
    -0.64642  0.00000 -0.76299      -0.83949

       local matrix rotation       local Z axis   Atom = 18
     0.76299  0.00000 -0.64642      -0.65093
     0.00000 -1.00000  0.00000       0.00000
    -0.64642  0.00000 -0.76299      -0.83949

       local matrix rotation       local Z axis   Atom = 19
     0.76299  0.00000 -0.64642      -0.65093
     0.00000 -1.00000  0.00000       0.00000
    -0.64642  0.00000 -0.76299      -0.83949

       local matrix rotation       local Z axis   Atom = 20
     0.76299  0.00000 -0.64642      -0.65093
     0.00000 -1.00000  0.00000       0.00000
    -0.64642  0.00000 -0.76299      -0.83949

 Sequential calculation

 Atom type  1,  Z = 23   Non relativistic atomic calculation
   n  l     pop
   3  0    2.000
   3  1    6.000
   4  0    2.000
   3  2    2.000
   4  1    1.000

 Atom type  2,  Z =  8   Non relativistic atomic calculation
   n  l     pop
   1  0    2.000
   2  0    2.000
   2  1    4.000

 FDM atom radius = 1.000 0.533

 ---- Symsite ----------------------------------------------------------------------------------------------------------

   ipr =  1, Z = 23, natomsym =     8

  igr      posx     posy     posz          sym    code
    1    0.34380  0.00080  0.29910            E     1
    2    0.65620  0.99920  0.70090            i    25
    3    0.84380  0.99920  0.29910         T.my   -41
    4    0.15620  0.00080  0.70090        T.C2y   -23
    5    0.84380  0.50080  0.79910          T.E    -1
    6    0.15620  0.49920  0.20090          T.i   -25
    7    0.34380  0.49920  0.79910           my    41
    8    0.65620  0.50080  0.20090          C2y    23

   ipr =  2, Z =  8, natomsym =     8

  igr      posx     posy     posz          sym    code
    9    0.40700  0.84500  0.65200            E     1
   10    0.09300  0.84500  0.34800        T.C2y   -23
   11    0.59300  0.15500  0.34800            i    25
   12    0.90700  0.15500  0.65200         T.my   -41
   13    0.90700  0.34500  0.15200          T.E    -1
   14    0.59300  0.34500  0.84800          C2y    23
   15    0.09300  0.65500  0.84800          T.i   -25
   16    0.40700  0.65500  0.15200           my    41

   ipr =  3, Z =  8, natomsym =     4

  igr      posx     posy     posz          sym    code
   17    0.25000  0.19100  0.00000            E     1
   18    0.75000  0.80900  0.00000            i    25
   19    0.75000  0.69100  0.50000          T.E    -1
   20    0.25000  0.30900  0.50000          T.i   -25

 ---- Esdata -----------------------------------------------------------------------------------------------------------

 E_edge =  5465.00 eV, WorkF =   3.77 eV

 ---- Init_run ----------------------------------------------------------------------------------------------------------

 Excited atom, type 0,  Z = 23   Non relativistic atomic calculation
   n  l     pop
   3  0    2.000
   3  1    6.000
   4  0    2.000
   3  2    3.000
   4  1    1.000

 Atom type                     Z  n  l  popatv
  0  Dirac                    23  3  2  3.00  4  0  2.00  4  1  1.00
  1  Dirac                    23  3  2  2.00  4  0  2.00  4  1  1.00
  2  Dirac                     8

 Default or imposed orbital screening :
      When default is used, if the screening orbital is full,
      it is the next one which is filled
   n_screening_orbital = 3
   l_screening_orbital = 2
   Screening = 0.500 0.500

 ---- Screening --------------------------------------------------------------------------------------------------------

 iprabs =  1

  ipr  it    charge   popatm(1,up)  popatm(1,dn) ...
   0   0    0.00000    2.50000    0.50000    1.00000    1.00000    0.50000    0.50000
   1   1    0.00000    2.00000    0.00000    1.00000    1.00000    0.50000    0.50000
   2   2    0.00000
   3   2    0.00000

 ---- Natomp_cal --------------------------------------------------------------------------------------------------------

 Cluster radius = 3.00 A, nb. of atom =  11
 Potential sup calculation: cluster radius = 9.95 A, nb. of atom = 411

 ---- Agregat ----------------------------------------------------------------------------------------------------------

 Index of the absorbing atom, iaabs =  1

 Point group : 1        (C1   )

 iopsymc =
                                         E :  1
        C3_111, -C3_111, C3_1-11, -C3_1-11 :  0 0 0 0
      C3_-111, -C3_-111, C3_11-1, -C3_11-1 :  0 0 0 0
                   C2_110, C2_-110, C2_101 :  0 0 0
                  C2_-101, C2_011, C2_0-11 :  0 0 0
                             C4x, C4y, C4z :  0 0 0
                          -C4x, -C4y, -C4z :  0 0 0
                             C2x, C2y, C2z :  0 0 0
                                         i :  0
                             S4x, S4y, S4z :  0 0 0
                          -S4x, -S4y, -S4z :  0 0 0
    iC3_111, -iC3_111, iC3_1-11, -iC3_1-11 :  0 0 0 0
  iC3_-111, -iC3_-111, iC3_11-1, -iC3_11-1 :  0 0 0 0
                                mx, my, mz :  0 0 0
                       d_011, d_101, d_110 :  0 0 0
                    d_01-1, d_10-1, d_1-10 :  0 0 0
                      C3z, -C3z, C6z, -C6z :  0 0 0 0
                      S3z, -S3z, S6z, -S6z :  0 0 0 0
              d_030, C2_030, d_060, C2_060 :  0 0 0 0
              d_120, C2_120, d_150, C2_150 :  0 0 0 0

 Character table :
       1
       1                                                                                                                                             

 Symmetry code:
    1        E

 Transformation matrices :
    R1 : internal orthonormal bases with z along c, x along b x c
         but for trigonal symmetry where z is along the hexagonal axis,
         used for the tensorial expansion.
    R2 : internal orthonormal bases used for the electronic structure calculation

 Transformation Crystal Bases - Bases R1 :
    13.61493  0.00000  0.00000
     0.00000  9.45241  0.00000
    -1.61143  0.00000 10.48420

 Transformation Crystal Normalized Bases - Bases R1 :
     0.99307  0.00000  0.00000
     0.00000  1.00000  0.00000
    -0.11754  0.00000  1.00000

 Rotation Bases R1 - Bases R2 :
     0.76299  0.00000 -0.64642
     0.00000 -1.00000  0.00000
    -0.64642  0.00000 -0.76299

 Inverse matrix :
     0.76299  0.00000 -0.64642
     0.00000 -1.00000  0.00000
    -0.64642  0.00000 -0.76299

 Transformation Crystal Bases - Bases R2 :
    11.42965  0.00000 -6.77715
     0.00000 -9.45241  0.00000
    -7.57141  0.00000 -7.99929

 Inverse matrix :
     0.05604  0.00000 -0.04748
     0.00000 -0.10579  0.00000
    -0.05304  0.00000 -0.08007

 Atom positions in order, in the internal R2 bases
   Z      posx       posy       posz          dista    ia   igr ity ipr  chargat
  23   0.000000   0.000000   0.000000   !    0.000000   1     1   1   1  0.00000
   8   1.331868  -0.771308  -1.205445   !    1.954964   2    11   2   2  0.00000
   8   0.505336  -0.951380   1.641924   !    1.963772   3    17   2   3  0.00000
   8   0.909800   1.729692   0.369462   !    1.988988   4    16   2   2  0.00000
   8  -1.692287   0.779312   0.797864   !    2.026758   5    10   2   2  0.00000
   8  -1.287822  -1.541616  -0.474598   !    2.064052   6    20   2   3  0.00000
   8  -0.883358   0.779312  -1.747059   !    2.107098   7     9   2   2  0.00000
  23  -2.575644   0.000000  -0.949195   !    2.744980   8     4   1   1  0.00000
  23  -0.782487  -2.492997   1.167326   !    2.861812   9     6   1   1  0.00000
  23  -0.782487   2.509003   1.167326   !    2.875766  10     6   1   1  0.00000
  23   0.448510   0.008003  -2.952503   !    2.986386  11     2   1   1  0.00000
   8   0.100871   1.729692   2.914385   !    3.390523  12    15   2   2  0.00000
   8   1.736333   1.549620  -2.477906   !    3.399440  13    19   2   3  0.00000
   8   0.909800  -3.272308   0.369462   !    3.416466  14    16   2   2  0.00000
  23   1.010671   0.000000   3.283847   !    3.435856  15     4   1   1  0.00000
  23   2.241668   2.501000  -0.835982   !    3.461061  16     8   1   1  0.00000
  23   2.241668  -2.501000  -0.835982   !    3.461061  17     8   1   1  0.00000
   8  -2.114355  -1.721688   2.372771   !    3.614519  18    13   2   2  0.00000
  23   3.024155   0.008003  -2.003308   !    3.627509  19     3   1   1  0.00000
  23  -3.024155   0.008003   2.003308   !    3.627509  20     3   1   1  0.00000
   8   3.529490   0.959384  -0.361385   !    3.675366  21    18   2   3  0.00000
   8   3.125026  -1.721688   0.911076   !    3.682398  22    14   2   2  0.00000
   8  -1.287822   3.460384  -0.474598   !    3.722631  23    20   2   3  0.00000
  23  -1.793158  -2.492997  -2.116521   !    3.729626  24     7   1   1  0.00000
  23   1.793158  -2.492997   2.116521   !    3.729626  25     7   1   1  0.00000
  23  -1.793158   2.509003  -2.116521   !    3.740344  26     7   1   1  0.00000
  23   1.793158   2.509003   2.116521   !    3.740344  27     7   1   1  0.00000
   8   2.702958   0.779312   2.485983   !    3.754121  28     9   2   2  0.00000
   8  -0.461290  -1.721688  -3.321966   !    3.769941  29    14   2   2  0.00000
   8  -3.907512  -0.771308   0.256250   !    3.991144  30    12   2   2  0.00000
   8  -3.485445   1.729692  -1.318657   !    4.108408  31    15   2   2  0.00000
   8  -3.080980  -0.951380  -2.591119   !    4.136600  32    17   2   3  0.00000
  23   4.034826   0.008003   1.280539   !    4.233162  33     2   1   1  0.00000
   8   0.100871  -3.272308   2.914385   !    4.383129  34    15   2   2  0.00000
   8   2.140797  -0.771308  -3.750367   !    4.386705  35    12   2   2  0.00000
   8   0.505336   4.050620   1.641924   !    4.399863  36    17   2   3  0.00000
   8  -2.518819   0.959384   3.645232   !    4.533496  37    18   2   3  0.00000
   8  -0.321197  -0.771308   4.489292   !    4.566380  38    12   2   2  0.00000
   8  -2.114355   3.280312   2.372771   !    4.567382  39    13   2   2  0.00000
   8   1.736333  -3.452380  -2.477906   !    4.590621  40    19   2   3  0.00000
   8   3.933955  -1.721688  -1.633846   !    4.594526  41    13   2   2  0.00000
   8   1.331868   4.230692  -1.205445   !    4.596272  42    11   2   2  0.00000
   8  -1.692287  -4.222688   0.797864   !    4.618606  43    10   2   2  0.00000
   8   3.125026   3.280312   0.911076   !    4.621287  44    14   2   2  0.00000
   8  -0.883358  -4.222688  -1.747059   !    4.654421  45     9   2   2  0.00000
   8   2.298493  -1.541616   3.758445   !    4.667500  46    20   2   3  0.00000
   8  -0.461290   3.280312  -3.321966   !    4.691342  47    14   2   2  0.00000
   8  -0.056825   0.959384  -4.594427   !    4.693869  48    18   2   3  0.00000
   8  -4.311977   1.549620   1.528711   !    4.830261  49    19   2   3  0.00000
   8  -3.485445  -3.272308  -1.318657   !    4.959353  50    15   2   2  0.00000
  23   1.230997  -2.501000  -4.119829   !    4.974269  51     5   1   1  0.00000
  23  -1.230997   2.501000   4.119829   !    4.974269  52     5   1   1  0.00000
  23  -1.230997  -2.501000   4.119829   !    4.974269  53     5   1   1  0.00000
  23   1.230997   2.501000  -4.119829   !    4.974269  54     5   1   1  0.00000
  23   0.000000   5.002000   0.000000   !    5.002000  55     1   1   1  0.00000
  23   0.000000  -5.002000   0.000000   !    5.002000  56     1   1   1  0.00000
   8  -2.676515   1.729692  -3.863580   !    5.008275  57    16   2   2  0.00000
   8   3.933955   3.280312  -1.633846   !    5.376421  58    13   2   2  0.00000
   8   3.529490  -4.042616  -0.361385   !    5.378722  59    18   2   3  0.00000
  23  -4.817312   2.501000  -0.113213   !    5.429025  60     5   1   1  0.00000
  23   4.817312   2.501000   0.113213   !    5.429025  61     5   1   1  0.00000
  23  -4.817312  -2.501000  -0.113213   !    5.429025  62     5   1   1  0.00000
  23   4.817312  -2.501000   0.113213   !    5.429025  63     5   1   1  0.00000
   8   1.894029   0.779312   5.030906   !    5.431822  64    10   2   2  0.00000
   8   4.356023   0.779312  -3.208753   !    5.466110  65    10   2   2  0.00000
   8  -4.716442  -0.771308   2.801172   !    5.539522  66    11   2   2  0.00000
  23  -3.586315   0.000000  -4.233042   !    5.548000  67     1   1   1  0.00000
  23   3.586315   0.000000   4.233042   !    5.548000  68     1   1   1  0.00000
  23  -3.806641  -2.501000   3.170634   !    5.549634  69     8   1   1  0.00000
  23  -3.806641   2.501000   3.170634   !    5.549634  70     8   1   1  0.00000
   8   2.702958  -4.222688   2.485983   !    5.596177  71     9   2   2  0.00000
   8   2.298493   3.460384   3.758445   !    5.602074  72    20   2   3  0.00000
  23  -2.013484   0.008003   5.287156   !    5.657578  73     2   1   1  0.00000
  23  -5.599799   0.008003   1.054113   !    5.698155  74     2   1   1  0.00000
  23  -2.575644  -5.002000  -0.949195   !    5.705692  75     4   1   1  0.00000
  23  -2.575644   5.002000  -0.949195   !    5.705692  76     4   1   1  0.00000
   8  -3.080980   4.050620  -2.591119   !    5.710854  77    17   2   3  0.00000
   8  -2.676515  -3.272308  -3.863580   !    5.727040  78    16   2   2  0.00000
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  23   5.379473   2.509003   6.349563   !    8.691995 276     7   1   1  0.00000
   8   3.371794   1.729692  -7.870197   !    8.735034 277    16   2   2  0.00000
   8  -4.047605  -1.721688  -7.555008   !    8.742166 278    14   2   2  0.00000
   8  -0.725662   6.551620   5.761753   !    8.754890 279    19   2   3  0.00000
   8  -3.749816  -1.541616   7.765061   !    8.759788 280    20   2   3  0.00000
   8   0.100871  -8.274308   2.914385   !    8.773140 281    15   2   2  0.00000
   8   5.164952  -4.222688  -5.753676   !    8.809802 282     9   2   2  0.00000
  23   4.596986   0.000000   7.516889   !    8.811124 283     4   1   1  0.00000
  23  -6.048309  -5.002000   4.006617   !    8.812209 284     1   1   1  0.00000
  23  -6.048309   5.002000   4.006617   !    8.812209 285     1   1   1  0.00000
  23   6.048309  -5.002000  -4.006617   !    8.812209 286     1   1   1  0.00000
  23   6.048309   5.002000  -4.006617   !    8.812209 287     1   1   1  0.00000
   8  -2.923284  -6.723688   4.917693   !    8.828209 288    14   2   2  0.00000
   8  -7.336132   3.460384   3.532019   !    8.846934 289    20   2   3  0.00000
  23  -5.037638   0.000000   7.290464   !    8.861640 290     4   1   1  0.00000
   8  -2.114355   8.282312   2.372771   !    8.871145 291    13   2   2  0.00000
   8  -5.542974   4.050620   5.648540   !    8.890337 292    17   2   3  0.00000
   8  -8.724825   1.729692   0.143037   !    8.895778 293    16   2   2  0.00000
   8   3.125026   8.282312   0.911076   !    8.899019 294    14   2   2  0.00000
   8   8.751267   0.779312  -1.520633   !    8.916520 295     9   2   2  0.00000
  23   4.817312  -7.503000   0.113213   !    8.917081 296     5   1   1  0.00000
  23  -4.817312   7.503000  -0.113213   !    8.917081 297     5   1   1  0.00000
  23   4.817312   7.503000   0.113213   !    8.917081 298     5   1   1  0.00000
  23  -4.817312  -7.503000  -0.113213   !    8.917081 299     5   1   1  0.00000
   8  -1.552194   1.729692   8.609121   !    8.917293 300    16   2   2  0.00000
   8   1.067496  -4.042616   7.878274   !    8.919053 301    18   2   3  0.00000
  23  -6.830796  -2.492997   5.173943   !    8.924376 302     6   1   1  0.00000
   8   1.174172  -1.541616  -8.714256   !    8.927123 303    20   2   3  0.00000
  23  -6.830796   2.509003   5.173943   !    8.928861 304     6   1   1  0.00000
   8   0.347639  -6.723688  -5.866888   !    8.930242 305    13   2   2  0.00000
   8  -0.461290   8.282312  -3.321966   !    8.935599 306    14   2   2  0.00000
   8   2.562865   6.731692  -5.325274   !    8.957817 307    15   2   2  0.00000
   8   1.736333  -8.454380  -2.477906   !    8.979500 308    19   2   3  0.00000
  23  -3.806641  -7.503000   3.170634   !    8.991021 309     8   1   1  0.00000
  23  -3.806641   7.503000   3.170634   !    8.991021 310     8   1   1  0.00000
   8  -5.700670  -6.723688  -1.860271   !    9.009230 311    13   2   2  0.00000
  23   2.355318  -2.501000   8.352872   !    9.031777 312     5   1   1  0.00000
  23  -2.355318   2.501000  -8.352872   !    9.031777 313     5   1   1  0.00000
  23   2.355318   2.501000   8.352872   !    9.031777 314     5   1   1  0.00000
  23  -2.355318  -2.501000  -8.352872   !    9.031777 315     5   1   1  0.00000
   8  -7.898292  -3.452380  -2.704331   !    9.034122 316    19   2   3  0.00000
   8   8.346803   3.460384  -0.248172   !    9.039079 317    20   2   3  0.00000
   8   7.942338  -4.222688   1.024289   !    9.053231 318    10   2   2  0.00000
   8   7.115806  -4.042616   3.871657   !    9.053572 319    18   2   3  0.00000
   8   7.380177  -0.771308  -5.212061   !    9.067939 320    11   2   2  0.00000
   8   6.711341   3.280312   5.144119   !    9.069978 321    14   2   2  0.00000
   8  -3.485445  -8.274308  -1.318657   !    9.074765 322    15   2   2  0.00000
   8  -7.740596   0.779312   4.804481   !    9.143697 323    10   2   2  0.00000
  23  -8.623954   0.000000   3.057422   !    9.149886 324     4   1   1  0.00000
   8  -1.445518   4.230692  -7.983409   !    9.150033 325    12   2   2  0.00000
  23  -1.344647  -7.503000  -5.069025   !    9.154130 326     8   1   1  0.00000
  23  -1.344647   7.503000  -5.069025   !    9.154130 327     8   1   1  0.00000
   8  -7.071760   1.729692  -5.551700   !    9.155490 328    15   2   2  0.00000
   8   6.553645  -5.953380  -2.364693   !    9.164321 329    17   2   3  0.00000
   8   3.371794  -3.272308  -7.870197   !    9.166078 330    16   2   2  0.00000
   8  -1.130126  -5.773308   7.034214   !    9.169975 331    11   2   2  0.00000
   8  -4.047605   3.280312  -7.555008   !    9.177238 332    14   2   2  0.00000
   8   6.149180   6.731692  -1.092232   !    9.182650 333    15   2   2  0.00000
  23  -0.113650   0.000000  -9.188854   !    9.189557 334     4   1   1  0.00000
  23  -4.368802  -7.494997  -3.065716   !    9.201088 335     6   1   1  0.00000
  23  -4.368802   7.511003  -3.065716   !    9.214131 336     6   1   1  0.00000
   8   0.505336   9.052620   1.641924   !    9.214185 337    17   2   3  0.00000
   8   6.289273   0.779312   6.719026   !    9.236211 338     9   2   2  0.00000
   8   4.760487  -6.543616  -4.481214   !    9.249997 339    20   2   3  0.00000
   8  -9.129289  -0.951380   1.415498   !    9.287232 340    17   2   3  0.00000
   8  -5.947439   1.729692   6.921002   !    9.287848 341    15   2   2  0.00000
   8  -3.749816   3.460384   7.765061   !    9.291478 342    20   2   3  0.00000
  23  -3.137805  -4.993997  -7.185546   !    9.296122 343     2   1   1  0.00000
  23   8.852138  -2.492997   1.393751   !    9.301501 344     6   1   1  0.00000
   8  -6.931667   5.781312   2.259558   !    9.304686 345     9   2   2  0.00000
  23  -3.137805   5.010003  -7.185546   !    9.304731 346     2   1   1  0.00000
  23   8.852138   2.509003   1.393751   !    9.305804 347     6   1   1  0.00000
   8   4.091651  -5.953380   5.874966   !    9.311260 348    17   2   3  0.00000
   8   4.496116   6.731692   4.602504   !    9.312023 349    16   2   2  0.00000
   8   3.933955   8.282312  -1.633846   !    9.313546 350    13   2   2  0.00000
   8  -3.345352   5.781312   6.492600   !    9.314977 351     9   2   2  0.00000
   8  -8.724825  -3.272308   0.143037   !    9.319390 352    16   2   2  0.00000
   8   0.663032  -1.721688   9.150735   !    9.334869 353    14   2   2  0.00000
   8  -1.552194  -3.272308   8.609121   !    9.339929 354    16   2   2  0.00000
   8   3.265119  -0.771308   8.722334   !    9.345321 355    12   2   2  0.00000
   8   2.967330  -5.953380  -6.597735   !    9.368986 356    17   2   3  0.00000
   8   5.587020  -1.721688  -7.328583   !    9.374813 357    14   2   2  0.00000
   8  -6.509599  -6.723688   0.684651   !    9.383582 358    14   2   2  0.00000
   8   1.331868   9.232692  -1.205445   !    9.405826 359    11   2   2  0.00000
  23   7.621141   0.008003   5.513581   !    9.406457 360     2   1   1  0.00000
   8  -1.692287  -9.224688   0.797864   !    9.412507 361    10   2   2  0.00000
   8  -4.874138  -6.543616  -4.707640   !    9.420085 362    20   2   3  0.00000
   8  -8.302757   4.230692  -1.431870   !    9.427872 363    11   2   2  0.00000
   8  -0.883358  -9.224688  -1.747059   !    9.430133 364     9   2   2  0.00000
   8  -4.469673   5.781312  -5.980101   !    9.442624 365     9   2   2  0.00000
   8   1.174172   3.460384  -8.714256   !    9.449402 366    20   2   3  0.00000
   8   0.769707   5.781312  -7.441795   !    9.454963 367    10   2   2  0.00000
  23  -6.161960  -5.002000  -5.182237   !    9.478678 368     4   1   1  0.00000
  23  -6.161960   5.002000  -5.182237   !    9.478678 369     4   1   1  0.00000
   8  -7.493828   4.230692  -3.976793   !    9.480036 370    12   2   2  0.00000
   8  -2.676515  -8.274308  -3.863580   !    9.516048 371    16   2   2  0.00000
  23   6.496820   0.008003  -6.959120   !    9.520404 372     2   1   1  0.00000
   8  -5.138509   6.731692   4.376079   !    9.532577 373    16   2   2  0.00000
   8   1.471961  -6.723688   6.605813   !    9.539990 374    13   2   2  0.00000
   8   2.298493   8.462384   3.758445   !    9.540488 375    20   2   3  0.00000
   8  -1.849983   6.551620  -6.710948   !    9.559445 376    19   2   3  0.00000
   8  -7.071760  -3.272308  -5.551700   !    9.567610 377    15   2   2  0.00000
   8  -6.667295  -0.951380  -6.824161   !    9.587863 378    17   2   3  0.00000
  23   5.265823  -7.494997  -2.839291   !    9.589861 379     6   1   1  0.00000
   8  -3.643141   0.959384  -8.827469   !    9.597765 380    18   2   3  0.00000
  23   5.265823   7.511003  -2.839291   !    9.602376 381     6   1   1  0.00000
   8  -4.311977  -8.454380   1.528711   !    9.612838 382    19   2   3  0.00000
  23  -9.634625   0.000000  -0.226425   !    9.637285 383     1   1   1  0.00000
  23   9.634625   0.000000   0.226425   !    9.637285 384     1   1   1  0.00000
  23   1.572832   0.008003   9.520198   !    9.649250 385     2   1   1  0.00000
  23   2.803829  -7.494997   5.400368   !    9.654036 386     6   1   1  0.00000
   8   5.164952   5.781312  -5.753676   !    9.654278 387     9   2   2  0.00000
  23   2.803829   7.511003   5.400368   !    9.666468 388     6   1   1  0.00000
   8  -5.947439  -3.272308   6.921002   !    9.694343 389    15   2   2  0.00000
   8   3.529490  -9.044616  -0.361385   !    9.715605 390    18   2   3  0.00000
  23  -9.186114   0.008003  -3.178929   !    9.720615 391     2   1   1  0.00000
   8   0.663032   3.280312   9.150735   !    9.743511 392    14   2   2  0.00000
   8  -1.023450   1.729692  -9.558316   !    9.767328 393    15   2   2  0.00000
   8   5.587020   3.280312  -7.328583   !    9.781787 394    14   2   2  0.00000
  23   8.403628   2.501000   4.346255   !    9.786005 395     5   1   1  0.00000
  23   8.403628  -2.501000   4.346255   !    9.786005 396     5   1   1  0.00000
  23  -8.403628  -2.501000  -4.346255   !    9.786005 397     5   1   1  0.00000
  23  -8.403628   2.501000  -4.346255   !    9.786005 398     5   1   1  0.00000
   8   9.173335  -1.721688  -3.095540   !    9.833446 399    14   2   2  0.00000
   8   8.751267  -4.222688  -1.520633   !    9.835045 400     9   2   2  0.00000
   8   7.942338   5.781312   1.024289   !    9.876916 401    10   2   2  0.00000
   8  -5.542974  -5.953380   5.648540   !    9.903197 402    17   2   3  0.00000
   8  -3.080980   9.052620  -2.591119   !    9.907384 403    17   2   3  0.00000
  23   8.289977   2.501000  -4.842599   !    9.921164 404     8   1   1  0.00000
  23   8.289977  -2.501000  -4.842599   !    9.921164 405     8   1   1  0.00000
   8   2.702958  -9.224688   2.485983   !    9.928795 406     9   2   2  0.00000
   8   1.067496   5.961384   7.878274   !    9.937044 407    18   2   3  0.00000
  23  -2.461994  -5.002000   8.239659   !    9.948538 408     1   1   1  0.00000
  23  -2.461994   5.002000   8.239659   !    9.948538 409     1   1   1  0.00000
  23   2.461994  -5.002000  -8.239659   !    9.948538 410     1   1   1  0.00000
  23   2.461994   5.002000  -8.239659   !    9.948538 411     1   1   1  0.00000

 ipr   iapot
   0     1
   1     1
   2     2
   3     3

 ia ib Za Zb   Angle(a,O,b)
  2  3  8  8       98.575
  2  4  8  8       98.396
  2  5  8  8      164.426
  2  6  8  8       89.347
  2  7  8  8       85.428
  3  4  8  8       98.528
  3  5  8  8       94.129
  3  6  8  8       89.482
  3  7  8  8      168.609
  4  5  8  8       88.534
  4  6  8  8      167.858
  4  7  8  8       91.383
  5  6  8  8       81.764
  5  7  8  8       80.453
  6  7  8  8       79.864

 Cluster charge =    0.00000  Vsphere =    0.00000 eV


 ---- Tensor_shape ------------------------------------------------------------------------------------------------------------

  Internal basis, z along c :

  Dipole-dipole matrix shape :

      1  0   2  2   3  3
      2 -2   4  0   5  5
      3 -3   5 -5   6  0

  Dipole-quadrupole matrix shape :

           (1,j,k)                 (2,j,k)                 (3,j,k)
      1  1   2  2   3  3      7  7   8  8   9  9     13 13  14 14  15 15
      2  2   4  4   5  5      8  8  10 10  11 11     14 14  16 16  17 17
      3  3   5  5   6  6      9  9  11 11  12 12     15 15  17 17  18 18

  Quadrupole-quadrupole matrix shape :

          (1,1,k,l)               (1,2,k,l)               (1,3,k,l)
      1  0   2  2   3  3      2 -2   7  0   8  8      3 -3   8 -8  12  0
      2  2   4  4   5  5      7  0   9  9  10 10      8 -8  13 13  14 14
      3  3   5  5   6  6      8  8  10 10  11 11     12  0  14 14  15 15
          (2,1,k,l)               (2,2,k,l)               (2,3,k,l)
      2 -2   7  0   8  8      4 -4   9 -9  13-13      5 -5  10-10  14-14
      7  0   9  9  10 10      9 -9  16  0  17 17     10-10  17-17  19  0
      8  8  10 10  11 11     13-13  17 17  18 18     14-14  19  0  20 20
          (3,1,k,l)               (3,2,k,l)               (3,3,k,l)
      3 -3   8 -8  12  0      5 -5  10-10  14-14      6 -6  11-11  15-15
      8 -8  13 13  14 14     10-10  17-17  19  0     11-11  18-18  20-20
     12  0  14 14  15 15     14-14  19  0  20 20     15-15  20-20  21  0

  Absorbing atom basis :

  Dipole-dipole matrix shape :

      1  0   2  2   3  3
      2 -2   4  0   5  5
      3 -3   5 -5   6  0

  Dipole-quadrupole matrix shape :

           (1,j,k)                 (2,j,k)                 (3,j,k)
      1  1   2  2   3  3      7  7   8  8   9  9     13 13  14 14  15 15
      2  2   4  4   5  5      8  8  10 10  11 11     14 14  16 16  17 17
      3  3   5  5   6  6      9  9  11 11  12 12     15 15  17 17  18 18

  Quadrupole-quadrupole matrix shape :

          (1,1,k,l)               (1,2,k,l)               (1,3,k,l)
      1  0   2  2   3  3      2 -2   7  0   8  8      3 -3   8 -8  12  0
      2  2   4  4   5  5      7  0   9  9  10 10      8 -8  13 13  14 14
      3  3   5  5   6  6      8  8  10 10  11 11     12  0  14 14  15 15
          (2,1,k,l)               (2,2,k,l)               (2,3,k,l)
      2 -2   7  0   8  8      4 -4   9 -9  13-13      5 -5  10-10  14-14
      7  0   9  9  10 10      9 -9  16  0  17 17     10-10  17-17  19  0
      8  8  10 10  11 11     13-13  17 17  18 18     14-14  19  0  20 20
          (3,1,k,l)               (3,2,k,l)               (3,3,k,l)
      3 -3   8 -8  12  0      5 -5  10-10  14-14      6 -6  11-11  15-15
      8 -8  13 13  14 14     10-10  17-17  19  0     11-11  18-18  20-20
     12  0  14 14  15 15     14-14  19  0  20 20     15-15  20-20  21  0

 ldip = ( 1 1 1)

 lqua = ( 1 1 1)
        ( 0 1 1)
        ( 0 0 1)

 ---- Atom_selec ------------------------------------------------------------------------------------------------------

  Rsort =    4.236 A
  nx = 23
  natome =  11, igrpt =   1, Cluster_comp = F, Cluster_mag = T

 ia   Z  it  igr ipr iap     posx      posy      posz   igrpt PtGrName  Atom_comp  Atom_mag         Axe_atom
  1  23   1    1   1   1   0.00000   0.00000   0.00000    1      1         F         T   0.00000   0.00000   1.00000
  2   8   2   11   2   2   1.33187  -0.77131  -1.20544    1      1         F         T   0.00000   0.00000   1.00000
  3   8   2   17   3   3   0.50534  -0.95138   1.64192    1      1         F         T   0.00000   0.00000   1.00000
  4   8   2   16   2   4   0.90980   1.72969   0.36946    1      1         F         T   0.00000   0.00000   1.00000
  5   8   2   10   2   5  -1.69229   0.77931   0.79786    1      1         F         T   0.00000   0.00000   1.00000
  6   8   2   20   3   6  -1.28782  -1.54162  -0.47460    1      1         F         T   0.00000   0.00000   1.00000
  7   8   2    9   2   7  -0.88336   0.77931  -1.74706    1      1         F         T   0.00000   0.00000   1.00000
  8  23   1    4   1   8  -2.57564   0.00000  -0.94920    1      1         F         T   0.00000   0.00000   1.00000
  9  23   1    6   1   9  -0.78249  -2.49300   1.16733    1      1         F         T   0.00000   0.00000  -1.00000
 10  23   1    6   1  10  -0.78249   2.50900   1.16733    1      1         F         T   0.00000   0.00000  -1.00000
 11  23   1    2   1  11   0.44851   0.00800  -2.95250    1      1         F         T   0.00000   0.00000   1.00000

 Atom rotation matrices :

  Atom :      1                       2                       3                       4
     1.000  0.000  0.000     1.000  0.000  0.000     1.000  0.000  0.000     1.000  0.000  0.000
     0.000  1.000  0.000     0.000  1.000  0.000     0.000  1.000  0.000     0.000  1.000  0.000
     0.000  0.000  1.000     0.000  0.000  1.000     0.000  0.000  1.000     0.000  0.000  1.000

  Atom :      5                       6                       7                       8
     1.000  0.000  0.000     1.000  0.000  0.000     1.000  0.000  0.000     1.000  0.000  0.000
     0.000  1.000  0.000     0.000  1.000  0.000     0.000  1.000  0.000     0.000  1.000  0.000
     0.000  0.000  1.000     0.000  0.000  1.000     0.000  0.000  1.000     0.000  0.000  1.000

  Atom :      9                      10                      11
    -1.000  0.000  0.000    -1.000  0.000  0.000     1.000  0.000  0.000
     0.000  1.000  0.000     0.000  1.000  0.000     0.000  1.000  0.000
     0.000  0.000 -1.000     0.000  0.000 -1.000     0.000  0.000  1.000

 Atom  ia_eq  is_eq
   1      1  1
   2      2  1
   3      3  1
   4      4  1
   5      5  1
   6      6  1
   7      7  1
   8      8  1
   9      9  1
  10     10  1
  11     11  1

 Useful representation number  1 :

   Number of the corresponding representation : 1 x 1

   Orbital belonging to the representation :
    0  0  1    0  0  2    1 -1  1    1 -1  2    1  0  1    1  0  2    1  1  1    1  1  2    2 -2  1    2 -2  2    2 -1  1    2 -1  2    2  0  1    2  0  2    2  1  1    2  1  2    2  2  1    2  2  2    3 -3  1    3 -3  2    3 -2  1    3 -2  2    3 -1  1    3 -1  2    3  0  1    3  0  2    3  1  1    3  1  2    3  2  1    3  2  2
    3  3  1    3  3  2

     is  Symmetry    Character
      1        E   1.000  0.000
      1        E   1.000  0.000

 ---- Reseau -----------------------------------------------------------------------------------------------------------

 npr =  1655, npoint =  2007, npso =  2007
 natome =  11

 ---- Raymuf -----------------------------------------------------------------------------------------------------------

 Vrop =    -25.508 eV

 Rmtg : muffin-tin radius
 Rmtsd : Radius for the density of state calculation

 ipr    Rn     Rnorm     Dab     Rdem     Rayop     Rv0     Rmtsd     Rmtg    nrmtg
  1  1.12418  1.41167  1.95496  0.97748  1.23070  1.95496  1.23070  1.23070    484
  2  0.83078  1.04324  1.95496  0.97748  0.92295  1.63057  0.92295  0.92295    469
  3  0.83395  1.04199  1.96377  0.98189  0.92686  1.63057  0.92686  0.92686    469

 ---- Potrmt -----------------------------------------------------------------------------------------------------------

   Z    ch(u)    ch(d)   ch_ion  Vmft(u)  Vmft(d)   Ionic radius
  23   12.522   10.525    3.230  -25.693  -25.323      0.790
   8    3.980    3.980   -2.149  -25.508  -25.508      1.400
   8    3.993    3.993   -2.161  -25.508  -25.508      1.400

 ---- En_dep ------------------------------------------------------------------------------------------------------------

  ia     Z    n  l    E_core   n  l     E_val   zero at infinity
  1     23    3  1    -52.276  4  0    -18.464
  2      8    1  0   -516.425  2  0    -31.954
  3      8    1  0   -516.487  2  0    -32.031

 Starting energy =  -38.261 eV,    zero at  -3.77 eV

 ---- Chg_agr ------------------------------------------------------------------------------------------------------------

 Number of valence electrons =   91.850
 Number of core electrons    =  167.604
 Total                       =  259.454
 Charge from outer sphere    =    3.742
 Sum of atomic number        =  280
 Initial charge              =    0.000
 Cluster charge              =   20.546

 ia   Z     ch_val    ch_core   ch_total     ch_out   Atom charge
  1  23      3.405     17.951     21.355      0.099      1.645
  2   8      5.376      2.000      7.376      0.245      0.624
  3   8      5.400      2.000      7.400      0.248      0.600

chg_level for neutral absorber= 1.850

chg_level for excited absorber= 2.841

 ---- Potcomp ----------------------------------------------------------------------------------------------------------

     VmoyF =   -20.600 eV,      Vmoyc =   -10.087 eV

 ---- Write_state ------------------------------------------------------------------------------------------------------------

 Sum of atomic numbers =  280, Reference charge =   259.454

 Cycle  1,   Fermi energy = -10.511 eV,  Cluster Energy_KS =  -1594.868 eV
         Level val excite = -10.657 eV
         Level val absorb = -10.657 eV

  At the Fermi level :

             ia   Z   Energy_KS      Charge  pop_orb_val(l)   l    Radius
              1  23     -41.968       2.243       2.106       2   1.23070
              2   8    -104.682       0.224       3.790       1   0.92295
              3   8    -105.417       0.204       3.802       1   0.92686

 ---- En_DFT ----------------------------------------------------------------------------------------------------------

 Cluster energy:  -187443.004 eV

  ia    Energ_atom      Energ_KS   delta_En_coeur   Fonc_exc     Fonc_coul      Vxc_int
   1    -20429.846       -41.968         0.000     -1150.591     20758.479     -1521.192
   2     -1999.635      -104.682         0.000      -218.979      1964.331      -288.356
   3     -2001.787      -105.417         0.000      -219.171      1965.805      -288.606

 Sum   -187443.004     -1594.868         0.000    -11833.245    189645.701    -15630.810

 E_cut =  -10.65673 eV

 ---- Agregat ----------------------------------------------------------------------------------------------------------

 Index of the absorbing atom, iaabs =  1

 Point group : 1        (C1   )

 iopsymc =
                                         E :  1
        C3_111, -C3_111, C3_1-11, -C3_1-11 :  0 0 0 0
      C3_-111, -C3_-111, C3_11-1, -C3_11-1 :  0 0 0 0
                   C2_110, C2_-110, C2_101 :  0 0 0
                  C2_-101, C2_011, C2_0-11 :  0 0 0
                             C4x, C4y, C4z :  0 0 0
                          -C4x, -C4y, -C4z :  0 0 0
                             C2x, C2y, C2z :  0 0 0
                                         i :  0
                             S4x, S4y, S4z :  0 0 0
                          -S4x, -S4y, -S4z :  0 0 0
    iC3_111, -iC3_111, iC3_1-11, -iC3_1-11 :  0 0 0 0
  iC3_-111, -iC3_-111, iC3_11-1, -iC3_11-1 :  0 0 0 0
                                mx, my, mz :  0 0 0
                       d_011, d_101, d_110 :  0 0 0
                    d_01-1, d_10-1, d_1-10 :  0 0 0
                      C3z, -C3z, C6z, -C6z :  0 0 0 0
                      S3z, -S3z, S6z, -S6z :  0 0 0 0
              d_030, C2_030, d_060, C2_060 :  0 0 0 0
              d_120, C2_120, d_150, C2_150 :  0 0 0 0

 Character table :
       1
       1                                                                                                                                             

 Symmetry code:
    1        E

 Transformation matrices :
    R1 : internal orthonormal bases with z along c, x along b x c
         but for trigonal symmetry where z is along the hexagonal axis,
         used for the tensorial expansion.
    R2 : internal orthonormal bases used for the electronic structure calculation

 Transformation Crystal Bases - Bases R1 :
    13.61493  0.00000  0.00000
     0.00000  9.45241  0.00000
    -1.61143  0.00000 10.48420

 Transformation Crystal Normalized Bases - Bases R1 :
     0.99307  0.00000  0.00000
     0.00000  1.00000  0.00000
    -0.11754  0.00000  1.00000

 Rotation Bases R1 - Bases R2 :
     0.76299  0.00000 -0.64642
     0.00000 -1.00000  0.00000
    -0.64642  0.00000 -0.76299

 Inverse matrix :
     0.76299  0.00000 -0.64642
     0.00000 -1.00000  0.00000
    -0.64642  0.00000 -0.76299

 Transformation Crystal Bases - Bases R2 :
    11.42965  0.00000 -6.77715
     0.00000 -9.45241  0.00000
    -7.57141  0.00000 -7.99929

 Inverse matrix :
     0.05604  0.00000 -0.04748
     0.00000 -0.10579  0.00000
    -0.05304  0.00000 -0.08007

 Atom positions in order, in the internal R2 bases
   Z      posx       posy       posz          dista    ia   igr ity ipr  chargat
  23   0.000000   0.000000   0.000000   !    0.000000   1     1   0   0  0.00000
   8   1.331868  -0.771308  -1.205445   !    1.954964   2    11   2   2  0.00000
   8   0.505336  -0.951380   1.641924   !    1.963772   3    17   2   3  0.00000
   8   0.909800   1.729692   0.369462   !    1.988988   4    16   2   2  0.00000
   8  -1.692287   0.779312   0.797864   !    2.026758   5    10   2   2  0.00000
   8  -1.287822  -1.541616  -0.474598   !    2.064052   6    20   2   3  0.00000
   8  -0.883358   0.779312  -1.747059   !    2.107098   7     9   2   2  0.00000
  23  -2.575644   0.000000  -0.949195   !    2.744980   8     4   1   1  0.00000
  23  -0.782487  -2.492997   1.167326   !    2.861812   9     6   1   1  0.00000
  23  -0.782487   2.509003   1.167326   !    2.875766  10     6   1   1  0.00000
  23   0.448510   0.008003  -2.952503   !    2.986386  11     2   1   1  0.00000
   8   0.100871   1.729692   2.914385   !    3.390523  12    15   2   2  0.00000
   8   1.736333   1.549620  -2.477906   !    3.399440  13    19   2   3  0.00000
   8   0.909800  -3.272308   0.369462   !    3.416466  14    16   2   2  0.00000
  23   1.010671   0.000000   3.283847   !    3.435856  15     4   1   1  0.00000
  23   2.241668   2.501000  -0.835982   !    3.461061  16     8   1   1  0.00000
  23   2.241668  -2.501000  -0.835982   !    3.461061  17     8   1   1  0.00000
   8  -2.114355  -1.721688   2.372771   !    3.614519  18    13   2   2  0.00000
  23   3.024155   0.008003  -2.003308   !    3.627509  19     3   1   1  0.00000
  23  -3.024155   0.008003   2.003308   !    3.627509  20     3   1   1  0.00000
   8   3.529490   0.959384  -0.361385   !    3.675366  21    18   2   3  0.00000
   8   3.125026  -1.721688   0.911076   !    3.682398  22    14   2   2  0.00000
   8  -1.287822   3.460384  -0.474598   !    3.722631  23    20   2   3  0.00000
  23  -1.793158  -2.492997  -2.116521   !    3.729626  24     7   1   1  0.00000
  23   1.793158  -2.492997   2.116521   !    3.729626  25     7   1   1  0.00000
  23  -1.793158   2.509003  -2.116521   !    3.740344  26     7   1   1  0.00000
  23   1.793158   2.509003   2.116521   !    3.740344  27     7   1   1  0.00000
   8   2.702958   0.779312   2.485983   !    3.754121  28     9   2   2  0.00000
   8  -0.461290  -1.721688  -3.321966   !    3.769941  29    14   2   2  0.00000
   8  -3.907512  -0.771308   0.256250   !    3.991144  30    12   2   2  0.00000
   8  -3.485445   1.729692  -1.318657   !    4.108408  31    15   2   2  0.00000
   8  -3.080980  -0.951380  -2.591119   !    4.136600  32    17   2   3  0.00000
  23   4.034826   0.008003   1.280539   !    4.233162  33     2   1   1  0.00000
   8   0.100871  -3.272308   2.914385   !    4.383129  34    15   2   2  0.00000
   8   2.140797  -0.771308  -3.750367   !    4.386705  35    12   2   2  0.00000
   8   0.505336   4.050620   1.641924   !    4.399863  36    17   2   3  0.00000
   8  -2.518819   0.959384   3.645232   !    4.533496  37    18   2   3  0.00000
   8  -0.321197  -0.771308   4.489292   !    4.566380  38    12   2   2  0.00000
   8  -2.114355   3.280312   2.372771   !    4.567382  39    13   2   2  0.00000
   8   1.736333  -3.452380  -2.477906   !    4.590621  40    19   2   3  0.00000
   8   3.933955  -1.721688  -1.633846   !    4.594526  41    13   2   2  0.00000
   8   1.331868   4.230692  -1.205445   !    4.596272  42    11   2   2  0.00000
   8  -1.692287  -4.222688   0.797864   !    4.618606  43    10   2   2  0.00000
   8   3.125026   3.280312   0.911076   !    4.621287  44    14   2   2  0.00000
   8  -0.883358  -4.222688  -1.747059   !    4.654421  45     9   2   2  0.00000
   8   2.298493  -1.541616   3.758445   !    4.667500  46    20   2   3  0.00000
   8  -0.461290   3.280312  -3.321966   !    4.691342  47    14   2   2  0.00000
   8  -0.056825   0.959384  -4.594427   !    4.693869  48    18   2   3  0.00000
   8  -4.311977   1.549620   1.528711   !    4.830261  49    19   2   3  0.00000
   8  -3.485445  -3.272308  -1.318657   !    4.959353  50    15   2   2  0.00000
  23   1.230997  -2.501000  -4.119829   !    4.974269  51     5   1   1  0.00000
  23  -1.230997   2.501000   4.119829   !    4.974269  52     5   1   1  0.00000
  23  -1.230997  -2.501000   4.119829   !    4.974269  53     5   1   1  0.00000
  23   1.230997   2.501000  -4.119829   !    4.974269  54     5   1   1  0.00000
  23   0.000000   5.002000   0.000000   !    5.002000  55     1   1   1  0.00000
  23   0.000000  -5.002000   0.000000   !    5.002000  56     1   1   1  0.00000
   8  -2.676515   1.729692  -3.863580   !    5.008275  57    16   2   2  0.00000
   8   3.933955   3.280312  -1.633846   !    5.376421  58    13   2   2  0.00000
   8   3.529490  -4.042616  -0.361385   !    5.378722  59    18   2   3  0.00000
  23  -4.817312   2.501000  -0.113213   !    5.429025  60     5   1   1  0.00000
  23   4.817312   2.501000   0.113213   !    5.429025  61     5   1   1  0.00000
  23  -4.817312  -2.501000  -0.113213   !    5.429025  62     5   1   1  0.00000
  23   4.817312  -2.501000   0.113213   !    5.429025  63     5   1   1  0.00000
   8   1.894029   0.779312   5.030906   !    5.431822  64    10   2   2  0.00000
   8   4.356023   0.779312  -3.208753   !    5.466110  65    10   2   2  0.00000
   8  -4.716442  -0.771308   2.801172   !    5.539522  66    11   2   2  0.00000
  23  -3.586315   0.000000  -4.233042   !    5.548000  67     1   1   1  0.00000
  23   3.586315   0.000000   4.233042   !    5.548000  68     1   1   1  0.00000
  23  -3.806641  -2.501000   3.170634   !    5.549634  69     8   1   1  0.00000
  23  -3.806641   2.501000   3.170634   !    5.549634  70     8   1   1  0.00000
   8   2.702958  -4.222688   2.485983   !    5.596177  71     9   2   2  0.00000
   8   2.298493   3.460384   3.758445   !    5.602074  72    20   2   3  0.00000
  23  -2.013484   0.008003   5.287156   !    5.657578  73     2   1   1  0.00000
  23  -5.599799   0.008003   1.054113   !    5.698155  74     2   1   1  0.00000
  23  -2.575644  -5.002000  -0.949195   !    5.705692  75     4   1   1  0.00000
  23  -2.575644   5.002000  -0.949195   !    5.705692  76     4   1   1  0.00000
   8  -3.080980   4.050620  -2.591119   !    5.710854  77    17   2   3  0.00000
   8  -2.676515  -3.272308  -3.863580   !    5.727040  78    16   2   2  0.00000
   8  -4.311977  -3.452380   1.528711   !    5.731408  79    19   2   3  0.00000
   8  -3.907512   4.230692   0.256250   !    5.764813  80    12   2   2  0.00000
   8   5.727113  -0.771308   0.482675   !    5.798940  81    12   2   2  0.00000
  23  -1.344647  -2.501000  -5.069025   !    5.810171  82     8   1   1  0.00000
  23  -1.344647   2.501000  -5.069025   !    5.810171  83     8   1   1  0.00000
   8   5.322648   1.549620   1.755136   !    5.814843  84    19   2   3  0.00000
  23   0.448510  -4.993997  -2.952503   !    5.818801  85     2   1   1  0.00000
   8   4.918183  -0.771308   3.027597   !    5.826645  86    11   2   2  0.00000
  23   0.448510   5.010003  -2.952503   !    5.832544  87     2   1   1  0.00000
  23  -4.368802  -2.492997  -3.065716   !    5.890677  88     6   1   1  0.00000
  23  -4.368802   2.509003  -3.065716   !    5.897469  89     6   1   1  0.00000
   8  -2.254447  -0.771308  -5.438487   !    5.937558  90    11   2   2  0.00000
   8  -2.923284  -1.721688   4.917693   !    5.974404  91    14   2   2  0.00000
   8  -2.518819  -4.042616   3.645232   !    5.997909  92    18   2   3  0.00000
   8  -0.725662   1.549620   5.761753   !    6.010466  93    19   2   3  0.00000
   8   2.140797   4.230692  -3.750367   !    6.045413  94    12   2   2  0.00000
   8   1.331868  -5.773308  -1.205445   !    6.046326  95    11   2   2  0.00000
  23   3.472665   0.000000  -4.955812   !    6.051403  96     4   1   1  0.00000
  23   1.010671  -5.002000   3.283847   !    6.068370  97     4   1   1  0.00000
  23   1.010671   5.002000   3.283847   !    6.068370  98     4   1   1  0.00000
   8  -1.692287   5.781312   0.797864   !    6.076511  99    10   2   2  0.00000
   8  -0.883358   5.781312  -1.747059   !    6.103777 100     9   2   2  0.00000
   8  -0.056825  -4.042616  -4.594427   !    6.120027 101    18   2   3  0.00000
   8   0.347639  -1.721688  -5.866888   !    6.124169 102    13   2   2  0.00000
   8   2.562865   1.729692  -5.325274   !    6.157812 103    15   2   2  0.00000
  23  -3.024155  -4.993997   2.003308   !    6.172419 104     3   1   1  0.00000
  23   3.024155  -4.993997  -2.003308   !    6.172419 105     3   1   1  0.00000
   8  -0.321197   4.230692   4.489292   !    6.177027 106    12   2   2  0.00000
  23  -3.024155   5.010003   2.003308   !    6.185377 107     3   1   1  0.00000
  23   3.024155   5.010003  -2.003308   !    6.185377 108     3   1   1  0.00000
   8   0.505336  -5.953380   1.641924   !    6.196290 109    17   2   3  0.00000
   8  -6.105135   0.959384  -0.587810   !    6.207947 110    18   2   3  0.00000
   8  -5.700670  -1.721688  -1.860271   !    6.238787 111    13   2   2  0.00000
  23  -0.562161   0.008003  -6.236351   !    6.261642 112     3   1   1  0.00000
  23   0.562161   0.008003   6.236351   !    6.261642 113     3   1   1  0.00000
   8  -5.278602   0.779312  -3.435178   !    6.345977 114    10   2   2  0.00000
   8   6.149180   1.729692  -1.092232   !    6.480526 115    15   2   2  0.00000
  23   5.265823  -2.492997  -2.839291   !    6.481165 116     6   1   1  0.00000
  23   5.265823   2.509003  -2.839291   !    6.487338 117     6   1   1  0.00000
  23   4.034826  -4.993997   1.280539   !    6.546725 118     2   1   1  0.00000
  23   4.034826   5.010003   1.280539   !    6.558943 119     2   1   1  0.00000
  23   2.803829  -2.492997   5.400368   !    6.575748 120     6   1   1  0.00000
  23   2.803829   2.509003   5.400368   !    6.581833 121     6   1   1  0.00000
   8   5.322648  -3.452380   1.755136   !    6.582554 122    19   2   3  0.00000
   8  -2.923284   3.280312   4.917693   !    6.594675 123    14   2   2  0.00000
   8   4.496116   1.729692   4.602504   !    6.662577 124    16   2   2  0.00000
   8  -1.287822  -6.543616  -0.474598   !    6.686004 125    20   2   3  0.00000
   8   4.760487  -1.541616  -4.481214   !    6.717150 126    20   2   3  0.00000
   8   0.347639   3.280312  -5.866888   !    6.730652 127    13   2   2  0.00000
   8   2.562865  -3.272308  -5.325274   !    6.755355 128    15   2   2  0.00000
   8  -0.725662  -3.452380   5.761753   !    6.755984 129    19   2   3  0.00000
   8  -6.509599  -1.721688   0.684651   !    6.768149 130    14   2   2  0.00000
   8   0.909800   6.731692   0.369462   !    6.802934 131    16   2   2  0.00000
   8  -5.700670   3.280312  -1.860271   !    6.835107 132    13   2   2  0.00000
   8   1.894029  -4.222688   5.030906   !    6.835822 133    10   2   2  0.00000
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   8  -1.130126  -5.773308   7.034214   !    9.169975 331    11   2   2  0.00000
   8  -4.047605   3.280312  -7.555008   !    9.177238 332    14   2   2  0.00000
   8   6.149180   6.731692  -1.092232   !    9.182650 333    15   2   2  0.00000
  23  -0.113650   0.000000  -9.188854   !    9.189557 334     4   1   1  0.00000
  23  -4.368802  -7.494997  -3.065716   !    9.201088 335     6   1   1  0.00000
  23  -4.368802   7.511003  -3.065716   !    9.214131 336     6   1   1  0.00000
   8   0.505336   9.052620   1.641924   !    9.214185 337    17   2   3  0.00000
   8   6.289273   0.779312   6.719026   !    9.236211 338     9   2   2  0.00000
   8   4.760487  -6.543616  -4.481214   !    9.249997 339    20   2   3  0.00000
   8  -9.129289  -0.951380   1.415498   !    9.287232 340    17   2   3  0.00000
   8  -5.947439   1.729692   6.921002   !    9.287848 341    15   2   2  0.00000
   8  -3.749816   3.460384   7.765061   !    9.291478 342    20   2   3  0.00000
  23  -3.137805  -4.993997  -7.185546   !    9.296122 343     2   1   1  0.00000
  23   8.852138  -2.492997   1.393751   !    9.301501 344     6   1   1  0.00000
   8  -6.931667   5.781312   2.259558   !    9.304686 345     9   2   2  0.00000
  23  -3.137805   5.010003  -7.185546   !    9.304731 346     2   1   1  0.00000
  23   8.852138   2.509003   1.393751   !    9.305804 347     6   1   1  0.00000
   8   4.091651  -5.953380   5.874966   !    9.311260 348    17   2   3  0.00000
   8   4.496116   6.731692   4.602504   !    9.312023 349    16   2   2  0.00000
   8   3.933955   8.282312  -1.633846   !    9.313546 350    13   2   2  0.00000
   8  -3.345352   5.781312   6.492600   !    9.314977 351     9   2   2  0.00000
   8  -8.724825  -3.272308   0.143037   !    9.319390 352    16   2   2  0.00000
   8   0.663032  -1.721688   9.150735   !    9.334869 353    14   2   2  0.00000
   8  -1.552194  -3.272308   8.609121   !    9.339929 354    16   2   2  0.00000
   8   3.265119  -0.771308   8.722334   !    9.345321 355    12   2   2  0.00000
   8   2.967330  -5.953380  -6.597735   !    9.368986 356    17   2   3  0.00000
   8   5.587020  -1.721688  -7.328583   !    9.374813 357    14   2   2  0.00000
   8  -6.509599  -6.723688   0.684651   !    9.383582 358    14   2   2  0.00000
   8   1.331868   9.232692  -1.205445   !    9.405826 359    11   2   2  0.00000
  23   7.621141   0.008003   5.513581   !    9.406457 360     2   1   1  0.00000
   8  -1.692287  -9.224688   0.797864   !    9.412507 361    10   2   2  0.00000
   8  -4.874138  -6.543616  -4.707640   !    9.420085 362    20   2   3  0.00000
   8  -8.302757   4.230692  -1.431870   !    9.427872 363    11   2   2  0.00000
   8  -0.883358  -9.224688  -1.747059   !    9.430133 364     9   2   2  0.00000
   8  -4.469673   5.781312  -5.980101   !    9.442624 365     9   2   2  0.00000
   8   1.174172   3.460384  -8.714256   !    9.449402 366    20   2   3  0.00000
   8   0.769707   5.781312  -7.441795   !    9.454963 367    10   2   2  0.00000
  23  -6.161960  -5.002000  -5.182237   !    9.478678 368     4   1   1  0.00000
  23  -6.161960   5.002000  -5.182237   !    9.478678 369     4   1   1  0.00000
   8  -7.493828   4.230692  -3.976793   !    9.480036 370    12   2   2  0.00000
   8  -2.676515  -8.274308  -3.863580   !    9.516048 371    16   2   2  0.00000
  23   6.496820   0.008003  -6.959120   !    9.520404 372     2   1   1  0.00000
   8  -5.138509   6.731692   4.376079   !    9.532577 373    16   2   2  0.00000
   8   1.471961  -6.723688   6.605813   !    9.539990 374    13   2   2  0.00000
   8   2.298493   8.462384   3.758445   !    9.540488 375    20   2   3  0.00000
   8  -1.849983   6.551620  -6.710948   !    9.559445 376    19   2   3  0.00000
   8  -7.071760  -3.272308  -5.551700   !    9.567610 377    15   2   2  0.00000
   8  -6.667295  -0.951380  -6.824161   !    9.587863 378    17   2   3  0.00000
  23   5.265823  -7.494997  -2.839291   !    9.589861 379     6   1   1  0.00000
   8  -3.643141   0.959384  -8.827469   !    9.597765 380    18   2   3  0.00000
  23   5.265823   7.511003  -2.839291   !    9.602376 381     6   1   1  0.00000
   8  -4.311977  -8.454380   1.528711   !    9.612838 382    19   2   3  0.00000
  23  -9.634625   0.000000  -0.226425   !    9.637285 383     1   1   1  0.00000
  23   9.634625   0.000000   0.226425   !    9.637285 384     1   1   1  0.00000
  23   1.572832   0.008003   9.520198   !    9.649250 385     2   1   1  0.00000
  23   2.803829  -7.494997   5.400368   !    9.654036 386     6   1   1  0.00000
   8   5.164952   5.781312  -5.753676   !    9.654278 387     9   2   2  0.00000
  23   2.803829   7.511003   5.400368   !    9.666468 388     6   1   1  0.00000
   8  -5.947439  -3.272308   6.921002   !    9.694343 389    15   2   2  0.00000
   8   3.529490  -9.044616  -0.361385   !    9.715605 390    18   2   3  0.00000
  23  -9.186114   0.008003  -3.178929   !    9.720615 391     2   1   1  0.00000
   8   0.663032   3.280312   9.150735   !    9.743511 392    14   2   2  0.00000
   8  -1.023450   1.729692  -9.558316   !    9.767328 393    15   2   2  0.00000
   8   5.587020   3.280312  -7.328583   !    9.781787 394    14   2   2  0.00000
  23   8.403628   2.501000   4.346255   !    9.786005 395     5   1   1  0.00000
  23   8.403628  -2.501000   4.346255   !    9.786005 396     5   1   1  0.00000
  23  -8.403628  -2.501000  -4.346255   !    9.786005 397     5   1   1  0.00000
  23  -8.403628   2.501000  -4.346255   !    9.786005 398     5   1   1  0.00000
   8   9.173335  -1.721688  -3.095540   !    9.833446 399    14   2   2  0.00000
   8   8.751267  -4.222688  -1.520633   !    9.835045 400     9   2   2  0.00000
   8   7.942338   5.781312   1.024289   !    9.876916 401    10   2   2  0.00000
   8  -5.542974  -5.953380   5.648540   !    9.903197 402    17   2   3  0.00000
   8  -3.080980   9.052620  -2.591119   !    9.907384 403    17   2   3  0.00000
  23   8.289977   2.501000  -4.842599   !    9.921164 404     8   1   1  0.00000
  23   8.289977  -2.501000  -4.842599   !    9.921164 405     8   1   1  0.00000
   8   2.702958  -9.224688   2.485983   !    9.928795 406     9   2   2  0.00000
   8   1.067496   5.961384   7.878274   !    9.937044 407    18   2   3  0.00000
  23  -2.461994  -5.002000   8.239659   !    9.948538 408     1   1   1  0.00000
  23  -2.461994   5.002000   8.239659   !    9.948538 409     1   1   1  0.00000
  23   2.461994  -5.002000  -8.239659   !    9.948538 410     1   1   1  0.00000
  23   2.461994   5.002000  -8.239659   !    9.948538 411     1   1   1  0.00000

 ipr   iapot
   0     1
   1     1
   2     2
   3     3

 ia ib Za Zb   Angle(a,O,b)
  2  3  8  8       98.575
  2  4  8  8       98.396
  2  5  8  8      164.426
  2  6  8  8       89.347
  2  7  8  8       85.428
  3  4  8  8       98.528
  3  5  8  8       94.129
  3  6  8  8       89.482
  3  7  8  8      168.609
  4  5  8  8       88.534
  4  6  8  8      167.858
  4  7  8  8       91.383
  5  6  8  8       81.764
  5  7  8  8       80.453
  6  7  8  8       79.864

 Cluster charge =    0.00000  Vsphere =    0.00000 eV


 ---- Tensor_shape ------------------------------------------------------------------------------------------------------------

  Internal basis, z along c :

  Dipole-dipole matrix shape :

      1  0   2  2   3  3
      2 -2   4  0   5  5
      3 -3   5 -5   6  0

  Dipole-quadrupole matrix shape :

           (1,j,k)                 (2,j,k)                 (3,j,k)
      1  1   2  2   3  3      7  7   8  8   9  9     13 13  14 14  15 15
      2  2   4  4   5  5      8  8  10 10  11 11     14 14  16 16  17 17
      3  3   5  5   6  6      9  9  11 11  12 12     15 15  17 17  18 18

  Quadrupole-quadrupole matrix shape :

          (1,1,k,l)               (1,2,k,l)               (1,3,k,l)
      1  0   2  2   3  3      2 -2   7  0   8  8      3 -3   8 -8  12  0
      2  2   4  4   5  5      7  0   9  9  10 10      8 -8  13 13  14 14
      3  3   5  5   6  6      8  8  10 10  11 11     12  0  14 14  15 15
          (2,1,k,l)               (2,2,k,l)               (2,3,k,l)
      2 -2   7  0   8  8      4 -4   9 -9  13-13      5 -5  10-10  14-14
      7  0   9  9  10 10      9 -9  16  0  17 17     10-10  17-17  19  0
      8  8  10 10  11 11     13-13  17 17  18 18     14-14  19  0  20 20
          (3,1,k,l)               (3,2,k,l)               (3,3,k,l)
      3 -3   8 -8  12  0      5 -5  10-10  14-14      6 -6  11-11  15-15
      8 -8  13 13  14 14     10-10  17-17  19  0     11-11  18-18  20-20
     12  0  14 14  15 15     14-14  19  0  20 20     15-15  20-20  21  0

  Absorbing atom basis :

  Dipole-dipole matrix shape :

      1  0   2  2   3  3
      2 -2   4  0   5  5
      3 -3   5 -5   6  0

  Dipole-quadrupole matrix shape :

           (1,j,k)                 (2,j,k)                 (3,j,k)
      1  1   2  2   3  3      7  7   8  8   9  9     13 13  14 14  15 15
      2  2   4  4   5  5      8  8  10 10  11 11     14 14  16 16  17 17
      3  3   5  5   6  6      9  9  11 11  12 12     15 15  17 17  18 18

  Quadrupole-quadrupole matrix shape :

          (1,1,k,l)               (1,2,k,l)               (1,3,k,l)
      1  0   2  2   3  3      2 -2   7  0   8  8      3 -3   8 -8  12  0
      2  2   4  4   5  5      7  0   9  9  10 10      8 -8  13 13  14 14
      3  3   5  5   6  6      8  8  10 10  11 11     12  0  14 14  15 15
          (2,1,k,l)               (2,2,k,l)               (2,3,k,l)
      2 -2   7  0   8  8      4 -4   9 -9  13-13      5 -5  10-10  14-14
      7  0   9  9  10 10      9 -9  16  0  17 17     10-10  17-17  19  0
      8  8  10 10  11 11     13-13  17 17  18 18     14-14  19  0  20 20
          (3,1,k,l)               (3,2,k,l)               (3,3,k,l)
      3 -3   8 -8  12  0      5 -5  10-10  14-14      6 -6  11-11  15-15
      8 -8  13 13  14 14     10-10  17-17  19  0     11-11  18-18  20-20
     12  0  14 14  15 15     14-14  19  0  20 20     15-15  20-20  21  0

 ldip = ( 1 1 1)

 lqua = ( 1 1 1)
        ( 0 1 1)
        ( 0 0 1)

 Absorption before the edge :
 Site  Z      fpp (per atom)
   1  23  4.52024E-01
   2   8  7.20921E-02
   3   8  7.20921E-02

 Total :  1.07068E+02 nbr. of electron

 ---- Prepdafs ---------------------------------------------------------------------------------------------------------

  (h,k,l) ThetaBragg  d_hkl (A)    Polarization angles        poldafse     vecdafse       poldafss     vecdafss

  1  1  1    20.811     3.193     0.000   0.000   0.000  -0.00614 0.00000   0.04538  -0.00614 0.00000   0.07207
                                                          0.07441 0.00000  -0.05493   0.07441 0.00000  -0.00694
                                                         -0.06827 0.00000  -0.04934  -0.06827 0.00000  -0.00624

  1  1  1    20.811     3.193     0.000   0.000  90.000   0.06282 0.00000  -0.00761   0.06282 0.00000   0.01908
                                                         -0.03309 0.00000  -0.09355  -0.03309 0.00000  -0.04556
                                                         -0.02973 0.00000   0.04227  -0.02973 0.00000   0.08537

  1  1  1    20.811     3.193     0.000  90.000   0.000  -0.00614 0.00000   0.04538   0.01278 0.00000   0.07207
                                                          0.07441 0.00000  -0.05493   0.07488 0.00000  -0.00694
                                                         -0.06827 0.00000  -0.04934   0.06727 0.00000  -0.00624

  1  1  1    20.811     3.193     0.000  90.000  90.000   0.06282 0.00000  -0.00761   0.03292 0.00000   0.01908
                                                         -0.03309 0.00000  -0.09355   0.08956 0.00000  -0.04556
                                                         -0.02973 0.00000   0.04227   0.03245 0.00000   0.08537


  (h,k,l)  exp(i*Q.R_ia) (ia = 1,natomsym)
  1  1  1  -6.19341E-01 -7.85122E-01  -6.19341E-01  7.85122E-01   6.27202E-01  7.78857E-01   6.27202E-01 -7.78857E-01   6.19341E-01  7.85122E-01   6.19341E-01 -7.85122E-01  -6.27202E-01 -7.78857E-01  -6.27202E-01  7.78857E-01
  1  1  1  -6.19341E-01 -7.85122E-01  -6.19341E-01  7.85122E-01   6.27202E-01  7.78857E-01   6.27202E-01 -7.78857E-01   6.19341E-01  7.85122E-01   6.19341E-01 -7.85122E-01  -6.27202E-01 -7.78857E-01  -6.27202E-01  7.78857E-01
  1  1  1  -6.19341E-01 -7.85122E-01  -6.19341E-01  7.85122E-01   6.27202E-01  7.78857E-01   6.27202E-01 -7.78857E-01   6.19341E-01  7.85122E-01   6.19341E-01 -7.85122E-01  -6.27202E-01 -7.78857E-01  -6.27202E-01  7.78857E-01
  1  1  1  -6.19341E-01 -7.85122E-01  -6.19341E-01  7.85122E-01   6.27202E-01  7.78857E-01   6.27202E-01 -7.78857E-01   6.19341E-01  7.85122E-01   6.19341E-01 -7.85122E-01  -6.27202E-01 -7.78857E-01  -6.27202E-01  7.78857E-01

 Attenuation factor for non resonant magnetic structure factor :
      General : fma =  1.000
      Orbital : Site    L/2S     (f_orb = (L/S)*f_spin)
                  1   -0.300
                  2    0.000
                  3    0.000

 Value of the structure factors per atom site :

 Site =  1, Z = 23

  (h,k,l)      f0              fp          fpp           f_spin         f_orb          Ph = Sum(exp(iQR))          Ph*f0*(eps_e.eps_s)    Ph*(fp+i*fpp)*(eps_e.eps_s) i*Ph_m*fma*(f_spin*vs+f_orb*vo)   vs = spin.vec_b             vo = spin.vec_a
  1  1  1  1.84309E+01    0.00000E+00  0.00000E+00   -7.59886E-03    4.55932E-03   -5.55112E-16 -1.11022E-15   -1.02312E-14 -2.04624E-14    0.00000E+00  0.00000E+00    6.50521E-18 -9.40557E-05   -3.93615E-01  0.00000E+00   -4.00609E-17  0.00000E+00
  1  1  1  1.84309E+01    0.00000E+00  0.00000E+00   -7.59886E-03    4.55932E-03   -5.55112E-16 -1.11022E-15   -1.02312E-14 -2.04624E-14    0.00000E+00  0.00000E+00   -2.71051E-18  3.77509E-05    1.57984E-01  0.00000E+00   -1.05676E-16  0.00000E+00
  1  1  1  1.84309E+01    0.00000E+00  0.00000E+00   -7.59886E-03    4.55932E-03   -5.55112E-16 -1.11022E-15   -2.27179E-30 -4.54357E-30    0.00000E+00  0.00000E+00   -3.07642E-18  4.37462E-05    1.28965E-02  0.00000E+00   -2.83630E-01  0.00000E+00
  1  1  1  1.84309E+01    0.00000E+00  0.00000E+00   -7.59886E-03    4.55932E-03   -5.55112E-16 -1.11022E-15   -9.93906E-31 -1.98781E-30    0.00000E+00  0.00000E+00   -1.02999E-18  1.17394E-05   -7.08198E-02  0.00000E+00   -1.99913E-01  0.00000E+00

 Site =  2, Z =  8

  (h,k,l)      f0              fp          fpp           f_spin         f_orb          Ph = Sum(exp(iQR))          Ph*f0*(eps_e.eps_s)    Ph*(fp+i*fpp)*(eps_e.eps_s) i*Ph_m*fma*(f_spin*vs+f_orb*vo)   vs = spin.vec_b             vo = spin.vec_a
  1  1  1  6.36137E+00    8.82405E-02  7.17275E-02    0.00000E+00    0.00000E+00   -8.60423E-16  7.77156E-16   -5.47347E-15  4.94378E-15   -1.31668E-16  6.86069E-18    0.00000E+00  0.00000E+00   -3.93615E-01  0.00000E+00   -4.00609E-17  0.00000E+00
  1  1  1  6.36137E+00    8.82405E-02  7.17275E-02    0.00000E+00    0.00000E+00   -8.60423E-16  7.77156E-16   -5.47347E-15  4.94378E-15   -1.31668E-16  6.86069E-18    0.00000E+00  0.00000E+00    1.57984E-01  0.00000E+00   -1.05676E-16  0.00000E+00
  1  1  1  6.36137E+00    8.82405E-02  7.17275E-02    0.00000E+00    0.00000E+00   -8.60423E-16  7.77156E-16   -1.21535E-30  1.09774E-30   -2.92361E-32  1.52338E-33    0.00000E+00  0.00000E+00    1.28965E-02  0.00000E+00   -2.83630E-01  0.00000E+00
  1  1  1  6.36137E+00    8.82405E-02  7.17275E-02    0.00000E+00    0.00000E+00   -8.60423E-16  7.77156E-16   -5.31717E-31  4.80261E-31   -1.27908E-32  6.66479E-34    0.00000E+00  0.00000E+00   -7.08198E-02  0.00000E+00   -1.99913E-01  0.00000E+00

 Site =  3, Z =  8

  (h,k,l)      f0              fp          fpp           f_spin         f_orb          Ph = Sum(exp(iQR))          Ph*f0*(eps_e.eps_s)    Ph*(fp+i*fpp)*(eps_e.eps_s) i*Ph_m*fma*(f_spin*vs+f_orb*vo)   vs = spin.vec_b             vo = spin.vec_a
  1  1  1  6.36137E+00    8.82405E-02  7.17275E-02    0.00000E+00    0.00000E+00    0.00000E+00 -3.55271E-15    0.00000E+00 -2.26001E-14    2.54827E-16 -3.13493E-16    0.00000E+00  0.00000E+00   -3.93615E-01  0.00000E+00   -4.00609E-17  0.00000E+00
  1  1  1  6.36137E+00    8.82405E-02  7.17275E-02    0.00000E+00    0.00000E+00    0.00000E+00 -3.55271E-15    0.00000E+00 -2.26001E-14    2.54827E-16 -3.13493E-16    0.00000E+00  0.00000E+00    1.57984E-01  0.00000E+00   -1.05676E-16  0.00000E+00
  1  1  1  6.36137E+00    8.82405E-02  7.17275E-02    0.00000E+00    0.00000E+00    0.00000E+00 -3.55271E-15    0.00000E+00 -5.01823E-30    5.65830E-32 -6.96095E-32    0.00000E+00  0.00000E+00    1.28965E-02  0.00000E+00   -2.83630E-01  0.00000E+00
  1  1  1  6.36137E+00    8.82405E-02  7.17275E-02    0.00000E+00    0.00000E+00    0.00000E+00 -3.55271E-15    0.00000E+00 -2.19548E-30    2.47551E-32 -3.04542E-32    0.00000E+00  0.00000E+00   -7.08198E-02  0.00000E+00   -1.99913E-01  0.00000E+00

  (h,k,l)   Total Structure factor
  1  1  1 -1.55750E-14   -9.40557E-05
  1  1  1 -1.55842E-14    3.77509E-05
  1  1  1 -3.07642E-18    4.37462E-05
  1  1  1 -1.02999E-18    1.17394E-05

 ---- Polond ---------------------------------------------------------------------------------------------------------

  Polarization and wave vectors in the internal basis R1 ( orthogonal basis, z along c crystal )

         ple            voe           pls            vos        type      weight_d weight_q

  0.76299  0.00000   0.00000   0.76299  0.00000   0.00000   xanes rectil  0.33333  0.20000
  0.00000  0.00000  -1.00000   0.00000  0.00000  -1.00000
 -0.64642  0.00000   0.00000  -0.64642  0.00000   0.00000

  0.53951  0.00000   0.53951   0.53951  0.00000   0.53951   xanes rectil  0.00000  0.13333
 -0.70711  0.00000   0.70711  -0.70711  0.00000   0.70711
 -0.45709  0.00000  -0.45709  -0.45709  0.00000  -0.45709

  0.00000  0.00000  -0.64642   0.00000  0.00000  -0.64642   xanes rectil  0.33333  0.20000
 -1.00000  0.00000   0.00000  -1.00000  0.00000   0.00000
  0.00000  0.00000  -0.76299   0.00000  0.00000  -0.76299

 -0.45709  0.00000   0.45709  -0.45709  0.00000   0.45709   xanes rectil  0.00000  0.13333
 -0.70711  0.00000  -0.70711  -0.70711  0.00000  -0.70711
 -0.53951  0.00000   0.53951  -0.53951  0.00000   0.53951

 -0.64642  0.00000   0.76299  -0.64642  0.00000   0.76299   xanes rectil  0.33333  0.20000
  0.00000  0.00000   0.00000   0.00000  0.00000   0.00000
 -0.76299  0.00000  -0.64642  -0.76299  0.00000  -0.64642

  0.08243  0.00000  -0.99660   0.08243  0.00000  -0.99660   xanes rectil  0.00000  0.13333
  0.00000  0.00000   0.00000   0.00000  0.00000   0.00000
 -0.99660  0.00000  -0.08243  -0.99660  0.00000  -0.08243

 -0.08355  0.00000   0.61790  -0.08355  0.00000   0.98119   dafs rectil 
  0.70336  0.00000  -0.51919   0.70336  0.00000  -0.06564
 -0.70591  0.00000  -0.59045  -0.70591  0.00000  -0.18153

  0.85535  0.00000  -0.10355   0.85535  0.00000   0.25974   dafs rectil 
 -0.31282  0.00000  -0.88425  -0.31282  0.00000  -0.43069
 -0.41293  0.00000   0.45539  -0.41293  0.00000   0.86431

 -0.08355  0.00000   0.61790   0.17401  0.00000   0.98119   dafs rectil 
  0.70336  0.00000  -0.51919   0.70780  0.00000  -0.06564
 -0.70591  0.00000  -0.59045   0.68465  0.00000  -0.18153

  0.85535  0.00000  -0.10355   0.44822  0.00000   0.25974   dafs rectil 
 -0.31282  0.00000  -0.88425   0.84655  0.00000  -0.43069
 -0.41293  0.00000   0.45539   0.28714  0.00000   0.86431

 ---- Atom_selec ------------------------------------------------------------------------------------------------------

  Rsort =    4.236 A
  nx = 23
  natome =  11, igrpt =   1, Cluster_comp = F, Cluster_mag = T

 ia   Z  it  igr ipr iap     posx      posy      posz   igrpt PtGrName  Atom_comp  Atom_mag         Axe_atom
  1  23   0    1   0   1   0.00000   0.00000   0.00000    1      1         F         T   0.00000   0.00000   1.00000
  2   8   2   11   2   2   1.33187  -0.77131  -1.20544    1      1         F         T   0.00000   0.00000   1.00000
  3   8   2   17   3   3   0.50534  -0.95138   1.64192    1      1         F         T   0.00000   0.00000   1.00000
  4   8   2   16   2   4   0.90980   1.72969   0.36946    1      1         F         T   0.00000   0.00000   1.00000
  5   8   2   10   2   5  -1.69229   0.77931   0.79786    1      1         F         T   0.00000   0.00000   1.00000
  6   8   2   20   3   6  -1.28782  -1.54162  -0.47460    1      1         F         T   0.00000   0.00000   1.00000
  7   8   2    9   2   7  -0.88336   0.77931  -1.74706    1      1         F         T   0.00000   0.00000   1.00000
  8  23   1    4   1   8  -2.57564   0.00000  -0.94920    1      1         F         T   0.00000   0.00000   1.00000
  9  23   1    6   1   9  -0.78249  -2.49300   1.16733    1      1         F         T   0.00000   0.00000  -1.00000
 10  23   1    6   1  10  -0.78249   2.50900   1.16733    1      1         F         T   0.00000   0.00000  -1.00000
 11  23   1    2   1  11   0.44851   0.00800  -2.95250    1      1         F         T   0.00000   0.00000   1.00000

 Atom rotation matrices :

  Atom :      1                       2                       3                       4
     1.000  0.000  0.000     1.000  0.000  0.000     1.000  0.000  0.000     1.000  0.000  0.000
     0.000  1.000  0.000     0.000  1.000  0.000     0.000  1.000  0.000     0.000  1.000  0.000
     0.000  0.000  1.000     0.000  0.000  1.000     0.000  0.000  1.000     0.000  0.000  1.000

  Atom :      5                       6                       7                       8
     1.000  0.000  0.000     1.000  0.000  0.000     1.000  0.000  0.000     1.000  0.000  0.000
     0.000  1.000  0.000     0.000  1.000  0.000     0.000  1.000  0.000     0.000  1.000  0.000
     0.000  0.000  1.000     0.000  0.000  1.000     0.000  0.000  1.000     0.000  0.000  1.000

  Atom :      9                      10                      11
    -1.000  0.000  0.000    -1.000  0.000  0.000     1.000  0.000  0.000
     0.000  1.000  0.000     0.000  1.000  0.000     0.000  1.000  0.000
     0.000  0.000 -1.000     0.000  0.000 -1.000     0.000  0.000  1.000

 Atom  ia_eq  is_eq
   1      1  1
   2      2  1
   3      3  1
   4      4  1
   5      5  1
   6      6  1
   7      7  1
   8      8  1
   9      9  1
  10     10  1
  11     11  1

 ---- Etafin -----------------------------------------------------------------------------------------------------------

 Useful representation number  1 :

   Number of the corresponding representation : 1 x 1

   Orbital belonging to the representation :
    1  1  2    1 -1  2    1  1  1    1 -1  1    1  0  2    1  0  1    0  0  2    2  0  2    2  2  2    2 -2  2    0  0  1    2  0  1    2  2  1    2 -2  1    2  1  2    2 -1  2    2  1  1    2 -1  1

     is  Symmetry    Character
      1        E   1.000  0.000
      1        E   1.000  0.000

 ---- Reseau -----------------------------------------------------------------------------------------------------------

 npr =  1655, npoint =  2007, npso =  2007
 natome =  11

 ---- Raymuf -----------------------------------------------------------------------------------------------------------

 Vrop =    -25.130 eV

 Rmtg : muffin-tin radius
 Rmtsd : Radius for the density of state calculation

 ipr    Rn     Rnorm     Dab     Rdem     Rayop     Rv0     Rmtsd     Rmtg    nrmtg
  0  1.12109  1.40257  1.95496  0.97748  1.21991  1.69209  1.21991  1.21991    484
  1  1.41167  1.41167  1.95496  0.97748  1.26339  1.95496  1.26339  1.26339    486
  2  0.83388  1.04324  1.95496  0.97748  0.93926  1.78876  0.93926  0.93926    470
  3  0.83706  1.04199  1.96377  0.98189  0.94360  1.72372  0.94360  0.94360    470

 ---- Potrmt -----------------------------------------------------------------------------------------------------------

   Z    ch(u)    ch(d)   ch_ion  Vmft(u)  Vmft(d)   Ionic radius
  23*  12.417   10.400    3.149  -25.280  -24.979      0.790
  23   12.516   10.525    3.230  -25.286  -24.973      0.790
   8    3.982    3.982   -2.149  -25.130  -25.130      1.400
   8    3.995    3.995   -2.161  -25.130  -25.130      1.400

 ---- Potcomp ----------------------------------------------------------------------------------------------------------

     VmoyF =   -20.260 eV,      Vmoyc =    -9.769 eV

     Epsii =  5318.723 eV,  psi*psi =  0.982

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -16.00000 eV

 Vmoy = -20.14402 eV, Vmftabs(up) = -25.34667 eV, Vmftabs(dn) = -25.03835 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -4.939E-05   2.616E-02   4.035E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -3.211E-05   1.700E-02   2.622E-03
  1 -1    1  1    -5.750E-02   1.740E+00   1.659E-01
  1 -1    1  2     6.917E-03  -2.071E-01  -1.952E-02
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -1.723E-02   5.245E-01   5.035E-02
  1  0    1  1    -4.572E-02   1.387E+00   1.327E-01
  1  0    1  2     6.005E-03  -1.798E-01  -1.695E-02
  1  0    2  1     6.842E-03  -2.009E-01  -1.852E-02
  1  0    2  2    -1.951E-02   5.913E-01   5.651E-02
  1  1    1  1    -3.668E-02   1.116E+00   1.072E-01
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     5.940E-03  -1.744E-01  -1.608E-02
  1  1    2  2    -2.118E-02   6.404E-01   6.104E-02
  2 -2    1  1     7.838E-03  -3.893E-01  -6.272E-02
  2 -2    1  2    -4.410E-05   1.947E-03   2.853E-04
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     7.354E-03  -3.658E-01  -5.899E-02
  2 -1    1  1     7.815E-03  -3.883E-01  -6.257E-02
  2 -1    1  2    -5.400E-05   2.384E-03   3.493E-04
  2 -1    2  1    -4.463E-05   1.960E-03   2.859E-04
  2 -1    2  2     7.375E-03  -3.667E-01  -5.913E-02
  2  0    1  1     7.792E-03  -3.872E-01  -6.242E-02
  2  0    1  2    -5.399E-05   2.384E-03   3.493E-04
  2  0    2  1    -5.465E-05   2.401E-03   3.501E-04
  2  0    2  2     7.396E-03  -3.676E-01  -5.926E-02
  2  1    1  1     7.768E-03  -3.862E-01  -6.227E-02
  2  1    1  2    -4.408E-05   1.946E-03   2.852E-04
  2  1    2  1    -5.464E-05   2.401E-03   3.501E-04
  2  1    2  2     7.418E-03  -3.685E-01  -5.940E-02
  2  2    1  1     7.745E-03  -3.852E-01  -6.212E-02
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -4.461E-05   1.960E-03   2.858E-04
  2  2    2  2     7.439E-03  -3.695E-01  -5.953E-02

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  1.5875267570E-02  0.0000000000E+00 -2.0194408643E-03 -1.6675361948E-04 -4.6210433505E-03  1.1389316190E-04
 -2.0194408643E-03  1.6675361948E-04  6.9358617687E-03 -1.4835561072E-36  1.1406030953E-03 -1.2361175204E-04
 -4.6210433505E-03 -1.1389316190E-04  1.1406030953E-03  1.2361175204E-04  1.5129427542E-02  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
 -4.2901996216E-03  3.7472066600E-05  2.3080697139E-03 -9.7629712783E-06  9.5703064830E-04  4.2723993845E-05
  2.3080697139E-03 -9.7629712783E-06  1.6005645366E-03  6.5588297195E-05 -6.7396011878E-04 -2.6290837479E-05
  9.5703064830E-04  4.2723993845E-05 -6.7396011878E-04 -2.6290837479E-05 -2.3742889009E-03 -5.2867429359E-05

 Tensor_dq(2,ks,j2), prototypical atom
  8.1819611583E-04 -3.4325753090E-05  2.0375586400E-04  3.1328906724E-05  1.3517851212E-03 -4.6151003295E-05
  2.0375586400E-04  3.1328906724E-05 -1.9112674552E-03 -2.6439140876E-05  1.8526736056E-03  8.1877815080E-06
  1.3517851212E-03 -4.6151003295E-05  1.8526736056E-03  8.1877815080E-06  1.6315539866E-03  5.7068450714E-05

 Tensor_dq(3,ks,j2), prototypical atom
  1.6325254024E-03  4.9257723357E-05  7.4077128687E-04 -2.7980720815E-05 -1.1920501322E-03  5.5386698410E-05
  7.4077128687E-04 -2.7980720815E-05  1.6217226824E-03 -3.8851934971E-05  1.7876787456E-04  5.8414776358E-05
 -1.1920501322E-03  5.5386698410E-05  1.7876787456E-04  5.8414776358E-05  3.9925177482E-03  2.0854733206E-05

 Tensor_qq(ke,je,1,1), prototypical atom
  1.3457339187E-03 -2.6725370927E-21 -6.1662517444E-04  5.0586971776E-06  4.7880388676E-07  1.9782915129E-05
 -6.1662517444E-04  5.0586971776E-06 -2.0976605885E-04  2.4423080395E-05  2.1418561326E-04 -2.8221527662E-06
  4.7880388676E-07  1.9782915129E-05  2.1418561326E-04 -2.8221527662E-06  5.9250781973E-04 -1.4596306109E-05

 Tensor_qq(ke,je,2,1), prototypical atom
 -6.1662517444E-04 -5.0586971776E-06  5.3809728455E-04  0.0000000000E+00  6.8949211829E-05 -4.0859067800E-06
  5.3809728455E-04 -4.8643002597E-23  2.4211916836E-04 -9.4910762512E-06  4.1887927608E-05  5.5917692668E-07
  6.8949211829E-05 -4.0859067800E-06  4.1887927608E-05  5.5917692668E-07  1.3662440098E-04  9.7438624786E-08

 Tensor_qq(ke,je,3,1), prototypical atom
  4.7880388676E-07 -1.9782915129E-05  6.8949211829E-05  4.0859067800E-06  8.8258723964E-04  1.3362685464E-21
  6.8949211829E-05  4.0859067800E-06  4.2024124477E-05  2.8557509923E-05  2.8800245308E-04 -9.0501035421E-06
  8.8258723964E-04  0.0000000000E+00  2.8800245308E-04 -9.0501035421E-06 -4.1929519882E-04 -1.4099995873E-05

 Tensor_qq(ke,je,1,2), prototypical atom
 -6.1662517444E-04 -5.0586971776E-06  5.3809728455E-04 -4.1758392073E-23  6.8949211829E-05 -4.0859067800E-06
  5.3809728455E-04 -9.0401394671E-23  2.4211916836E-04 -9.4910762512E-06  4.1887927608E-05  5.5917692668E-07
  6.8949211829E-05 -4.0859067800E-06  4.1887927608E-05  5.5917692668E-07  1.3662440098E-04  9.7438624786E-08

 Tensor_qq(ke,je,2,2), prototypical atom
 -2.0976605885E-04 -2.4423080395E-05  2.4211916836E-04  9.4910762512E-06  4.2024124477E-05 -2.8557509923E-05
  2.4211916836E-04  9.4910762512E-06  1.6252146265E-03 -2.5962231877E-37 -6.6848598061E-04 -4.9400364501E-06
  4.2024124477E-05 -2.8557509923E-05 -6.6848598061E-04 -4.9400364501E-06 -4.4967383387E-04  1.5436716442E-05

 Tensor_qq(ke,je,3,2), prototypical atom
  2.1418561326E-04  2.8221527662E-06  4.1887927608E-05 -5.5917692668E-07  2.8800245308E-04  9.0501035421E-06
  4.1887927608E-05 -5.5917692668E-07 -6.6848598061E-04  4.9400364501E-06  5.5663700932E-04 -2.2563236136E-23
  2.8800245308E-04  9.0501035421E-06  5.5663700932E-04  4.1758392073E-23  4.8280820308E-04 -6.0752489005E-06

 Tensor_qq(ke,je,1,3), prototypical atom
  4.7880388676E-07 -1.9782915129E-05  6.8949211829E-05  4.0859067800E-06  8.8258723964E-04  0.0000000000E+00
  6.8949211829E-05  4.0859067800E-06  4.2024124477E-05  2.8557509923E-05  2.8800245308E-04 -9.0501035421E-06
  8.8258723964E-04  0.0000000000E+00  2.8800245308E-04 -9.0501035421E-06 -4.1929519882E-04 -1.4099995873E-05

 Tensor_qq(ke,je,2,3), prototypical atom
  2.1418561326E-04  2.8221527662E-06  4.1887927608E-05 -5.5917692668E-07  2.8800245308E-04  9.0501035421E-06
  4.1887927608E-05 -5.5917692668E-07 -6.6848598061E-04  4.9400364501E-06  5.5663700932E-04  1.0271194008E-22
  2.8800245308E-04  9.0501035421E-06  5.5663700932E-04  1.2527517622E-22  4.8280820308E-04 -6.0752489005E-06

 Tensor_qq(ke,je,3,3), prototypical atom
  5.9250781973E-04  1.4596306109E-05  1.3662440098E-04 -9.7438624786E-08 -4.1929519882E-04  1.4099995873E-05
  1.3662440098E-04 -9.7438624786E-08 -4.4967383387E-04 -1.5436716442E-05  4.8280820308E-04  6.0752489005E-06
 -4.1929519882E-04  1.4099995873E-05  4.8280820308E-04  6.0752489005E-06  1.6385932901E-03  1.3362685464E-21

 Crystal Tensor_dd(ke,ks) (Mbarn)
  1.2700214056E-01  0.0000000000E+00  0.0000000000E+00  5.4210108624E-20 -3.6968346804E-02  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  5.5486894150E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -3.6968346804E-02  0.0000000000E+00  0.0000000000E+00 -5.4210108624E-20  1.2103542034E-01  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  1.0765871349E-02  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21  3.8304310940E-06  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -1.6781284708E-03  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22
  3.8304310940E-06  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22  4.7400625578E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  0.0000000000E+00  4.3047782764E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  4.3047782764E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  3.3510342087E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  3.3510342087E-04  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23

 Crystal Tensor_qq(ke,je,3,1)
  3.8304310940E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  7.0606979172E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  3.3619299582E-04  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
  7.0606979172E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -3.3543615905E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  0.0000000000E+00  4.3047782764E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  4.3047782764E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  3.3510342087E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  3.3510342087E-04  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23

 Crystal Tensor_qq(ke,je,2,2)
 -1.6781284708E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  3.3619299582E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.3001717012E-02  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21
  3.3619299582E-04  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21 -3.5973906710E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00 -8.4703294725E-22  3.3510342087E-04  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
  3.3510342087E-04  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21  4.4530960745E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  4.4530960745E-03  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21

 Crystal Tensor_qq(ke,je,1,3)
  3.8304310940E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  7.0606979172E-03  0.0000000000E+00
  0.0000000000E+00  1.6940658945E-21  3.3619299582E-04  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21
  7.0606979172E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21 -3.3543615905E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00 -8.4703294725E-22  3.3510342087E-04  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
  3.3510342087E-04  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21  4.4530960745E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  4.4530960745E-03  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21

 Crystal Tensor_qq(ke,je,3,3)
  4.7400625578E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -3.3543615905E-03  0.0000000000E+00
  0.0000000000E+00  2.6469779602E-23 -3.5973906710E-03  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21
 -3.3543615905E-03  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21  1.3108746321E-02  0.0000000000E+00

 Convertion factor =  77.98094 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -16.000  1.65011E-01  1.17356E-01  6.02086E-02  7.86694E-02  9.12989E-02  1.33573E-01  1.06833E-01
   dip-dip  1.60975E-01  1.08231E-01  5.54869E-02  7.12748E-02  8.70626E-02  1.27150E-01  1.01175E-01
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  4.03620E-03  9.12485E-03  4.72167E-03  7.39462E-03  4.23630E-03  6.42302E-03  5.65783E-03

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -2.08685E-16  1.39384E-03 -3.40553E-16  1.20902E-03  9.66075E-17 -7.94405E-04 -8.17521E-17  7.80675E-03
   dip-dip -1.91642E-16  3.04108E-16 -3.21119E-16  4.85765E-16  8.17488E-17  9.96266E-04 -7.60415E-17  6.20869E-03
   dip-qua -2.23146E-18 -1.39580E-18 -5.81083E-18 -1.25615E-17  1.05718E-17 -4.75051E-18 -8.69080E-18 -6.57445E-17
   qua-qua -1.48119E-17  1.39384E-03 -1.36229E-17  1.20902E-03  4.28697E-18 -1.79067E-03  2.98019E-18  1.59807E-03

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -15.90000 eV

 Vmoy = -20.14500 eV, Vmftabs(up) = -25.34830 eV, Vmftabs(dn) = -25.03998 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -4.586E-05   2.429E-02   3.747E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -3.001E-05   1.589E-02   2.451E-03
  1 -1    1  1    -4.824E-02   1.460E+00   1.392E-01
  1 -1    1  2     5.802E-03  -1.737E-01  -1.637E-02
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -1.445E-02   4.399E-01   4.223E-02
  1  0    1  1    -3.836E-02   1.164E+00   1.113E-01
  1  0    1  2     5.037E-03  -1.508E-01  -1.421E-02
  1  0    2  1     5.739E-03  -1.685E-01  -1.554E-02
  1  0    2  2    -1.636E-02   4.959E-01   4.739E-02
  1  1    1  1    -3.077E-02   9.366E-01   8.990E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     4.982E-03  -1.463E-01  -1.349E-02
  1  1    2  2    -1.776E-02   5.371E-01   5.119E-02
  2 -2    1  1     5.848E-03  -2.904E-01  -4.679E-02
  2 -2    1  2    -3.293E-05   1.454E-03   2.131E-04
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     5.485E-03  -2.728E-01  -4.400E-02
  2 -1    1  1     5.830E-03  -2.897E-01  -4.668E-02
  2 -1    1  2    -4.033E-05   1.781E-03   2.610E-04
  2 -1    2  1    -3.333E-05   1.464E-03   2.136E-04
  2 -1    2  2     5.501E-03  -2.735E-01  -4.410E-02
  2  0    1  1     5.813E-03  -2.889E-01  -4.657E-02
  2  0    1  2    -4.032E-05   1.781E-03   2.609E-04
  2  0    2  1    -4.082E-05   1.793E-03   2.616E-04
  2  0    2  2     5.517E-03  -2.742E-01  -4.420E-02
  2  1    1  1     5.796E-03  -2.881E-01  -4.645E-02
  2  1    1  2    -3.292E-05   1.454E-03   2.130E-04
  2  1    2  1    -4.081E-05   1.793E-03   2.615E-04
  2  1    2  2     5.533E-03  -2.749E-01  -4.430E-02
  2  2    1  1     5.778E-03  -2.874E-01  -4.634E-02
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -3.332E-05   1.464E-03   2.135E-04
  2  2    2  2     5.549E-03  -2.756E-01  -4.440E-02

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  3.7093430466E-03  0.0000000000E+00 -2.4277625012E-04  6.6159899375E-06 -3.9681401140E-03  6.4618436344E-06
 -2.4277625012E-04 -6.6159899375E-06  1.1593514933E-03  0.0000000000E+00  3.4998197949E-04 -6.6756308654E-06
 -3.9681401140E-03 -6.4618436344E-06  3.4998197949E-04  6.6756308654E-06  1.0278697679E-02  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
 -8.8933464771E-04  5.6614320198E-06  2.2200981592E-04  1.1751391438E-06  1.3602665520E-04  7.4082551089E-07
  2.2200981592E-04  1.1751391438E-06 -7.4587816549E-04 -1.8378382814E-07 -4.4429265470E-05  6.5646267605E-07
  1.3602665520E-04  7.4082551089E-07 -4.4429265470E-05  6.5646267605E-07 -8.7000964289E-04  5.6235393886E-06

 Tensor_dq(2,ks,j2), prototypical atom
 -1.5081793581E-05 -4.1151033142E-06 -4.6530868573E-05  5.5692253822E-07  1.5919529045E-04 -3.8278356383E-06
 -4.6530868573E-05  5.5692253822E-07 -7.8639081834E-05 -3.8234218756E-06  6.1416006702E-05  1.1487519948E-06
  1.5919529045E-04 -3.8278356383E-06  6.1416006702E-05  1.1487519948E-06  2.4917052152E-04  3.0496057105E-06

 Tensor_dq(3,ks,j2), prototypical atom
  1.8612071305E-03  5.1210699198E-06  6.9860621988E-05 -2.5406569717E-06  4.4056197586E-05  3.6495016738E-06
  6.9860621988E-05 -2.5406569717E-06  2.0099320397E-03 -2.4589011298E-07 -1.7888028630E-04  8.7859519922E-07
  4.4056197586E-05  3.6495016738E-06 -1.7888028630E-04  8.7859519922E-07  1.8196497235E-03 -3.0534315645E-06

 Tensor_qq(ke,je,1,1), prototypical atom
  4.5558800729E-04 -4.1759158423E-23 -6.4670625169E-06  1.0972126439E-06  4.4453251271E-05  6.7243471040E-07
 -6.4670625169E-06  1.0972126439E-06  4.1994014541E-04  2.8340516822E-06 -2.6735750242E-05  1.7280320428E-07
  4.4453251271E-05  6.7243471040E-07 -2.6735750242E-05  1.7280320428E-07  2.7173935489E-04  3.5998639611E-07

 Tensor_qq(ke,je,2,1), prototypical atom
 -6.4670625169E-06 -1.0972126439E-06  5.0936622648E-05  0.0000000000E+00 -5.1637646838E-06  2.4963610075E-07
  5.0936622648E-05 -4.6933648318E-26 -3.4540249745E-07  7.7517890260E-08 -4.6836167667E-06  1.4294216003E-08
 -5.1637646838E-06  2.4963610075E-07 -4.6836167667E-06  1.4294216003E-08 -8.5960392421E-06 -4.1673141995E-07

 Tensor_qq(ke,je,3,1), prototypical atom
  4.4453251271E-05 -6.7243471040E-07 -5.1637646838E-06 -2.4963610075E-07  1.8127499627E-04  0.0000000000E+00
 -5.1637646838E-06 -2.4963610075E-07  1.2387809505E-04  2.5187919990E-06 -1.6668218441E-05 -2.6315191219E-08
  1.8127499627E-04 -4.1759158423E-23 -1.6668218441E-05 -2.6315191219E-08 -1.0353952427E-04 -1.0919739135E-06

 Tensor_qq(ke,je,1,2), prototypical atom
 -6.4670625169E-06 -1.0972126439E-06  5.0936622648E-05 -1.3049737007E-24 -5.1637646838E-06  2.4963610075E-07
  5.0936622648E-05 -4.6933648318E-26 -3.4540249745E-07  7.7517890260E-08 -4.6836167667E-06  1.4294216003E-08
 -5.1637646838E-06  2.4963610075E-07 -4.6836167667E-06  1.4294216003E-08 -8.5960392421E-06 -4.1673141995E-07

 Tensor_qq(ke,je,2,2), prototypical atom
  4.1994014541E-04 -2.8340516822E-06 -3.4540249745E-07 -7.7517890260E-08  1.2387809505E-04 -2.5187919990E-06
 -3.4540249745E-07 -7.7517890260E-08  6.2900406585E-04  0.0000000000E+00 -5.8717218993E-05  1.0300892227E-06
  1.2387809505E-04 -2.5187919990E-06 -5.8717218993E-05  1.0300892227E-06  2.1637982761E-04  1.6934553533E-06

 Tensor_qq(ke,je,3,2), prototypical atom
 -2.6735750242E-05 -1.7280320428E-07 -4.6836167667E-06 -1.4294216003E-08 -1.6668218441E-05  2.6315191219E-08
 -4.6836167667E-06 -1.4294216003E-08 -5.8717218993E-05 -1.0300892227E-06  5.1812721486E-05 -6.1262763541E-25
 -1.6668218441E-05  2.6315191219E-08  5.1812721486E-05  0.0000000000E+00 -1.0801963115E-05  2.2945240505E-07

 Tensor_qq(ke,je,1,3), prototypical atom
  4.4453251271E-05 -6.7243471040E-07 -5.1637646838E-06 -2.4963610075E-07  1.8127499627E-04  0.0000000000E+00
 -5.1637646838E-06 -2.4963610075E-07  1.2387809505E-04  2.5187919990E-06 -1.6668218441E-05 -2.6315191219E-08
  1.8127499627E-04  0.0000000000E+00 -1.6668218441E-05 -2.6315191219E-08 -1.0353952427E-04 -1.0919739135E-06

 Tensor_qq(ke,je,2,3), prototypical atom
 -2.6735750242E-05 -1.7280320428E-07 -4.6836167667E-06 -1.4294216003E-08 -1.6668218441E-05  2.6315191219E-08
 -4.6836167667E-06 -1.4294216003E-08 -5.8717218993E-05 -1.0300892227E-06  5.1812721486E-05 -6.1262763541E-25
 -1.6668218441E-05  2.6315191219E-08  5.1812721486E-05  0.0000000000E+00 -1.0801963115E-05  2.2945240505E-07

 Tensor_qq(ke,je,3,3), prototypical atom
  2.7173935489E-04 -3.5998639611E-07 -8.5960392421E-06  4.1673141995E-07 -1.0353952427E-04  1.0919739135E-06
 -8.5960392421E-06  4.1673141995E-07  2.1637982761E-04 -1.6934553533E-06 -1.0801963115E-05 -2.2945240505E-07
 -1.0353952427E-04  1.0919739135E-06 -1.0801963115E-05 -2.2945240505E-07  5.0828734765E-04  0.0000000000E+00

 Crystal Tensor_dd(ke,ks) (Mbarn)
  2.9674744372E-02  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21 -3.1745120912E-02  0.0000000000E+00
  0.0000000000E+00  1.6940658945E-21  9.2748119466E-03  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21
 -3.1745120912E-02  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21  8.2229581432E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  3.6447040583E-03  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22  3.5562601017E-04  0.0000000000E+00
  0.0000000000E+00 -4.2351647363E-22  3.3595211633E-03  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23
  3.5562601017E-04  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23  2.1739148391E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  0.0000000000E+00  4.0749298118E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22
  4.0749298118E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -3.7468934134E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -3.7468934134E-05  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22

 Crystal Tensor_qq(ke,je,3,1)
  3.5562601017E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.4501999702E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  9.9102476037E-04  0.0000000000E+00  0.0000000000E+00 -6.6174449004E-24
  1.4501999702E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -8.2831619413E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  0.0000000000E+00  4.0749298118E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  4.0749298118E-04  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23 -3.7468934134E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -3.7468934134E-05  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22

 Crystal Tensor_qq(ke,je,2,2)
  3.3595211633E-03  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23  9.9102476037E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  5.0320325268E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  9.9102476037E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.7310386209E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00 -5.2939559203E-23 -3.7468934134E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -3.7468934134E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.1450177189E-04  0.0000000000E+00
  0.0000000000E+00  6.6174449004E-24  4.1450177189E-04  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23

 Crystal Tensor_qq(ke,je,1,3)
  3.5562601017E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22  1.4501999702E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  9.9102476037E-04  0.0000000000E+00  0.0000000000E+00 -6.6174449004E-24
  1.4501999702E-03  0.0000000000E+00  0.0000000000E+00  6.6174449004E-24 -8.2831619413E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00 -5.2939559203E-23 -3.7468934134E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -3.7468934134E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.1450177189E-04  0.0000000000E+00
  0.0000000000E+00 -6.6174449004E-24  4.1450177189E-04  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23

 Crystal Tensor_qq(ke,je,3,3)
  2.1739148391E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -8.2831619413E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.7310386209E-03  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23
 -8.2831619413E-04  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23  4.0662987812E-03  0.0000000000E+00

 Convertion factor =  77.98237 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -15.900  8.33961E-02  4.76911E-02  9.64943E-03  1.96349E-02  3.00047E-02  8.83299E-02  4.12127E-02
   dip-dip  8.29487E-02  4.61118E-02  9.27481E-03  1.91152E-02  2.89556E-02  8.70880E-02  4.03930E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  4.47381E-04  1.57932E-03  3.74613E-04  5.19715E-04  1.04911E-03  1.24188E-03  8.19676E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -8.15707E-17  1.17079E-04 -1.11960E-16  8.17714E-05  5.15288E-17 -8.53615E-05  3.97624E-19  4.65193E-04
   dip-dip -8.15239E-17  1.54249E-16 -1.09884E-16  2.08783E-16  4.86296E-17  5.85447E-05  6.06262E-18  3.41348E-04
   dip-qua  2.94827E-18 -1.81055E-18  8.72199E-19  2.17751E-19  8.09826E-19  1.73255E-19 -5.58732E-18 -2.81944E-18
   qua-qua -2.99512E-18  1.17079E-04 -2.94844E-18  8.17714E-05  2.08940E-18 -1.43906E-04 -7.76742E-20  1.23845E-04

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -15.80000 eV

 Vmoy = -20.14604 eV, Vmftabs(up) = -25.34991 eV, Vmftabs(dn) = -25.04160 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -4.308E-05   2.282E-02   3.520E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -2.838E-05   1.502E-02   2.318E-03
  1 -1    1  1    -4.189E-02   1.267E+00   1.209E-01
  1 -1    1  2     5.036E-03  -1.508E-01  -1.421E-02
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -1.255E-02   3.819E-01   3.666E-02
  1  0    1  1    -3.330E-02   1.010E+00   9.664E-02
  1  0    1  2     4.372E-03  -1.309E-01  -1.234E-02
  1  0    2  1     4.981E-03  -1.463E-01  -1.348E-02
  1  0    2  2    -1.420E-02   4.305E-01   4.114E-02
  1  1    1  1    -2.672E-02   8.132E-01   7.807E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     4.324E-03  -1.270E-01  -1.170E-02
  1  1    2  2    -1.542E-02   4.662E-01   4.443E-02
  2 -2    1  1     4.622E-03  -2.295E-01  -3.698E-02
  2 -2    1  2    -2.605E-05   1.151E-03   1.686E-04
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     4.334E-03  -2.156E-01  -3.477E-02
  2 -1    1  1     4.608E-03  -2.289E-01  -3.689E-02
  2 -1    1  2    -3.191E-05   1.409E-03   2.065E-04
  2 -1    2  1    -2.637E-05   1.159E-03   1.690E-04
  2 -1    2  2     4.347E-03  -2.161E-01  -3.485E-02
  2  0    1  1     4.594E-03  -2.283E-01  -3.680E-02
  2  0    1  2    -3.190E-05   1.409E-03   2.065E-04
  2  0    2  1    -3.230E-05   1.419E-03   2.070E-04
  2  0    2  2     4.359E-03  -2.167E-01  -3.493E-02
  2  1    1  1     4.581E-03  -2.277E-01  -3.671E-02
  2  1    1  2    -2.605E-05   1.150E-03   1.686E-04
  2  1    2  1    -3.229E-05   1.419E-03   2.070E-04
  2  1    2  2     4.372E-03  -2.172E-01  -3.501E-02
  2  2    1  1     4.567E-03  -2.271E-01  -3.663E-02
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -2.636E-05   1.158E-03   1.690E-04
  2  2    2  2     4.384E-03  -2.178E-01  -3.509E-02

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  4.4699445359E-03  0.0000000000E+00 -5.8333456074E-04  1.7020794131E-05 -2.2023002835E-03  1.4664534870E-05
 -5.8333456074E-04 -1.7020794131E-05  2.4472985404E-03 -2.9672211193E-37  3.5562189588E-04 -1.3729696184E-05
 -2.2023002835E-03 -1.4664534870E-05  3.5562189588E-04  1.3729696184E-05  8.9713159018E-03  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
 -4.9980492020E-04 -5.3124368940E-06  3.2814203895E-04 -4.5944742151E-07  1.0341931079E-06 -2.3429937023E-05
  3.2814203895E-04 -4.5944742151E-07 -9.7989628586E-04 -2.5069405073E-05 -3.0935825994E-04  1.0250690077E-06
  1.0341931079E-06 -2.3429937023E-05 -3.0935825994E-04  1.0250690077E-06 -2.5967204769E-04  2.3734365326E-05

 Tensor_dq(2,ks,j2), prototypical atom
 -3.7199207989E-04 -1.7578748053E-06 -3.8435768258E-04  3.4214252047E-07  3.2620806310E-04  1.7992765338E-05
 -3.8435768258E-04  3.4214252047E-07  1.1192571227E-04  1.7673717407E-05 -3.1006603503E-05  1.6315324470E-06
  3.2620806310E-04  1.7992765338E-05 -3.1006603503E-05  1.6315324470E-06  4.0017576865E-04 -1.3797165915E-05

 Tensor_dq(3,ks,j2), prototypical atom
  1.2026286666E-03 -4.0105335607E-06  6.9328500428E-05 -4.1368123182E-06  2.5162148412E-05 -9.7411320935E-06
  6.9328500428E-05 -4.1368123182E-06  1.0238417424E-03 -6.8847417254E-06 -3.1662793073E-04  5.2255099825E-06
  2.5162148412E-05 -9.7411320935E-06 -3.1662793073E-04  5.2255099825E-06  1.6366286966E-03  9.3677680831E-06

 Tensor_qq(ke,je,1,1), prototypical atom
  4.4172517141E-04 -1.5659971790E-23  1.1552630887E-04  2.7304206679E-06  4.5668147454E-05  6.7642041822E-08
  1.1552630887E-04  2.7304206679E-06  2.5893253391E-04  1.2522904581E-06  3.4806233625E-06  1.0052344591E-06
  4.5668147454E-05  6.7642041822E-08  3.4806233625E-06  1.0052344591E-06  1.6539585942E-05 -1.1693698686E-06

 Tensor_qq(ke,je,2,1), prototypical atom
  1.1552630887E-04 -2.7304206679E-06  1.3002551045E-04  8.3519849545E-23 -4.0896581671E-05  7.5175057481E-07
  1.3002551045E-04  4.2049576442E-23 -4.7902482381E-05  2.1402904767E-06 -3.3010525114E-06  5.4072883132E-07
 -4.0896581671E-05  7.5175057481E-07 -3.3010525114E-06  5.4072883132E-07 -7.3007812283E-05  2.5690366802E-07

 Tensor_qq(ke,je,3,1), prototypical atom
  4.5668147454E-05 -6.7642041822E-08 -4.0896581671E-05 -7.5175057481E-07  3.1487999247E-04  0.0000000000E+00
 -4.0896581671E-05 -7.5175057481E-07  1.6419275404E-04 -7.2619031269E-07 -6.1555171393E-05  1.2581333350E-06
  3.1487999247E-04  3.1319943580E-23 -6.1555171393E-05  1.2581333350E-06 -1.3770863113E-04 -1.9000573005E-06

 Tensor_qq(ke,je,1,2), prototypical atom
  1.1552630887E-04 -2.7304206679E-06  1.3002551045E-04  4.1759924773E-23 -4.0896581671E-05  7.5175057481E-07
  1.3002551045E-04  2.8965166965E-25 -4.7902482381E-05  2.1402904767E-06 -3.3010525114E-06  5.4072883132E-07
 -4.0896581671E-05  7.5175057481E-07 -3.3010525114E-06  5.4072883132E-07 -7.3007812283E-05  2.5690366802E-07

 Tensor_qq(ke,je,2,2), prototypical atom
  2.5893253391E-04 -1.2522904581E-06 -4.7902482381E-05 -2.1402904767E-06  1.6419275404E-04  7.2619031269E-07
 -4.7902482381E-05 -2.1402904767E-06  5.0758772519E-04  7.8816810982E-38  5.5880553208E-05  2.2909439588E-06
  1.6419275404E-04  7.2619031269E-07  5.5880553208E-05  2.2909439588E-06  3.7841210605E-06 -1.0689258939E-06

 Tensor_qq(ke,je,3,2), prototypical atom
  3.4806233625E-06 -1.0052344591E-06 -3.3010525114E-06 -5.4072883132E-07 -6.1555171393E-05 -1.2581333350E-06
 -3.3010525114E-06 -5.4072883132E-07  5.5880553208E-05 -2.2909439588E-06  1.2636016471E-04 -1.2967891494E-23
 -6.1555171393E-05 -1.2581333350E-06  1.2636016471E-04  0.0000000000E+00 -9.8914543551E-05  2.9803233802E-06

 Tensor_qq(ke,je,1,3), prototypical atom
  4.5668147454E-05 -6.7642041822E-08 -4.0896581671E-05 -7.5175057481E-07  3.1487999247E-04  1.6703969909E-22
 -4.0896581671E-05 -7.5175057481E-07  1.6419275404E-04 -7.2619031269E-07 -6.1555171393E-05  1.2581333350E-06
  3.1487999247E-04  1.4093974611E-22 -6.1555171393E-05  1.2581333350E-06 -1.3770863113E-04 -1.9000573005E-06

 Tensor_qq(ke,je,2,3), prototypical atom
  3.4806233625E-06 -1.0052344591E-06 -3.3010525114E-06 -5.4072883132E-07 -6.1555171393E-05 -1.2581333350E-06
 -3.3010525114E-06 -5.4072883132E-07  5.5880553208E-05 -2.2909439588E-06  1.2636016471E-04  2.8792033279E-23
 -6.1555171393E-05 -1.2581333350E-06  1.2636016471E-04  4.1759924773E-23 -9.8914543551E-05  2.9803233802E-06

 Tensor_qq(ke,je,3,3), prototypical atom
  1.6539585942E-05  1.1693698686E-06 -7.3007812283E-05 -2.5690366802E-07 -1.3770863113E-04  1.9000573005E-06
 -7.3007812283E-05 -2.5690366802E-07  3.7841210605E-06  1.0689258939E-06 -9.8914543551E-05 -2.9803233802E-06
 -1.3770863113E-04  1.9000573005E-06 -9.8914543551E-05 -2.9803233802E-06  5.8418947439E-04 -1.6703969909E-22

 Crystal Tensor_dd(ke,ks) (Mbarn)
  3.5759556287E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -1.7618402268E-02  0.0000000000E+00
  0.0000000000E+00  6.7762635780E-21  1.9578388323E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -1.7618402268E-02  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21  7.1770527215E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  3.5338013713E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  3.6534517963E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.0714602713E-03  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22
  3.6534517963E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22  1.3231668754E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  0.0000000000E+00  1.0402040836E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.0402040836E-03  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22 -2.6408420091E-05  0.0000000000E+00
  0.0000000000E+00 -2.1175823681E-22 -2.6408420091E-05  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22

 Crystal Tensor_qq(ke,je,3,1)
  3.6534517963E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22  2.5190399398E-03  0.0000000000E+00
  0.0000000000E+00  2.1175823681E-22  1.3135420324E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  2.5190399398E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -1.1016690490E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  0.0000000000E+00  1.0402040836E-03  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22
  1.0402040836E-03  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22 -2.6408420091E-05  0.0000000000E+00
  0.0000000000E+00 -2.1175823681E-22 -2.6408420091E-05  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22

 Crystal Tensor_qq(ke,je,2,2)
  2.0714602713E-03  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22  1.3135420324E-03  0.0000000000E+00
  0.0000000000E+00  8.4703294725E-22  4.0607018015E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.3135420324E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  3.0272968484E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  0.0000000000E+00 -2.6408420091E-05  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22
 -2.6408420091E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.0108813177E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.0108813177E-03  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22

 Crystal Tensor_qq(ke,je,1,3)
  3.6534517963E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22  2.5190399398E-03  0.0000000000E+00
  0.0000000000E+00  2.1175823681E-22  1.3135420324E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  2.5190399398E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -1.1016690490E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  0.0000000000E+00 -2.6408420091E-05  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22
 -2.6408420091E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.0108813177E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.0108813177E-03  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22

 Crystal Tensor_qq(ke,je,3,3)
  1.3231668754E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -1.1016690490E-03  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22  3.0272968484E-05  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22
 -1.1016690490E-03  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22  4.6735157952E-03  0.0000000000E+00

 Convertion factor =  77.98380 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -15.800  6.92399E-02  4.61903E-02  2.05755E-02  3.03251E-02  4.15820E-02  7.66873E-02  4.39524E-02
   dip-dip  6.81859E-02  4.38821E-02  1.95784E-02  2.94613E-02  3.93442E-02  7.44204E-02  4.23695E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  1.05400E-03  2.30815E-03  9.97084E-04  8.63782E-04  2.23781E-03  2.26690E-03  1.58296E-03

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -9.03691E-17  3.94619E-05 -9.01911E-17 -1.66173E-05  3.71253E-17  9.62418E-05  1.29304E-17  8.24945E-04
   dip-dip -8.65050E-17  1.48085E-16 -8.60218E-17  1.99914E-16  3.36794E-17  1.32061E-04  1.09179E-17  7.73028E-04
   dip-qua  3.14205E-20  1.16227E-18 -5.47640E-19  2.58294E-18  1.32370E-18 -6.97270E-18  2.01976E-18 -9.01379E-20
   qua-qua -3.89549E-18  3.94619E-05 -3.62161E-18 -1.66173E-05  2.12219E-18 -3.58189E-05 -7.20380E-21  5.19170E-05

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -15.70000 eV

 Vmoy = -20.14707 eV, Vmftabs(up) = -25.35151 eV, Vmftabs(dn) = -25.04320 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -4.080E-05   2.161E-02   3.333E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -2.705E-05   1.432E-02   2.209E-03
  1 -1    1  1    -3.723E-02   1.126E+00   1.074E-01
  1 -1    1  2     4.474E-03  -1.339E-01  -1.262E-02
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -1.115E-02   3.394E-01   3.258E-02
  1  0    1  1    -2.960E-02   8.979E-01   8.589E-02
  1  0    1  2     3.884E-03  -1.163E-01  -1.096E-02
  1  0    2  1     4.425E-03  -1.300E-01  -1.198E-02
  1  0    2  2    -1.262E-02   3.825E-01   3.656E-02
  1  1    1  1    -2.375E-02   7.228E-01   6.939E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     3.842E-03  -1.128E-01  -1.040E-02
  1  1    2  2    -1.370E-02   4.143E-01   3.948E-02
  2 -2    1  1     3.799E-03  -1.887E-01  -3.039E-02
  2 -2    1  2    -2.144E-05   9.469E-04   1.388E-04
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     3.561E-03  -1.771E-01  -2.857E-02
  2 -1    1  1     3.787E-03  -1.882E-01  -3.032E-02
  2 -1    1  2    -2.625E-05   1.160E-03   1.700E-04
  2 -1    2  1    -2.170E-05   9.537E-04   1.391E-04
  2 -1    2  2     3.572E-03  -1.776E-01  -2.863E-02
  2  0    1  1     3.776E-03  -1.877E-01  -3.025E-02
  2  0    1  2    -2.625E-05   1.159E-03   1.699E-04
  2  0    2  1    -2.657E-05   1.168E-03   1.704E-04
  2  0    2  2     3.582E-03  -1.780E-01  -2.870E-02
  2  1    1  1     3.765E-03  -1.872E-01  -3.017E-02
  2  1    1  2    -2.143E-05   9.466E-04   1.387E-04
  2  1    2  1    -2.657E-05   1.168E-03   1.704E-04
  2  1    2  2     3.592E-03  -1.785E-01  -2.876E-02
  2  2    1  1     3.753E-03  -1.867E-01  -3.010E-02
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -2.169E-05   9.533E-04   1.391E-04
  2  2    2  2     3.603E-03  -1.789E-01  -2.883E-02

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  2.6589572806E-02  0.0000000000E+00 -1.1668686854E-02  2.4601813244E-05  1.0156361890E-02  2.7389842851E-04
 -1.1668686854E-02 -2.4601813244E-05  2.4516042919E-02 -2.3738204574E-36 -1.5822269019E-03 -2.7918499017E-04
  1.0156361890E-02 -2.7389842851E-04 -1.5822269019E-03  2.7918499017E-04  1.8304862889E-02  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
  1.1919409864E-03 -7.9680074790E-06  1.9469389701E-03 -4.2273663978E-05  2.6985989532E-03 -3.4556469867E-05
  1.9469389701E-03 -4.2273663978E-05 -5.1434732127E-03 -7.9430571400E-05 -5.0875521967E-03  1.5820024577E-05
  2.6985989532E-03 -3.4556469867E-05 -5.0875521967E-03  1.5820024577E-05  1.8386657873E-03  6.3142781336E-05

 Tensor_dq(2,ks,j2), prototypical atom
 -6.2784679122E-03 -5.6086977843E-05 -5.3087303469E-03  5.3313608071E-05  2.9530910038E-04  3.0213706243E-05
 -5.3087303469E-03  5.3313608071E-05  3.3087072021E-03  8.3754885765E-05  1.6162421750E-03  4.3087849275E-06
  2.9530910038E-04  3.0213706243E-05  1.6162421750E-03  4.3087849275E-06  2.8069271619E-03 -6.4325351743E-06

 Tensor_dq(3,ks,j2), prototypical atom
  8.1801258051E-07 -8.0720134963E-05 -2.8225266487E-04 -6.8100690846E-05  1.8600732702E-03 -3.6613526096E-05
 -2.8225266487E-04 -6.8100690846E-05 -1.6964977894E-03  3.1396629824E-05 -3.2983565282E-03  6.7553326805E-05
  1.8600732702E-03 -3.6613526096E-05 -3.2983565282E-03  6.7553326805E-05  3.6061044029E-03  4.4767645900E-05

 Tensor_qq(ke,je,1,1), prototypical atom
  2.1977232384E-03  3.3408552898E-22  1.6150403316E-03  3.0606919719E-05 -3.2724972554E-04  9.9297485991E-07
  1.6150403316E-03  3.0606919719E-05 -4.7026705467E-04  1.6823855077E-05  6.5898276156E-06  6.9424822062E-06
 -3.2724972554E-04  9.9297485991E-07  6.5898276156E-06  6.9424822062E-06 -1.0714491798E-03 -9.5188820756E-06

 Tensor_qq(ke,je,2,1), prototypical atom
  1.6150403316E-03 -3.0606919719E-05  1.3360222580E-03 -6.6817105796E-22 -2.0985997131E-04  4.6146714671E-06
  1.3360222580E-03  4.0728754612E-22 -6.2419809703E-04  2.7375782471E-05 -1.2545775070E-04  8.4967063945E-06
 -2.0985997131E-04  4.6146714671E-06 -1.2545775070E-04  8.4967063945E-06 -8.7116194289E-04  7.0127318254E-06

 Tensor_qq(ke,je,3,1), prototypical atom
 -3.2724972554E-04 -9.9297485991E-07 -2.0985997131E-04 -4.6146714671E-06  5.0782634462E-04  1.3363421159E-21
 -2.0985997131E-04 -4.6146714671E-06 -4.2319134454E-04  1.3064243352E-05 -6.9088683123E-04  3.9693036433E-06
  5.0782634462E-04  8.3521382245E-22 -6.9088683123E-04  3.9693036433E-06  6.0946705646E-04 -1.0506517772E-05

 Tensor_qq(ke,je,1,2), prototypical atom
  1.6150403316E-03 -3.0606919719E-05  1.3360222580E-03  6.6817105796E-22 -2.0985997131E-04  4.6146714671E-06
  1.3360222580E-03  1.0754586041E-21 -6.2419809703E-04  2.7375782471E-05 -1.2545775070E-04  8.4967063945E-06
 -2.0985997131E-04  4.6146714671E-06 -1.2545775070E-04  8.4967063945E-06 -8.7116194289E-04  7.0127318254E-06

 Tensor_qq(ke,je,2,2), prototypical atom
 -4.7026705467E-04 -1.6823855077E-05 -6.2419809703E-04 -2.7375782471E-05 -4.2319134454E-04 -1.3064243352E-05
 -6.2419809703E-04 -2.7375782471E-05  1.2969661596E-03  3.7090944647E-38  1.0224786163E-03  1.8143434707E-05
 -4.2319134454E-04 -1.3064243352E-05  1.0224786163E-03  1.8143434707E-05 -1.6412943343E-04  1.2659655765E-05

 Tensor_qq(ke,je,3,2), prototypical atom
  6.5898276156E-06 -6.9424822062E-06 -1.2545775070E-04 -8.4967063945E-06 -6.9088683123E-04 -3.9693036433E-06
 -1.2545775070E-04 -8.4967063945E-06  1.0224786163E-03 -1.8143434707E-05  1.2497181984E-03 -8.5025866973E-22
 -6.9088683123E-04 -3.9693036433E-06  1.2497181984E-03 -6.6817105796E-22 -7.7660762539E-04  1.9791294792E-05

 Tensor_qq(ke,je,1,3), prototypical atom
 -3.2724972554E-04 -9.9297485991E-07 -2.0985997131E-04 -4.6146714671E-06  5.0782634462E-04  1.3363421159E-21
 -2.0985997131E-04 -4.6146714671E-06 -4.2319134454E-04  1.3064243352E-05 -6.9088683123E-04  3.9693036433E-06
  5.0782634462E-04 -4.1760691122E-22 -6.9088683123E-04  3.9693036433E-06  6.0946705646E-04 -1.0506517772E-05

 Tensor_qq(ke,je,2,3), prototypical atom
  6.5898276156E-06 -6.9424822062E-06 -1.2545775070E-04 -8.4967063945E-06 -6.9088683123E-04 -3.9693036433E-06
 -1.2545775070E-04 -8.4967063945E-06  1.0224786163E-03 -1.8143434707E-05  1.2497181984E-03 -8.5025866973E-22
 -6.9088683123E-04 -3.9693036433E-06  1.2497181984E-03 -6.6817105796E-22 -7.7660762539E-04  1.9791294792E-05

 Tensor_qq(ke,je,3,3), prototypical atom
 -1.0714491798E-03  9.5188820756E-06 -8.7116194289E-04 -7.0127318254E-06  6.0946705646E-04  1.0506517772E-05
 -8.7116194289E-04 -7.0127318254E-06 -1.6412943343E-04 -1.2659655765E-05 -7.7660762539E-04 -1.9791294792E-05
  6.0946705646E-04  1.0506517772E-05 -7.7660762539E-04 -1.9791294792E-05  1.3559714530E-03  6.6817105796E-22

 Crystal Tensor_dd(ke,ks) (Mbarn)
  2.1271658245E-01  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21  8.1250895120E-02  0.0000000000E+00
  0.0000000000E+00 -6.7762635780E-21  1.9612834335E-01  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  8.1250895120E-02  0.0000000000E+00  0.0000000000E+00 -1.0842021725E-19  1.4643890311E-01  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  1.7581785907E-02  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20 -2.6179978043E-03  0.0000000000E+00
  0.0000000000E+00  1.3552527156E-20 -3.7621364373E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -2.6179978043E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -8.5715934383E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00 -1.3552527156E-20  1.0688178064E-02  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21
  1.0688178064E-02  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21 -1.0036620056E-03  0.0000000000E+00
  0.0000000000E+00 -1.6940658945E-21 -1.0036620056E-03  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21

 Crystal Tensor_qq(ke,je,3,1)
 -2.6179978043E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.0626107570E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -3.3855307563E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  4.0626107570E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.8757364517E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00 -1.3552527156E-20  1.0688178064E-02  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21
  1.0688178064E-02  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21 -1.0036620056E-03  0.0000000000E+00
  0.0000000000E+00 -1.6940658945E-21 -1.0036620056E-03  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21

 Crystal Tensor_qq(ke,je,2,2)
 -3.7621364373E-03  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21 -3.3855307563E-03  0.0000000000E+00
  0.0000000000E+00  6.7762635780E-21  1.0375729277E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -3.3855307563E-03  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21 -1.3130354674E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  0.0000000000E+00 -1.0036620056E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -1.0036620056E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  9.9977455869E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  9.9977455869E-03  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21

 Crystal Tensor_qq(ke,je,1,3)
 -2.6179978043E-03  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21  4.0626107570E-03  0.0000000000E+00
  0.0000000000E+00  1.6940658945E-21 -3.3855307563E-03  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21
  4.0626107570E-03  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21  4.8757364517E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  0.0000000000E+00 -1.0036620056E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -1.0036620056E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  9.9977455869E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  9.9977455869E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,3)
 -8.5715934383E-03  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21  4.8757364517E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -1.3130354674E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  4.8757364517E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.0847771624E-02  0.0000000000E+00

 Convertion factor =  77.98523 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -15.700  1.16265E-01  1.54451E-01  2.05425E-01  2.33129E-01  2.64261E-01  1.39015E-01  1.93541E-01
   dip-dip  1.04875E-01  1.50502E-01  1.96128E-01  2.25204E-01  2.54280E-01  1.33540E-01  1.85095E-01
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  1.13897E-02  3.94921E-03  9.29622E-03  7.92449E-03  9.98088E-03  5.47492E-03  8.44651E-03

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -3.05896E-16  8.16110E-04 -1.79660E-16  3.41975E-04  3.43968E-17  1.49112E-03 -1.14671E-16  1.58465E-02
   dip-dip -3.17494E-16  6.22042E-16 -1.64470E-16  5.78644E-16  5.52583E-17  2.44248E-03 -7.81368E-17  1.46411E-02
   dip-qua  1.57687E-17  3.24084E-17 -8.88983E-18  6.42939E-17 -1.17222E-17 -9.88864E-17 -3.05269E-17 -3.50954E-17
   qua-qua -4.17104E-18  8.16110E-04 -6.30040E-18  3.41975E-04 -9.13930E-18 -9.51361E-04 -6.00727E-18  1.20544E-03

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -15.60000 eV

 Vmoy = -20.14814 eV, Vmftabs(up) = -25.35310 eV, Vmftabs(dn) = -25.04479 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -3.887E-05   2.058E-02   3.175E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -2.593E-05   1.372E-02   2.117E-03
  1 -1    1  1    -3.364E-02   1.018E+00   9.705E-02
  1 -1    1  2     4.040E-03  -1.209E-01  -1.140E-02
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -1.008E-02   3.067E-01   2.944E-02
  1  0    1  1    -2.675E-02   8.114E-01   7.762E-02
  1  0    1  2     3.508E-03  -1.050E-01  -9.897E-03
  1  0    2  1     3.997E-03  -1.174E-01  -1.082E-02
  1  0    2  2    -1.141E-02   3.457E-01   3.303E-02
  1  1    1  1    -2.147E-02   6.533E-01   6.271E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     3.470E-03  -1.019E-01  -9.391E-03
  1  1    2  2    -1.238E-02   3.744E-01   3.568E-02
  2 -2    1  1     3.211E-03  -1.595E-01  -2.569E-02
  2 -2    1  2    -1.814E-05   8.014E-04   1.175E-04
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     3.010E-03  -1.497E-01  -2.414E-02
  2 -1    1  1     3.201E-03  -1.590E-01  -2.563E-02
  2 -1    1  2    -2.221E-05   9.813E-04   1.438E-04
  2 -1    2  1    -1.836E-05   8.071E-04   1.178E-04
  2 -1    2  2     3.018E-03  -1.501E-01  -2.420E-02
  2  0    1  1     3.192E-03  -1.586E-01  -2.557E-02
  2  0    1  2    -2.221E-05   9.812E-04   1.438E-04
  2  0    2  1    -2.249E-05   9.884E-04   1.442E-04
  2  0    2  2     3.027E-03  -1.504E-01  -2.425E-02
  2  1    1  1     3.182E-03  -1.582E-01  -2.551E-02
  2  1    1  2    -1.813E-05   8.011E-04   1.174E-04
  2  1    2  1    -2.248E-05   9.883E-04   1.442E-04
  2  1    2  2     3.036E-03  -1.508E-01  -2.431E-02
  2  2    1  1     3.173E-03  -1.578E-01  -2.544E-02
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -1.836E-05   8.068E-04   1.177E-04
  2  2    2  2     3.044E-03  -1.512E-01  -2.436E-02

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  2.3311171915E-02 -8.3522914944E-23 -6.4719401822E-03 -8.8923277136E-05  2.2599028948E-03 -8.6281522426E-07
 -6.4719401822E-03  8.8923277136E-05  2.3748598635E-02 -5.9346600483E-37 -8.0480686944E-04 -9.7869982649E-06
  2.2599028948E-03  8.6281522426E-07 -8.0480686944E-04  9.7869982649E-06  2.5967381295E-02  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
  1.3879347316E-05  5.1573231585E-06  3.7632907762E-04  2.4123721120E-06  1.1146780395E-03 -7.3565402796E-06
  3.7632907762E-04  2.4123721120E-06 -1.8205612148E-03 -1.9218712712E-05 -1.6351602527E-03  4.4192243353E-06
  1.1146780395E-03 -7.3565402796E-06 -1.6351602527E-03  4.4192243353E-06  5.4728801510E-04  2.0324445741E-06

 Tensor_dq(2,ks,j2), prototypical atom
 -2.0067081305E-03 -1.2034094202E-05 -1.8609599054E-03  7.2149256299E-06 -1.0387902733E-04  1.5083390733E-05
 -1.8609599054E-03  7.2149256299E-06  1.4735193728E-03  1.1797480711E-05  8.9377435621E-04 -1.7387419453E-05
 -1.0387902733E-04  1.5083390733E-05  8.9377435621E-04 -1.7387419453E-05  6.5908725789E-04  1.0872795067E-05

 Tensor_dq(3,ks,j2), prototypical atom
 -9.4197859317E-05 -1.5779415882E-06 -3.8139108527E-04 -3.2918014033E-06  4.6397580661E-04 -3.3815885286E-06
 -3.8139108527E-04 -3.2918014033E-06 -4.2872886695E-04 -3.6722074837E-07 -9.4755961899E-04  5.5415817065E-06
  4.6397580661E-04 -3.3815885286E-06 -9.4755961899E-04  5.5415817065E-06  1.6258916596E-03  1.1298083343E-07

 Tensor_qq(ke,je,1,1), prototypical atom
  5.8416578195E-04 -1.6704582989E-22  3.5411199994E-04  5.5467241899E-06 -5.7033544811E-05  1.7906231710E-06
  3.5411199994E-04  5.5467241899E-06 -3.4457205380E-05  1.0472308812E-06 -2.1162329145E-06 -1.7221600661E-06
 -5.7033544811E-05  1.7906231710E-06 -2.1162329145E-06 -1.7221600661E-06 -1.5233319566E-04  6.4919245787E-07

 Tensor_qq(ke,je,2,1), prototypical atom
  3.5411199994E-04 -5.5467241899E-06  3.0203830876E-04  8.3522914944E-23 -4.4266515978E-05  2.0163231362E-06
  3.0203830876E-04  9.4594963971E-23 -1.4017804927E-04  3.5020121180E-06 -2.4796844611E-05 -8.6116163241E-07
 -4.4266515978E-05  2.0163231362E-06 -2.4796844611E-05 -8.6116163241E-07 -1.7211549576E-04  2.9607362207E-06

 Tensor_qq(ke,je,3,1), prototypical atom
 -5.7033544811E-05 -1.7906231710E-06 -4.4266515978E-05 -2.0163231362E-06  1.2231850388E-04  1.6704582989E-22
 -4.4266515978E-05 -2.0163231362E-06 -8.3890081832E-05  3.1833710975E-06 -1.3679182735E-04  1.1373786667E-06
  1.2231850388E-04  3.3409165978E-22 -1.3679182735E-04  1.1373786667E-06  1.0008580369E-04 -6.8370967324E-07

 Tensor_qq(ke,je,1,2), prototypical atom
  3.5411199994E-04 -5.5467241899E-06  3.0203830876E-04  0.0000000000E+00 -4.4266515978E-05  2.0163231362E-06
  3.0203830876E-04  1.1072049027E-23 -1.4017804927E-04  3.5020121180E-06 -2.4796844611E-05 -8.6116163241E-07
 -4.4266515978E-05  2.0163231362E-06 -2.4796844611E-05 -8.6116163241E-07 -1.7211549576E-04  2.9607362207E-06

 Tensor_qq(ke,je,2,2), prototypical atom
 -3.4457205380E-05 -1.0472308812E-06 -1.4017804927E-04 -3.5020121180E-06 -8.3890081832E-05 -3.1833710975E-06
 -1.4017804927E-04 -3.5020121180E-06  4.3945350682E-04 -3.7091625302E-38  2.3538603219E-04  4.5902459094E-06
 -8.3890081832E-05 -3.1833710975E-06  2.3538603219E-04  4.5902459094E-06  3.0945380790E-05 -3.8816595096E-07

 Tensor_qq(ke,je,3,2), prototypical atom
 -2.1162329145E-06  1.7221600661E-06 -2.4796844611E-05  8.6116163241E-07 -1.3679182735E-04 -1.1373786667E-06
 -2.4796844611E-05  8.6116163241E-07  2.3538603219E-04 -4.5902459094E-06  2.6440877686E-04  5.5761199256E-23
 -1.3679182735E-04 -1.1373786667E-06  2.6440877686E-04  8.3522914944E-23 -1.2908114256E-04  8.5934678966E-07

 Tensor_qq(ke,je,1,3), prototypical atom
 -5.7033544811E-05 -1.7906231710E-06 -4.4266515978E-05 -2.0163231362E-06  1.2231850388E-04  8.3522914944E-23
 -4.4266515978E-05 -2.0163231362E-06 -8.3890081832E-05  3.1833710975E-06 -1.3679182735E-04  1.1373786667E-06
  1.2231850388E-04  3.3409165978E-22 -1.3679182735E-04  1.1373786667E-06  1.0008580369E-04 -6.8370967324E-07

 Tensor_qq(ke,je,2,3), prototypical atom
 -2.1162329145E-06  1.7221600661E-06 -2.4796844611E-05  8.6116163241E-07 -1.3679182735E-04 -1.1373786667E-06
 -2.4796844611E-05  8.6116163241E-07  2.3538603219E-04 -4.5902459094E-06  2.6440877686E-04  5.5761199256E-23
 -1.3679182735E-04 -1.1373786667E-06  2.6440877686E-04  8.3522914944E-23 -1.2908114256E-04  8.5934678966E-07

 Tensor_qq(ke,je,3,3), prototypical atom
 -1.5233319566E-04 -6.4919245787E-07 -1.7211549576E-04 -2.9607362207E-06  1.0008580369E-04  6.8370967324E-07
 -1.7211549576E-04 -2.9607362207E-06  3.0945380790E-05  3.8816595096E-07 -1.2908114256E-04 -8.5934678966E-07
  1.0008580369E-04  6.8370967324E-07 -1.2908114256E-04 -8.5934678966E-07  3.0125469998E-04  0.0000000000E+00

 Crystal Tensor_dd(ke,ks) (Mbarn)
  1.8648937532E-01  0.0000000000E+00  0.0000000000E+00  2.7105054312E-20  1.8079223158E-02  0.0000000000E+00
  0.0000000000E+00 -2.7105054312E-20  1.8998878908E-01  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.8079223158E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  2.0773905036E-01  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  4.6733262556E-03  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21 -4.5626835849E-04  0.0000000000E+00
  0.0000000000E+00  1.6940658945E-21 -2.7565764304E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22
 -4.5626835849E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -1.2186655653E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  1.6940658945E-21  2.4163064701E-03  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22
  2.4163064701E-03  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22 -1.9837475688E-04  0.0000000000E+00
  0.0000000000E+00 -8.4703294725E-22 -1.9837475688E-04  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22

 Crystal Tensor_qq(ke,je,3,1)
 -4.5626835849E-04  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22  9.7854803105E-04  0.0000000000E+00
  0.0000000000E+00  8.4703294725E-22 -6.7112065465E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22
  9.7854803105E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22  8.0068642952E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  1.6940658945E-21  2.4163064701E-03  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22
  2.4163064701E-03  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22 -1.9837475688E-04  0.0000000000E+00
  0.0000000000E+00 -8.4703294725E-22 -1.9837475688E-04  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22

 Crystal Tensor_qq(ke,je,2,2)
 -2.7565764304E-04  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22 -6.7112065465E-04  0.0000000000E+00
  0.0000000000E+00  8.4703294725E-22  3.5156280546E-03  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21
 -6.7112065465E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  2.4756304632E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  0.0000000000E+00 -1.9837475688E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -1.9837475688E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  2.1152702149E-03  0.0000000000E+00
  0.0000000000E+00 -4.2351647363E-22  2.1152702149E-03  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22

 Crystal Tensor_qq(ke,je,1,3)
 -4.5626835849E-04  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22  9.7854803105E-04  0.0000000000E+00
  0.0000000000E+00  8.4703294725E-22 -6.7112065465E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22
  9.7854803105E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22  8.0068642952E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  0.0000000000E+00 -1.9837475688E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -1.9837475688E-04  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21  2.1152702149E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.1152702149E-03  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22

 Crystal Tensor_qq(ke,je,3,3)
 -1.2186655653E-03  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22  8.0068642952E-04  0.0000000000E+00
  0.0000000000E+00 -8.4703294725E-22  2.4756304632E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22
  8.0068642952E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22  2.4100375998E-03  0.0000000000E+00

 Convertion factor =  77.98666 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -15.600  1.80021E-01  1.84895E-01  1.92034E-01  2.05170E-01  2.18832E-01  2.05844E-01  1.96631E-01
   dip-dip  1.77535E-01  1.83762E-01  1.89989E-01  2.03341E-01  2.16693E-01  2.04624E-01  1.94739E-01
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  2.48620E-03  1.13336E-03  2.04538E-03  1.82929E-03  2.13864E-03  1.22008E-03  1.89174E-03

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -3.83724E-16  1.09078E-04 -2.33128E-16  9.50972E-05  1.06411E-16 -1.41948E-04 -9.87488E-18  1.18903E-04
   dip-dip -3.87351E-16  6.97108E-16 -2.34309E-16  5.70596E-16  1.06031E-16 -1.21144E-05 -3.75844E-18  1.59842E-05
   dip-qua  5.96888E-18  1.11562E-17  2.52224E-18  2.57159E-17  2.41185E-18 -3.59045E-17 -5.73686E-18 -2.13918E-17
   qua-qua -2.34129E-18  1.09078E-04 -1.34113E-18  9.50972E-05 -2.03254E-18 -1.29833E-04 -3.79579E-19  1.02918E-04

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -15.50000 eV

 Vmoy = -20.14924 eV, Vmftabs(up) = -25.35468 eV, Vmftabs(dn) = -25.04636 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -3.719E-05   1.969E-02   3.038E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -2.496E-05   1.321E-02   2.038E-03
  1 -1    1  1    -3.077E-02   9.310E-01   8.878E-02
  1 -1    1  2     3.694E-03  -1.106E-01  -1.042E-02
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -9.224E-03   2.807E-01   2.695E-02
  1  0    1  1    -2.448E-02   7.425E-01   7.102E-02
  1  0    1  2     3.208E-03  -9.602E-02  -9.050E-03
  1  0    2  1     3.654E-03  -1.073E-01  -9.890E-03
  1  0    2  2    -1.044E-02   3.163E-01   3.023E-02
  1  1    1  1    -1.965E-02   5.979E-01   5.739E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     3.173E-03  -9.318E-02  -8.588E-03
  1  1    2  2    -1.133E-02   3.426E-01   3.265E-02
  2 -2    1  1     2.772E-03  -1.377E-01  -2.218E-02
  2 -2    1  2    -1.568E-05   6.927E-04   1.015E-04
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     2.598E-03  -1.292E-01  -2.084E-02
  2 -1    1  1     2.764E-03  -1.373E-01  -2.213E-02
  2 -1    1  2    -1.920E-05   8.483E-04   1.244E-04
  2 -1    2  1    -1.587E-05   6.977E-04   1.018E-04
  2 -1    2  2     2.605E-03  -1.295E-01  -2.089E-02
  2  0    1  1     2.756E-03  -1.369E-01  -2.207E-02
  2  0    1  2    -1.919E-05   8.482E-04   1.243E-04
  2  0    2  1    -1.944E-05   8.544E-04   1.247E-04
  2  0    2  2     2.613E-03  -1.299E-01  -2.093E-02
  2  1    1  1     2.747E-03  -1.366E-01  -2.202E-02
  2  1    1  2    -1.567E-05   6.925E-04   1.015E-04
  2  1    2  1    -1.943E-05   8.543E-04   1.247E-04
  2  1    2  2     2.620E-03  -1.302E-01  -2.098E-02
  2  2    1  1     2.739E-03  -1.362E-01  -2.197E-02
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -1.587E-05   6.975E-04   1.018E-04
  2  2    2  2     2.628E-03  -1.305E-01  -2.103E-02

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  1.4663530449E-01  0.0000000000E+00 -4.4220832262E-02  1.0425476011E-03  3.5596605523E-02 -1.1724491286E-03
 -4.4220832262E-02 -1.0425476011E-03  2.4338780961E-01  0.0000000000E+00 -1.4814408329E-02  1.8343731322E-03
  3.5596605523E-02  1.1724491286E-03 -1.4814408329E-02 -1.8343731322E-03  1.7892431297E-01 -8.5529034387E-20

 Tensor_dq(1,ks,j2), prototypical atom
  2.3132008500E-03 -1.0641143484E-04  3.1523445237E-04 -7.9493457591E-05  2.7491299240E-03  2.6857007069E-05
  3.1523445237E-04 -7.9493457591E-05 -3.8988802179E-03  1.5902250733E-04 -3.9095722789E-03  2.4624279086E-05
  2.7491299240E-03  2.6857007069E-05 -3.9095722789E-03  2.4624279086E-05  2.2508888231E-03  2.4933682957E-05

 Tensor_dq(2,ks,j2), prototypical atom
 -7.3091579616E-03 -8.5691929427E-06 -6.0452723785E-03 -7.7642713542E-05 -1.5042046435E-03 -1.0065716575E-04
 -6.0452723785E-03 -7.7642713542E-05  4.9062104712E-03 -1.4808938724E-04  2.0281580380E-03  2.9094117563E-05
 -1.5042046435E-03 -1.0065716575E-04  2.0281580380E-03  2.9094117563E-05  6.0857712873E-04 -1.6458246708E-05

 Tensor_dq(3,ks,j2), prototypical atom
 -3.1303925026E-03  1.7569100660E-04 -2.3706822923E-03  9.0113269559E-05  2.0079377781E-03  4.2359318122E-05
 -2.3706822923E-03  9.0113269559E-05 -4.2037303717E-03 -5.2892916518E-05 -2.4889637819E-03 -9.5925999085E-05
  2.0079377781E-03  4.2359318122E-05 -2.4889637819E-03 -9.5925999085E-05  1.2621813850E-03 -5.4732675362E-05

 Tensor_qq(ke,je,1,1), prototypical atom
  6.6179021906E-04 -1.6704889529E-22  3.8922522894E-04 -5.3025722163E-07 -1.4110964468E-05 -2.2961316529E-06
  3.8922522894E-04 -5.3025722163E-07 -5.0329326674E-05 -8.0819113944E-06 -4.2893697755E-05 -4.2081017998E-07
 -1.4110964468E-05 -2.2961316529E-06 -4.2893697755E-05 -4.2081017998E-07 -5.2627372327E-05 -4.0079317988E-06

 Tensor_qq(ke,je,2,1), prototypical atom
  3.8922522894E-04  5.3025722163E-07  3.1478898895E-04  0.0000000000E+00 -3.5365307062E-05 -1.5967269757E-06
  3.1478898895E-04  1.8588811367E-23 -9.1084506284E-05 -4.5043395745E-06 -2.0935206086E-06  2.7821864206E-07
 -3.5365307062E-05 -1.5967269757E-06 -2.0935206086E-06  2.7821864206E-07 -1.0885122193E-04 -2.4767401211E-06

 Tensor_qq(ke,je,3,1), prototypical atom
 -1.4110964468E-05  2.2961316529E-06 -3.5365307062E-05  1.5967269757E-06  1.3456029459E-04 -8.3524447643E-23
 -3.5365307062E-05  1.5967269757E-06 -1.2709524520E-04 -4.5460483185E-06 -1.4836041424E-04 -4.8744484525E-07
  1.3456029459E-04 -1.6704889529E-22 -1.4836041424E-04 -4.8744484525E-07  9.3443111074E-05  4.8929686595E-07

 Tensor_qq(ke,je,1,2), prototypical atom
  3.8922522894E-04  5.3025722163E-07  3.1478898895E-04 -4.1762223822E-23 -3.5365307062E-05 -1.5967269757E-06
  3.1478898895E-04 -2.2923005440E-24 -9.1084506284E-05 -4.5043395745E-06 -2.0935206086E-06  2.7821864206E-07
 -3.5365307062E-05 -1.5967269757E-06 -2.0935206086E-06  2.7821864206E-07 -1.0885122193E-04 -2.4767401211E-06

 Tensor_qq(ke,je,2,2), prototypical atom
 -5.0329326674E-05  8.0819113944E-06 -9.1084506284E-05  4.5043395745E-06 -1.2709524520E-04  4.5460483185E-06
 -9.1084506284E-05  4.5043395745E-06  4.4266123609E-04  5.5638458936E-38  2.3236156792E-04 -4.8329983094E-06
 -1.2709524520E-04  4.5460483185E-06  2.3236156792E-04 -4.8329983094E-06  4.0495384919E-06  1.1179264359E-06

 Tensor_qq(ke,je,3,2), prototypical atom
 -4.2893697755E-05  4.2081017998E-07 -2.0935206086E-06 -2.7821864206E-07 -1.4836041424E-04  4.8744484525E-07
 -2.0935206086E-06 -2.7821864206E-07  2.3236156792E-04  4.8329983094E-06  2.5616473738E-04  2.3831642180E-23
 -1.4836041424E-04  4.8744484525E-07  2.5616473738E-04  0.0000000000E+00 -1.2174138930E-04  6.6611103413E-07

 Tensor_qq(ke,je,1,3), prototypical atom
 -1.4110964468E-05  2.2961316529E-06 -3.5365307062E-05  1.5967269757E-06  1.3456029459E-04 -1.2528667146E-22
 -3.5365307062E-05  1.5967269757E-06 -1.2709524520E-04 -4.5460483185E-06 -1.4836041424E-04 -4.8744484525E-07
  1.3456029459E-04 -1.6704889529E-22 -1.4836041424E-04 -4.8744484525E-07  9.3443111074E-05  4.8929686595E-07

 Tensor_qq(ke,je,2,3), prototypical atom
 -4.2893697755E-05  4.2081017998E-07 -2.0935206086E-06 -2.7821864206E-07 -1.4836041424E-04  4.8744484525E-07
 -2.0935206086E-06 -2.7821864206E-07  2.3236156792E-04  4.8329983094E-06  2.5616473738E-04 -1.7930581642E-23
 -1.4836041424E-04  4.8744484525E-07  2.5616473738E-04 -2.0881111911E-23 -1.2174138930E-04  6.6611103413E-07

 Tensor_qq(ke,je,3,3), prototypical atom
 -5.2627372327E-05  4.0079317988E-06 -1.0885122193E-04  2.4767401211E-06  9.3443111074E-05 -4.8929686595E-07
 -1.0885122193E-04  2.4767401211E-06  4.0495384919E-06 -1.1179264359E-06 -1.2174138930E-04 -6.6611103413E-07
  9.3443111074E-05 -4.8929686595E-07 -1.2174138930E-04 -6.6611103413E-07  2.1764834135E-04  1.6704889529E-22

 Crystal Tensor_dd(ke,ks) (Mbarn)
  1.1730824359E+00  0.0000000000E+00  0.0000000000E+00  4.3368086899E-19  2.8477284418E-01  0.0000000000E+00
  0.0000000000E+00 -4.3368086899E-19  1.9471024769E+00  0.0000000000E+00  0.0000000000E+00 -4.3368086899E-19
  2.8477284418E-01  0.0000000000E+00  0.0000000000E+00  4.3368086899E-19  1.4313945038E+00  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  5.2943217525E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -1.1288771574E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -4.0263461339E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
 -1.1288771574E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22 -4.2101897862E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  2.1175823681E-22  2.5183119116E-03  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22
  2.5183119116E-03  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21 -1.6748164869E-05  0.0000000000E+00
  0.0000000000E+00  4.2351647363E-22 -1.6748164869E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,1)
 -1.1288771574E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22  1.0764823567E-03  0.0000000000E+00
  0.0000000000E+00  4.2351647363E-22 -1.0167619616E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.0764823567E-03  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22  7.4754488860E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00 -2.1175823681E-22  2.5183119116E-03  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22
  2.5183119116E-03  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21 -1.6748164869E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -1.6748164869E-05  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22

 Crystal Tensor_qq(ke,je,2,2)
 -4.0263461339E-04  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21 -1.0167619616E-03  0.0000000000E+00
  0.0000000000E+00  1.6940658945E-21  3.5412898887E-03  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21
 -1.0167619616E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  3.2396307935E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  0.0000000000E+00 -1.6748164869E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -1.6748164869E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  2.0493178990E-03  0.0000000000E+00
  0.0000000000E+00 -2.1175823681E-22  2.0493178990E-03  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22

 Crystal Tensor_qq(ke,je,1,3)
 -1.1288771574E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22  1.0764823567E-03  0.0000000000E+00
  0.0000000000E+00 -4.2351647363E-22 -1.0167619616E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.0764823567E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  7.4754488860E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00 -1.0587911841E-22 -1.6748164869E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -1.6748164869E-05  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21  2.0493178990E-03  0.0000000000E+00
  0.0000000000E+00  2.1175823681E-22  2.0493178990E-03  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22

 Crystal Tensor_qq(ke,je,3,3)
 -4.2101897862E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  7.4754488860E-04  0.0000000000E+00
  0.0000000000E+00 -8.4703294725E-22  3.2396307935E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  7.4754488860E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.7411867308E-03  0.0000000000E+00

 Convertion factor =  77.98809 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -15.500  1.00245E+00  1.47472E+00  1.94933E+00  1.77797E+00  1.60617E+00  1.38409E+00  1.51908E+00
   dip-dip  1.00012E+00  1.47361E+00  1.94710E+00  1.77573E+00  1.60436E+00  1.38285E+00  1.51719E+00
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  2.33886E-03  1.10784E-03  2.22877E-03  2.24212E-03  1.80584E-03  1.24003E-03  1.88669E-03

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -2.72322E-15 -1.52641E-04 -1.54516E-15 -1.39217E-04 -6.37661E-16 -1.05940E-02 -4.46635E-17 -6.37629E-02
   dip-dip -2.72651E-15  5.96159E-15 -1.55669E-15  3.96184E-15 -6.09282E-16 -1.07827E-02 -2.70450E-17 -6.35790E-02
   dip-qua  5.31784E-18  4.23420E-17  1.36950E-17  7.91189E-17 -2.76448E-17 -1.00328E-16 -1.57037E-17 -6.82358E-17
   qua-qua -2.01910E-18 -1.52641E-04 -2.16801E-18 -1.39217E-04 -7.33970E-19  1.88660E-04 -1.91481E-18 -1.83947E-04

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -15.40000 eV

 Vmoy = -20.15042 eV, Vmftabs(up) = -25.35624 eV, Vmftabs(dn) = -25.04792 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -3.570E-05   1.891E-02   2.917E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -2.411E-05   1.276E-02   1.969E-03
  1 -1    1  1    -2.842E-02   8.599E-01   8.200E-02
  1 -1    1  2     3.409E-03  -1.021E-01  -9.618E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -8.525E-03   2.594E-01   2.490E-02
  1  0    1  1    -2.261E-02   6.860E-01   6.561E-02
  1  0    1  2     2.961E-03  -8.864E-02  -8.354E-03
  1  0    2  1     3.373E-03  -9.904E-02  -9.127E-03
  1  0    2  2    -9.645E-03   2.923E-01   2.794E-02
  1  1    1  1    -1.816E-02   5.525E-01   5.303E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     2.930E-03  -8.602E-02  -7.927E-03
  1  1    2  2    -1.047E-02   3.166E-01   3.017E-02
  2 -2    1  1     2.434E-03  -1.209E-01  -1.947E-02
  2 -2    1  2    -1.377E-05   6.088E-04   8.926E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     2.280E-03  -1.134E-01  -1.829E-02
  2 -1    1  1     2.426E-03  -1.205E-01  -1.942E-02
  2 -1    1  2    -1.687E-05   7.455E-04   1.093E-04
  2 -1    2  1    -1.395E-05   6.132E-04   8.950E-05
  2 -1    2  2     2.287E-03  -1.137E-01  -1.833E-02
  2  0    1  1     2.419E-03  -1.202E-01  -1.938E-02
  2  0    1  2    -1.687E-05   7.454E-04   1.093E-04
  2  0    2  1    -1.708E-05   7.510E-04   1.096E-04
  2  0    2  2     2.293E-03  -1.140E-01  -1.837E-02
  2  1    1  1     2.412E-03  -1.199E-01  -1.933E-02
  2  1    1  2    -1.377E-05   6.086E-04   8.923E-05
  2  1    2  1    -1.708E-05   7.509E-04   1.096E-04
  2  1    2  2     2.300E-03  -1.143E-01  -1.841E-02
  2  2    1  1     2.405E-03  -1.196E-01  -1.928E-02
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -1.394E-05   6.130E-04   8.946E-05
  2  2    2  2     2.306E-03  -1.145E-01  -1.846E-02

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  3.3548663285E-01  0.0000000000E+00  2.0789352072E-02 -3.3400413298E-04  8.8305772156E-02  2.0403438311E-03
  2.0789352072E-02  3.3400413298E-04  3.8228407825E-01  0.0000000000E+00  1.5068853111E-02  1.6309420134E-03
  8.8305772156E-02 -2.0403438311E-03  1.5068853111E-02 -1.6309420134E-03  3.5427229592E-01  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
  4.4099229742E-03  1.7312637515E-04 -1.3358798408E-03  8.9367366501E-05 -4.7319238177E-03  2.0972914775E-05
 -1.3358798408E-03  8.9367366501E-05  2.9478442496E-03 -8.5756568704E-05  7.3070970673E-03 -5.8494930898E-05
 -4.7319238177E-03  2.0972914775E-05  7.3070970673E-03 -5.8494930898E-05 -5.9646180939E-03 -1.9689292822E-04

 Tensor_dq(2,ks,j2), prototypical atom
  8.5020337991E-03  1.6034708599E-04  4.2911515442E-03 -3.9388143896E-05  1.0189841808E-04 -8.6689902712E-05
  4.2911515442E-03 -3.9388143896E-05 -5.5392181647E-03 -1.4952928607E-04 -9.8754745295E-03  4.3235327298E-05
  1.0189841808E-04 -8.6689902712E-05 -9.8754745295E-03  4.3235327298E-05 -3.0286863890E-03 -8.0295761106E-06

 Tensor_dq(3,ks,j2), prototypical atom
  3.3583498181E-03 -1.4030868191E-04  2.8296386209E-03 -8.9789379242E-05 -6.8509089073E-03  6.2259610699E-05
  2.8296386209E-03 -8.9789379242E-05 -3.9666120784E-03  4.1320534968E-05  7.5408928797E-03  1.4598901072E-05
 -6.8509089073E-03  6.2259610699E-05  7.5408928797E-03  1.4598901072E-05 -1.6379404438E-02  1.1442493860E-05

 Tensor_qq(ke,je,1,1), prototypical atom
  6.1833875225E-04 -1.6705196069E-22  2.9195005080E-04  5.2453917135E-07 -1.3421506769E-04  2.7524603735E-06
  2.9195005080E-04  5.2453917135E-07 -1.4441519856E-04  4.8053104155E-06 -1.3978476629E-04 -3.6151266836E-06
 -1.3421506769E-04  2.7524603735E-06 -1.3978476629E-04 -3.6151266836E-06 -3.0651966733E-04  3.0047567204E-06

 Tensor_qq(ke,je,2,1), prototypical atom
  2.9195005080E-04 -5.2453917135E-07  2.4518453196E-04  4.1762990171E-23 -7.3110368321E-05  2.6788778106E-06
  2.4518453196E-04  2.2472410035E-23 -1.9642294766E-04  3.5901970206E-06 -1.2287429833E-04 -3.8488437099E-07
 -7.3110368321E-05  2.6788778106E-06 -1.2287429833E-04 -3.8488437099E-07 -2.4988601711E-04  2.0168774314E-06

 Tensor_qq(ke,je,3,1), prototypical atom
 -1.3421506769E-04 -2.7524603735E-06 -7.3110368321E-05 -2.6788778106E-06  2.6061234505E-04  6.6820784274E-22
 -7.3110368321E-05 -2.6788778106E-06  1.0315062978E-06  2.0729764425E-06 -3.0905357760E-04  4.3142741448E-06
  2.6061234505E-04  5.0115588206E-22 -3.0905357760E-04  4.3142741448E-06  4.2405628006E-04 -4.0824487532E-06

 Tensor_qq(ke,je,1,2), prototypical atom
  2.9195005080E-04 -5.2453917135E-07  2.4518453196E-04  8.3525980343E-23 -7.3110368321E-05  2.6788778106E-06
  2.4518453196E-04  6.4235400206E-23 -1.9642294766E-04  3.5901970206E-06 -1.2287429833E-04 -3.8488437099E-07
 -7.3110368321E-05  2.6788778106E-06 -1.2287429833E-04 -3.8488437099E-07 -2.4988601711E-04  2.0168774314E-06

 Tensor_qq(ke,je,2,2), prototypical atom
 -1.4441519856E-04 -4.8053104155E-06 -1.9642294766E-04 -3.5901970206E-06  1.0315062978E-06 -2.0729764425E-06
 -1.9642294766E-04 -3.5901970206E-06  3.9944814349E-04  7.4185973225E-38  2.6646595321E-04  5.3209477058E-06
  1.0315062978E-06 -2.0729764425E-06  2.6646595321E-04  5.3209477058E-06  2.4634043594E-04  2.9446445470E-06

 Tensor_qq(ke,je,3,2), prototypical atom
 -1.3978476629E-04  3.6151266836E-06 -1.2287429833E-04  3.8488437099E-07 -3.0905357760E-04 -4.3142741448E-06
 -1.2287429833E-04  3.8488437099E-07  2.6646595321E-04 -5.3209477058E-06  7.5594527809E-04 -5.6353109410E-23
 -3.0905357760E-04 -4.3142741448E-06  7.5594527809E-04 -4.1762990171E-23 -4.1097507452E-04  4.7081102720E-06

 Tensor_qq(ke,je,1,3), prototypical atom
 -1.3421506769E-04 -2.7524603735E-06 -7.3110368321E-05 -2.6788778106E-06  2.6061234505E-04  3.3410392137E-22
 -7.3110368321E-05 -2.6788778106E-06  1.0315062978E-06  2.0729764425E-06 -3.0905357760E-04  4.3142741448E-06
  2.6061234505E-04 -3.3410392137E-22 -3.0905357760E-04  4.3142741448E-06  4.2405628006E-04 -4.0824487532E-06

 Tensor_qq(ke,je,2,3), prototypical atom
 -1.3978476629E-04  3.6151266836E-06 -1.2287429833E-04  3.8488437099E-07 -3.0905357760E-04 -4.3142741448E-06
 -1.2287429833E-04  3.8488437099E-07  2.6646595321E-04 -5.3209477058E-06  7.5594527809E-04  2.7172870932E-23
 -3.0905357760E-04 -4.3142741448E-06  7.5594527809E-04  4.1762990171E-23 -4.1097507452E-04  4.7081102720E-06

 Tensor_qq(ke,je,3,3), prototypical atom
 -3.0651966733E-04 -3.0047567204E-06 -2.4988601711E-04 -2.0168774314E-06  4.2405628006E-04  4.0824487532E-06
 -2.4988601711E-04 -2.0168774314E-06  2.4634043594E-04 -2.9446445470E-06 -4.1097507452E-04 -4.7081102720E-06
  4.2405628006E-04  4.0824487532E-06 -4.1097507452E-04 -4.7081102720E-06  1.0276144793E-03  3.3410392137E-22

 Crystal Tensor_dd(ke,ks) (Mbarn)
  2.6838930628E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  7.0644617725E-01  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  3.0582726260E+00  0.0000000000E+00  0.0000000000E+00  4.3368086899E-19
  7.0644617725E-01  0.0000000000E+00  0.0000000000E+00  4.3368086899E-19  2.8341783674E+00  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  4.9467100180E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -1.0737205416E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -1.1553215884E-03  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22
 -1.0737205416E-03  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22 -2.4521573386E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  2.1175823681E-22  1.9614762557E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.9614762557E-03  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22 -9.8299438663E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -9.8299438663E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,1)
 -1.0737205416E-03  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22  2.0848987604E-03  0.0000000000E+00
  0.0000000000E+00  8.4703294725E-22  8.2520503824E-06  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21
  2.0848987604E-03  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21  3.3924502404E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  0.0000000000E+00  1.9614762557E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.9614762557E-03  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22 -9.8299438663E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -9.8299438663E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,2)
 -1.1553215884E-03  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22  8.2520503824E-06  0.0000000000E+00
  0.0000000000E+00  8.4703294725E-22  3.1955851480E-03  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21
  8.2520503824E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.9707234875E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00 -8.4703294725E-22 -9.8299438663E-04  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21
 -9.8299438663E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  6.0475622247E-03  0.0000000000E+00
  0.0000000000E+00 -1.6940658945E-21  6.0475622247E-03  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21

 Crystal Tensor_qq(ke,je,1,3)
 -1.0737205416E-03  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22  2.0848987604E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  8.2520503824E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  2.0848987604E-03  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21  3.3924502404E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  8.4703294725E-22 -9.8299438663E-04  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21
 -9.8299438663E-04  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21  6.0475622247E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  6.0475622247E-03  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21

 Crystal Tensor_qq(ke,je,3,3)
 -2.4521573386E-03  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22  3.3924502404E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.9707234875E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.3924502404E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  8.2209158341E-03  0.0000000000E+00

 Convertion factor =  77.98952 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -15.400  2.05448E+00  2.55538E+00  3.06164E+00  3.26559E+00  3.47196E+00  2.71997E+00  2.86200E+00
   dip-dip  2.04984E+00  2.55406E+00  3.05827E+00  3.26325E+00  3.46823E+00  2.71709E+00  2.85878E+00
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  4.63850E-03  1.32351E-03  3.37054E-03  2.33667E-03  3.72852E-03  2.87436E-03  3.21879E-03

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -7.55094E-15  1.91762E-04 -5.37709E-15  1.13675E-04 -9.87212E-17  1.50555E-02  5.68303E-16  1.08851E-01
   dip-dip -7.50772E-15  9.94784E-15 -5.38696E-15  7.70850E-15 -1.93636E-16  1.52802E-02  4.54735E-16  1.08668E-01
   dip-qua -4.07765E-17 -1.17938E-16  1.02468E-17 -8.72651E-17  9.65174E-17  1.82814E-16  1.16844E-16  1.81392E-16
   qua-qua -2.44004E-18  1.91762E-04 -3.79262E-19  1.13675E-04 -1.60264E-18 -2.24713E-04 -3.27625E-18  1.83304E-04

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -15.30000 eV

 Vmoy = -20.15162 eV, Vmftabs(up) = -25.35779 eV, Vmftabs(dn) = -25.04947 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -3.438E-05   1.820E-02   2.808E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -2.335E-05   1.236E-02   1.907E-03
  1 -1    1  1    -2.646E-02   8.004E-01   7.633E-02
  1 -1    1  2     3.171E-03  -9.493E-02  -8.946E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -7.943E-03   2.417E-01   2.320E-02
  1  0    1  1    -2.106E-02   6.388E-01   6.110E-02
  1  0    1  2     2.755E-03  -8.247E-02  -7.772E-03
  1  0    2  1     3.138E-03  -9.213E-02  -8.490E-03
  1  0    2  2    -8.985E-03   2.723E-01   2.602E-02
  1  1    1  1    -1.691E-02   5.146E-01   4.940E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     2.726E-03  -8.003E-02  -7.375E-03
  1  1    2  2    -9.753E-03   2.949E-01   2.810E-02
  2 -2    1  1     2.165E-03  -1.075E-01  -1.732E-02
  2 -2    1  2    -1.227E-05   5.422E-04   7.951E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     2.028E-03  -1.008E-01  -1.626E-02
  2 -1    1  1     2.159E-03  -1.072E-01  -1.728E-02
  2 -1    1  2    -1.502E-05   6.640E-04   9.737E-05
  2 -1    2  1    -1.242E-05   5.462E-04   7.973E-05
  2 -1    2  2     2.034E-03  -1.011E-01  -1.630E-02
  2  0    1  1     2.152E-03  -1.069E-01  -1.724E-02
  2  0    1  2    -1.502E-05   6.639E-04   9.736E-05
  2  0    2  1    -1.521E-05   6.689E-04   9.764E-05
  2  0    2  2     2.040E-03  -1.014E-01  -1.634E-02
  2  1    1  1     2.146E-03  -1.067E-01  -1.720E-02
  2  1    1  2    -1.226E-05   5.420E-04   7.948E-05
  2  1    2  1    -1.521E-05   6.688E-04   9.762E-05
  2  1    2  2     2.045E-03  -1.016E-01  -1.638E-02
  2  2    1  1     2.139E-03  -1.064E-01  -1.715E-02
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -1.242E-05   5.460E-04   7.970E-05
  2  2    2  2     2.051E-03  -1.019E-01  -1.642E-02

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  1.0320578368E-01  0.0000000000E+00 -2.5803019380E-03  2.5352204747E-04  1.7110201238E-03  3.7988656645E-05
 -2.5803019380E-03 -2.5352204747E-04  8.9606868259E-02  1.6321213598E-36  6.0800506951E-03  2.2112705617E-04
  1.7110201238E-03 -3.7988656645E-05  6.0800506951E-03 -2.2112705617E-04  8.9977591264E-02  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
  2.2778853013E-03  1.1550942637E-05  2.3860174067E-04  2.5868664791E-05 -1.5692530172E-03  1.0604161850E-05
  2.3860174067E-04  2.5868664791E-05  1.4641473143E-03 -7.2645676755E-07  2.3414884508E-03 -2.5390852933E-05
 -1.5692530172E-03  1.0604161850E-05  2.3414884508E-03 -2.5390852933E-05 -1.5992674246E-03 -1.0571388485E-05

 Tensor_dq(2,ks,j2), prototypical atom
  2.4089453103E-03 -1.0726727884E-06  1.8913552272E-03  3.1367572891E-06  3.9662460771E-04  9.2648069030E-06
  1.8913552272E-03  3.1367572891E-06 -1.9993332357E-03 -1.5242842715E-05 -2.8441782958E-03 -5.3590522368E-06
  3.9662460771E-04  9.2648069030E-06 -2.8441782958E-03 -5.3590522368E-06 -5.7703431550E-04 -3.4799145060E-06

 Tensor_dq(3,ks,j2), prototypical atom
  9.6421679734E-04 -1.9355176231E-05  1.1617289017E-03 -1.9745080826E-06 -1.3830131855E-03 -2.7588904263E-06
  1.1617289017E-03 -1.9745080826E-06 -1.1646335952E-03  1.2289230076E-05  1.4910960373E-03  2.0531587383E-05
 -1.3830131855E-03 -2.7588904263E-06  1.4910960373E-03  2.0531587383E-05 -4.2459378540E-03  7.3476216298E-06

 Tensor_qq(ke,je,1,1), prototypical atom
  4.1678804759E-04 -5.2204695651E-23  2.1738679016E-04 -1.8703366824E-06 -6.9107004397E-05 -1.8026429966E-07
  2.1738679016E-04 -1.8703366824E-06 -3.9803853741E-05 -3.0433473144E-08 -2.6366267697E-05 -1.5946207772E-07
 -6.9107004397E-05 -1.8026429966E-07 -2.6366267697E-05 -1.5946207772E-07 -1.5424549445E-04  1.0896079121E-06

 Tensor_qq(ke,je,2,1), prototypical atom
  2.1738679016E-04  1.8703366824E-06  1.7765664951E-04  0.0000000000E+00 -3.7058550320E-05 -4.4919810194E-07
  1.7765664951E-04 -9.7828967677E-24 -1.0386422308E-04 -2.2037948981E-07 -4.9407687293E-05  1.2755865830E-07
 -3.7058550320E-05 -4.4919810194E-07 -4.9407687293E-05  1.2755865830E-07 -1.4662019046E-04 -7.0718698232E-07

 Tensor_qq(ke,je,3,1), prototypical atom
 -6.9107004397E-05  1.8026429966E-07 -3.7058550320E-05  4.4919810194E-07  1.0803115046E-04  0.0000000000E+00
 -3.7058550320E-05  4.4919810194E-07 -3.1163693745E-05  3.7325409200E-07 -1.3076144618E-04  1.0268985986E-07
  1.0803115046E-04 -1.0440939130E-23 -1.3076144618E-04  1.0268985986E-07  1.4153817831E-04 -2.5010447771E-07

 Tensor_qq(ke,je,1,2), prototypical atom
  2.1738679016E-04  1.8703366824E-06  1.7765664951E-04 -2.0881878260E-23 -3.7058550320E-05 -4.4919810194E-07
  1.7765664951E-04 -2.0223835898E-23 -1.0386422308E-04 -2.2037948981E-07 -4.9407687293E-05  1.2755865830E-07
 -3.7058550320E-05 -4.4919810194E-07 -4.9407687293E-05  1.2755865830E-07 -1.4662019046E-04 -7.0718698232E-07

 Tensor_qq(ke,je,2,2), prototypical atom
 -3.9803853741E-05  3.0433473144E-08 -1.0386422308E-04  2.2037948981E-07 -3.1163693745E-05 -3.7325409200E-07
 -1.0386422308E-04  2.2037948981E-07  2.4160005864E-04  0.0000000000E+00  1.5476702854E-04  1.4655645172E-06
 -3.1163693745E-05 -3.7325409200E-07  1.5476702854E-04  1.4655645172E-06  8.5684628952E-05 -5.8163929716E-07

 Tensor_qq(ke,je,3,2), prototypical atom
 -2.6366267697E-05  1.5946207772E-07 -4.9407687293E-05 -1.2755865830E-07 -1.3076144618E-04 -1.0268985986E-07
 -4.9407687293E-05 -1.2755865830E-07  1.5476702854E-04 -1.4655645172E-06  3.0671348740E-04  1.2575465485E-23
 -1.3076144618E-04 -1.0268985986E-07  3.0671348740E-04  1.0440939130E-23 -1.5499613290E-04 -3.1294315699E-07

 Tensor_qq(ke,je,1,3), prototypical atom
 -6.9107004397E-05  1.8026429966E-07 -3.7058550320E-05  4.4919810194E-07  1.0803115046E-04 -2.0881878260E-23
 -3.7058550320E-05  4.4919810194E-07 -3.1163693745E-05  3.7325409200E-07 -1.3076144618E-04  1.0268985986E-07
  1.0803115046E-04 -4.1763756521E-23 -1.3076144618E-04  1.0268985986E-07  1.4153817831E-04 -2.5010447771E-07

 Tensor_qq(ke,je,2,3), prototypical atom
 -2.6366267697E-05  1.5946207772E-07 -4.9407687293E-05 -1.2755865830E-07 -1.3076144618E-04 -1.0268985986E-07
 -4.9407687293E-05 -1.2755865830E-07  1.5476702854E-04 -1.4655645172E-06  3.0671348740E-04  2.1345263550E-24
 -1.3076144618E-04 -1.0268985986E-07  3.0671348740E-04  1.0440939130E-23 -1.5499613290E-04 -3.1294315699E-07

 Tensor_qq(ke,je,3,3), prototypical atom
 -1.5424549445E-04 -1.0896079121E-06 -1.4662019046E-04  7.0718698232E-07  1.4153817831E-04  2.5010447771E-07
 -1.4662019046E-04  7.0718698232E-07  8.5684628952E-05  5.8163929716E-07 -1.5499613290E-04  3.1294315699E-07
  1.4153817831E-04  2.5010447771E-07 -1.5499613290E-04  3.1294315699E-07  4.1757612509E-04  4.1763756521E-23

 Crystal Tensor_dd(ke,ks) (Mbarn)
  8.2564626944E-01  0.0000000000E+00  0.0000000000E+00 -1.0842021725E-19  1.3688160991E-02  0.0000000000E+00
  0.0000000000E+00  1.0842021725E-19  7.1685494607E-01  0.0000000000E+00  0.0000000000E+00 -5.4210108624E-20
  1.3688160991E-02  0.0000000000E+00  0.0000000000E+00  5.4210108624E-20  7.1982073011E-01  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  3.3343043807E-03  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22 -5.5285603517E-04  0.0000000000E+00
  0.0000000000E+00 -4.2351647363E-22 -3.1843082992E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -5.5285603517E-04  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23 -1.2339639556E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  4.2351647363E-22  1.4212531961E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.4212531961E-03  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23 -3.9526149835E-04  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22 -3.9526149835E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22

 Crystal Tensor_qq(ke,je,3,1)
 -5.5285603517E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  8.6424920372E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -2.4930954996E-04  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23
  8.6424920372E-04  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23  1.1323054265E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  4.2351647363E-22  1.4212531961E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.4212531961E-03  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23 -3.9526149835E-04  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22 -3.9526149835E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22

 Crystal Tensor_qq(ke,je,2,2)
 -3.1843082992E-04  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23 -2.4930954996E-04  0.0000000000E+00
  0.0000000000E+00 -5.2939559203E-23  1.9328004691E-03  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22
 -2.4930954996E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22  6.8547703162E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  0.0000000000E+00 -3.9526149835E-04  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23
 -3.9526149835E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22  2.4537078992E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.4537078992E-03  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22

 Crystal Tensor_qq(ke,je,1,3)
 -5.5285603517E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  8.6424920372E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -2.4930954996E-04  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23
  8.6424920372E-04  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23  1.1323054265E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00 -5.2939559203E-23 -3.9526149835E-04  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23
 -3.9526149835E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22  2.4537078992E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.4537078992E-03  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22

 Crystal Tensor_qq(ke,je,3,3)
 -1.2339639556E-03  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22  1.1323054265E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  6.8547703162E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.1323054265E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  3.3406090007E-03  0.0000000000E+00

 Convertion factor =  77.99095 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -15.300  7.70167E-01  7.43113E-01  7.18487E-01  7.48372E-01  7.79517E-01  7.19467E-01  7.55687E-01
   dip-dip  7.67925E-01  7.42390E-01  7.16855E-01  7.47199E-01  7.77542E-01  7.18291E-01  7.54107E-01
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  2.24256E-03  7.23554E-04  1.63240E-03  1.17305E-03  1.97424E-03  1.17572E-03  1.57948E-03

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -1.81490E-15  1.22845E-05 -1.39829E-15 -1.75501E-05 -3.28397E-16  1.72127E-04  1.42626E-16  1.83391E-03
   dip-dip -1.80671E-15  2.44024E-15 -1.39992E-15  2.61923E-15 -3.60538E-16  1.75195E-04  1.32683E-16  1.80937E-03
   dip-qua -6.37721E-18 -2.23444E-17  3.06420E-18 -1.91093E-17  3.31900E-17  4.87183E-17  1.15149E-17  6.07014E-17
   qua-qua -1.81012E-18  1.22845E-05 -1.42985E-18 -1.75501E-05 -1.04921E-18 -3.06805E-06 -1.57182E-18  2.45449E-05

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -15.20000 eV

 Vmoy = -20.15288 eV, Vmftabs(up) = -25.35932 eV, Vmftabs(dn) = -25.05100 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -3.318E-05   1.757E-02   2.710E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -2.266E-05   1.200E-02   1.851E-03
  1 -1    1  1    -2.479E-02   7.498E-01   7.150E-02
  1 -1    1  2     2.968E-03  -8.884E-02  -8.372E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -7.448E-03   2.267E-01   2.176E-02
  1  0    1  1    -1.973E-02   5.986E-01   5.725E-02
  1  0    1  2     2.579E-03  -7.720E-02  -7.275E-03
  1  0    2  1     2.937E-03  -8.622E-02  -7.945E-03
  1  0    2  2    -8.424E-03   2.553E-01   2.440E-02
  1  1    1  1    -1.585E-02   4.824E-01   4.630E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     2.552E-03  -7.492E-02  -6.904E-03
  1  1    2  2    -9.144E-03   2.764E-01   2.634E-02
  2 -2    1  1     1.947E-03  -9.670E-02  -1.558E-02
  2 -2    1  2    -1.104E-05   4.882E-04   7.161E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     1.823E-03  -9.068E-02  -1.462E-02
  2 -1    1  1     1.941E-03  -9.644E-02  -1.554E-02
  2 -1    1  2    -1.352E-05   5.979E-04   8.769E-05
  2 -1    2  1    -1.118E-05   4.919E-04   7.181E-05
  2 -1    2  2     1.829E-03  -9.091E-02  -1.466E-02
  2  0    1  1     1.936E-03  -9.619E-02  -1.550E-02
  2  0    1  2    -1.352E-05   5.978E-04   8.768E-05
  2  0    2  1    -1.370E-05   6.024E-04   8.793E-05
  2  0    2  2     1.834E-03  -9.114E-02  -1.469E-02
  2  1    1  1     1.930E-03  -9.593E-02  -1.547E-02
  2  1    1  2    -1.104E-05   4.881E-04   7.158E-05
  2  1    2  1    -1.370E-05   6.023E-04   8.792E-05
  2  1    2  2     1.839E-03  -9.138E-02  -1.473E-02
  2  2    1  1     1.924E-03  -9.567E-02  -1.543E-02
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -1.118E-05   4.917E-04   7.178E-05
  2  2    2  2     1.845E-03  -9.161E-02  -1.476E-02

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  6.9937167839E-02  5.3458589274E-21 -9.0910505579E-04 -1.7819480806E-04  1.1044599318E-02 -9.7505399398E-05
 -9.0910505579E-04  1.7819480806E-04  7.3881398021E-02  2.3740382671E-36  8.0968401559E-05 -1.1492411211E-04
  1.1044599318E-02  9.7505399398E-05  8.0968401559E-05  1.1492411211E-04  5.9084303159E-02  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
  2.8524572577E-03 -3.5658768193E-05  1.2173445638E-03  3.2139105534E-07 -1.8657592964E-03 -1.0909960746E-07
  1.2173445638E-03  3.2139105534E-07  1.1212610071E-03  1.7313492398E-05  2.5014715090E-03  1.0415798083E-05
 -1.8657592964E-03 -1.0909960746E-07  2.5014715090E-03  1.0415798083E-05 -2.8632199251E-03  2.6649419625E-05

 Tensor_dq(2,ks,j2), prototypical atom
  3.7600570822E-03 -3.1330691715E-05  3.0082054420E-03  2.0058566641E-05  7.4764520021E-04  2.6869740150E-05
  3.0082054420E-03  2.0058566641E-05 -2.9158343057E-03  4.7494474535E-05 -3.5721442240E-03 -4.4028590080E-06
  7.4764520021E-04  2.6869740150E-05 -3.5721442240E-03 -4.4028590080E-06 -3.0378562221E-04 -2.1858492027E-05

 Tensor_dq(3,ks,j2), prototypical atom
  1.4971906012E-03  8.9475239855E-06  1.2241136935E-03  2.4929577206E-05 -1.6177204837E-03 -9.3824985927E-06
  1.2241136935E-03  2.4929577206E-05 -2.1875102409E-04 -6.1350167388E-06  2.0028875765E-03  7.7375578581E-06
 -1.6177204837E-03 -9.3824985927E-06  2.0028875765E-03  7.7375578581E-06 -3.6131492959E-03  7.5249987184E-06

 Tensor_qq(ke,je,1,1), prototypical atom
  7.1135660503E-04 -1.6705809148E-22  4.4343034917E-04 -6.1310016776E-06 -1.1823463724E-04 -1.5140147539E-06
  4.4343034917E-04 -6.1310016776E-06 -1.5563574589E-04 -3.1589821325E-06 -7.4792444857E-05  8.1061234866E-07
 -1.1823463724E-04 -1.5140147539E-06 -7.4792444857E-05  8.1061234866E-07 -3.2681288280E-04  1.9311068874E-06

 Tensor_qq(ke,je,2,1), prototypical atom
  4.4343034917E-04  6.1310016776E-06  3.3432393759E-04 -4.1764522871E-23 -6.2554789210E-05 -1.9581348911E-06
  3.3432393759E-04  9.5505069951E-25 -1.8026646203E-04 -4.5937434014E-06 -1.0024972166E-04 -5.9299001712E-07
 -6.2554789210E-05 -1.9581348911E-06 -1.0024972166E-04 -5.9299001712E-07 -2.3755623619E-04 -1.7023413199E-06

 Tensor_qq(ke,je,3,1), prototypical atom
 -1.1823463724E-04  1.5140147539E-06 -6.2554789210E-05  1.9581348911E-06  1.5940876122E-04 -1.6705809148E-22
 -6.2554789210E-05  1.9581348911E-06 -7.1712110110E-05 -1.9569849642E-06 -2.0998646763E-04 -1.4162852840E-06
  1.5940876122E-04 -8.3529045741E-23 -2.0998646763E-04 -1.4162852840E-06  2.2284877795E-04  1.7453339169E-06

 Tensor_qq(ke,je,1,2), prototypical atom
  4.4343034917E-04  6.1310016776E-06  3.3432393759E-04 -4.1764522871E-23 -6.2554789210E-05 -1.9581348911E-06
  3.3432393759E-04  9.5505069951E-25 -1.8026646203E-04 -4.5937434014E-06 -1.0024972166E-04 -5.9299001712E-07
 -6.2554789210E-05 -1.9581348911E-06 -1.0024972166E-04 -5.9299001712E-07 -2.3755623619E-04 -1.7023413199E-06

 Tensor_qq(ke,je,2,2), prototypical atom
 -1.5563574589E-04  3.1589821325E-06 -1.8026646203E-04  4.5937434014E-06 -7.1712110110E-05  1.9569849642E-06
 -1.8026646203E-04  4.5937434014E-06  3.0329988818E-04  9.2735869807E-39  2.6968190255E-04 -2.9318562313E-06
 -7.1712110110E-05  1.9569849642E-06  2.6968190255E-04 -2.9318562313E-06  2.3293984623E-05 -2.7162821209E-06

 Tensor_qq(ke,je,3,2), prototypical atom
 -7.4792444857E-05 -8.1061234866E-07 -1.0024972166E-04  5.9299001712E-07 -2.0998646763E-04  1.4162852840E-06
 -1.0024972166E-04  5.9299001712E-07  2.6968190255E-04  2.9318562313E-06  4.7209984197E-04  3.5383418593E-23
 -2.0998646763E-04  1.4162852840E-06  4.7209984197E-04  0.0000000000E+00 -2.5173157498E-04 -3.7613093802E-06

 Tensor_qq(ke,je,1,3), prototypical atom
 -1.1823463724E-04  1.5140147539E-06 -6.2554789210E-05  1.9581348911E-06  1.5940876122E-04  0.0000000000E+00
 -6.2554789210E-05  1.9581348911E-06 -7.1712110110E-05 -1.9569849642E-06 -2.0998646763E-04 -1.4162852840E-06
  1.5940876122E-04 -2.5058713722E-22 -2.0998646763E-04 -1.4162852840E-06  2.2284877795E-04  1.7453339169E-06

 Tensor_qq(ke,je,2,3), prototypical atom
 -7.4792444857E-05 -8.1061234866E-07 -1.0024972166E-04  5.9299001712E-07 -2.0998646763E-04  1.4162852840E-06
 -1.0024972166E-04  5.9299001712E-07  2.6968190255E-04  2.9318562313E-06  4.7209984197E-04  3.5383418593E-23
 -2.0998646763E-04  1.4162852840E-06  4.7209984197E-04  0.0000000000E+00 -2.5173157498E-04 -3.7613093802E-06

 Tensor_qq(ke,je,3,3), prototypical atom
 -3.2681288280E-04 -1.9311068874E-06 -2.3755623619E-04  1.7023413199E-06  2.2284877795E-04 -1.7453339169E-06
 -2.3755623619E-04  1.7023413199E-06  2.3293984623E-05  2.7162821209E-06 -2.5173157498E-04  3.7613093802E-06
  2.2284877795E-04 -1.7453339169E-06 -2.5173157498E-04  3.7613093802E-06  5.2178782187E-04 -3.3411618296E-22

 Crystal Tensor_dd(ke,ks) (Mbarn)
  5.5949734271E-01  0.0000000000E+00  0.0000000000E+00  5.4210108624E-20  8.8356794543E-02  0.0000000000E+00
  0.0000000000E+00 -5.4210108624E-20  5.9105118417E-01  0.0000000000E+00  0.0000000000E+00  2.7105054312E-20
  8.8356794543E-02  0.0000000000E+00  0.0000000000E+00 -2.7105054312E-20  4.7267442527E-01  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  5.6908528402E-03  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21 -9.4587709793E-04  0.0000000000E+00
  0.0000000000E+00  1.6940658945E-21 -1.2450859671E-03  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22
 -9.4587709793E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22 -2.6145030624E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00 -1.6940658945E-21  2.6745915007E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  2.6745915007E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -8.0199777325E-04  0.0000000000E+00
  0.0000000000E+00  8.4703294725E-22 -8.0199777325E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22

 Crystal Tensor_qq(ke,je,3,1)
 -9.4587709793E-04  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22  1.2752700898E-03  0.0000000000E+00
  0.0000000000E+00  8.4703294725E-22 -5.7369688088E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22
  1.2752700898E-03  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22  1.7827902236E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  1.6940658945E-21  2.6745915007E-03  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22
  2.6745915007E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -8.0199777325E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -8.0199777325E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22

 Crystal Tensor_qq(ke,je,2,2)
 -1.2450859671E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -5.7369688088E-04  0.0000000000E+00
  0.0000000000E+00  1.6940658945E-21  2.4263991054E-03  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22
 -5.7369688088E-04  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22  1.8635187699E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  2.1175823681E-22 -8.0199777325E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -8.0199777325E-04  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22  3.7767987358E-03  0.0000000000E+00
  0.0000000000E+00 -4.2351647363E-22  3.7767987358E-03  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22

 Crystal Tensor_qq(ke,je,1,3)
 -9.4587709793E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.2752700898E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -5.7369688088E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22
  1.2752700898E-03  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22  1.7827902236E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  2.1175823681E-22 -8.0199777325E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -8.0199777325E-04  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22  3.7767987358E-03  0.0000000000E+00
  0.0000000000E+00 -4.2351647363E-22  3.7767987358E-03  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22

 Crystal Tensor_qq(ke,je,3,3)
 -2.6145030624E-03  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22  1.7827902236E-03  0.0000000000E+00
  0.0000000000E+00  4.2351647363E-22  1.8635187699E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.7827902236E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.1743025750E-03  0.0000000000E+00

 Convertion factor =  77.99238 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -15.200  4.39988E-01  5.14764E-01  5.93576E-01  5.95587E-01  5.99374E-01  4.60533E-01  5.43684E-01
   dip-dip  4.36062E-01  5.13557E-01  5.91051E-01  5.93581E-01  5.96110E-01  4.58748E-01  5.41074E-01
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  3.92625E-03  1.20787E-03  2.52514E-03  2.00667E-03  3.26390E-03  1.78491E-03  2.60965E-03

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -1.14439E-15 -1.32879E-04 -9.38359E-16 -1.08029E-04  1.25551E-16 -5.57210E-04  5.81169E-17 -5.21749E-03
   dip-dip -1.13947E-15  1.84115E-15 -9.36006E-16  1.65534E-15  1.21542E-16 -7.29434E-04  3.26118E-17 -5.05479E-03
   dip-qua -2.17643E-18 -2.87641E-17 -8.71530E-19 -1.23976E-17  6.77064E-18  6.47172E-17  2.81840E-17  8.97162E-17
   qua-qua -2.75007E-18 -1.32879E-04 -1.48112E-18 -1.08029E-04 -2.76145E-18  1.72225E-04 -2.67896E-18 -1.62697E-04

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -15.10000 eV

 Vmoy = -20.15414 eV, Vmftabs(up) = -25.36065 eV, Vmftabs(dn) = -25.05252 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -3.208E-05   1.699E-02   2.621E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -2.204E-05   1.167E-02   1.800E-03
  1 -1    1  1    -2.334E-02   7.060E-01   6.733E-02
  1 -1    1  2     2.792E-03  -8.357E-02  -7.875E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -7.022E-03   2.137E-01   2.051E-02
  1  0    1  1    -1.859E-02   5.639E-01   5.393E-02
  1  0    1  2     2.427E-03  -7.265E-02  -6.846E-03
  1  0    2  1     2.763E-03  -8.111E-02  -7.473E-03
  1  0    2  2    -7.940E-03   2.406E-01   2.300E-02
  1  1    1  1    -1.494E-02   4.546E-01   4.363E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     2.402E-03  -7.051E-02  -6.497E-03
  1  1    2  2    -8.619E-03   2.606E-01   2.483E-02
  2 -2    1  1     1.768E-03  -8.777E-02  -1.414E-02
  2 -2    1  2    -1.004E-05   4.437E-04   6.508E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     1.655E-03  -8.229E-02  -1.327E-02
  2 -1    1  1     1.762E-03  -8.754E-02  -1.411E-02
  2 -1    1  2    -1.229E-05   5.434E-04   7.970E-05
  2 -1    2  1    -1.016E-05   4.470E-04   6.527E-05
  2 -1    2  2     1.659E-03  -8.250E-02  -1.330E-02
  2  0    1  1     1.757E-03  -8.731E-02  -1.407E-02
  2  0    1  2    -1.229E-05   5.433E-04   7.969E-05
  2  0    2  1    -1.245E-05   5.475E-04   7.993E-05
  2  0    2  2     1.664E-03  -8.271E-02  -1.333E-02
  2  1    1  1     1.752E-03  -8.707E-02  -1.404E-02
  2  1    1  2    -1.003E-05   4.435E-04   6.506E-05
  2  1    2  1    -1.245E-05   5.474E-04   7.992E-05
  2  1    2  2     1.669E-03  -8.292E-02  -1.336E-02
  2  2    1  1     1.746E-03  -8.684E-02  -1.400E-02
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -1.016E-05   4.469E-04   6.525E-05
  2  2    2  2     1.674E-03  -8.313E-02  -1.340E-02

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  4.1949231802E-02 -2.6729785101E-21 -1.2313680283E-03 -6.4652837879E-05 -2.1153212366E-03  2.7746389841E-05
 -1.2313680283E-03  6.4652837879E-05  4.3094676637E-02 -2.2257017147E-37 -5.2060063371E-04 -4.6721999355E-05
 -2.1153212366E-03 -2.7746389841E-05 -5.2060063371E-04  4.6721999355E-05  3.7248243646E-02 -2.6729785101E-21

 Tensor_dq(1,ks,j2), prototypical atom
  9.4005176101E-04 -1.1956231280E-05  2.1502523988E-04 -9.7334049234E-08 -6.9998572900E-04 -2.7176312402E-06
  2.1502523988E-04 -9.7334049234E-08  9.0991611561E-04  4.0304053982E-06  1.2269462715E-03  6.0619256282E-06
 -6.9998572900E-04 -2.7176312402E-06  1.2269462715E-03  6.0619256282E-06 -9.3047080040E-04  7.5453657975E-06

 Tensor_dq(2,ks,j2), prototypical atom
  1.7307469748E-03 -1.5259202222E-05  1.4966867099E-03  1.1531027981E-05  6.4678698604E-04  1.6608926536E-05
  1.4966867099E-03  1.1531027981E-05 -1.6607843926E-03  2.7549502357E-05 -2.1282401710E-03 -5.3670258153E-06
  6.4678698604E-04  1.6608926536E-05 -2.1282401710E-03 -5.3670258153E-06  2.7645531930E-04 -1.4676088058E-05

 Tensor_dq(3,ks,j2), prototypical atom
 -6.8252795628E-05  3.9270765349E-06  2.0791900346E-04  7.0678006300E-06 -6.8185349414E-04 -4.0636546565E-06
  2.0791900346E-04  7.0678006300E-06 -1.9623901965E-04 -9.1745003662E-06  9.3660018017E-04  8.2316506604E-07
 -6.8185349414E-04 -4.0636546565E-06  9.3660018017E-04  8.2316506604E-07 -1.4256732906E-03  6.8652930682E-06

 Tensor_qq(ke,je,1,1), prototypical atom
  3.9077619439E-04  0.0000000000E+00  2.3598702817E-04 -3.0509247876E-06 -3.2285451254E-05 -1.3452258662E-06
  2.3598702817E-04 -3.0509247876E-06 -7.4911589934E-05 -1.5906671168E-06 -9.2247359701E-05  1.1583345133E-06
 -3.2285451254E-05 -1.3452258662E-06 -9.2247359701E-05  1.1583345133E-06 -1.1291350542E-04  1.1079575831E-06

 Tensor_qq(ke,je,2,1), prototypical atom
  2.3598702817E-04  3.0509247876E-06  1.9246377191E-04 -4.1765289220E-23 -1.0610417756E-05 -9.8895947451E-07
  1.9246377191E-04  2.2694149904E-24 -1.1410889172E-04 -2.6412278190E-06 -1.0125176560E-04 -4.9402626149E-07
 -1.0610417756E-05 -9.8895947451E-07 -1.0125176560E-04 -4.9402626149E-07 -9.1637931030E-05 -1.6719322315E-07

 Tensor_qq(ke,je,3,1), prototypical atom
 -3.2285451254E-05  1.3452258662E-06 -1.0610417756E-05  9.8895947451E-07  1.0475390938E-04 -8.3530578440E-23
 -1.0610417756E-05  9.8895947451E-07 -6.3772731509E-05 -2.0176463353E-06 -1.4098298411E-04 -1.2158778439E-06
  1.0475390938E-04  0.0000000000E+00 -1.4098298411E-04 -1.2158778439E-06  1.1898572855E-04  1.3172515320E-06

 Tensor_qq(ke,je,1,2), prototypical atom
  2.3598702817E-04  3.0509247876E-06  1.9246377191E-04  0.0000000000E+00 -1.0610417756E-05 -9.8895947451E-07
  1.9246377191E-04  2.2694149904E-24 -1.1410889172E-04 -2.6412278190E-06 -1.0125176560E-04 -4.9402626149E-07
 -1.0610417756E-05 -9.8895947451E-07 -1.0125176560E-04 -4.9402626149E-07 -9.1637931030E-05 -1.6719322315E-07

 Tensor_qq(ke,je,2,2), prototypical atom
 -7.4911589934E-05  1.5906671168E-06 -1.1410889172E-04  2.6412278190E-06 -6.3772731509E-05  2.0176463353E-06
 -1.1410889172E-04  2.6412278190E-06  2.3356652178E-04  2.3184392861E-38  2.0808121891E-04 -2.7498796779E-06
 -6.3772731509E-05  2.0176463353E-06  2.0808121891E-04 -2.7498796779E-06 -1.4546297721E-05 -1.0654212385E-06

 Tensor_qq(ke,je,3,2), prototypical atom
 -9.2247359701E-05 -1.1583345133E-06 -1.0125176560E-04  4.9402626149E-07 -1.4098298411E-04  1.2158778439E-06
 -1.0125176560E-04  4.9402626149E-07  2.0808121891E-04  2.7498796779E-06  3.3860693076E-04 -2.3601305649E-23
 -1.4098298411E-04  1.2158778439E-06  3.3860693076E-04 -4.1765289220E-23 -1.5412376125E-04 -2.3529151346E-06

 Tensor_qq(ke,je,1,3), prototypical atom
 -3.2285451254E-05  1.3452258662E-06 -1.0610417756E-05  9.8895947451E-07  1.0475390938E-04  8.3530578440E-23
 -1.0610417756E-05  9.8895947451E-07 -6.3772731509E-05 -2.0176463353E-06 -1.4098298411E-04 -1.2158778439E-06
  1.0475390938E-04  8.3530578440E-23 -1.4098298411E-04 -1.2158778439E-06  1.1898572855E-04  1.3172515320E-06

 Tensor_qq(ke,je,2,3), prototypical atom
 -9.2247359701E-05 -1.1583345133E-06 -1.0125176560E-04  4.9402626149E-07 -1.4098298411E-04  1.2158778439E-06
 -1.0125176560E-04  4.9402626149E-07  2.0808121891E-04  2.7498796779E-06  3.3860693076E-04  1.8163983572E-23
 -1.4098298411E-04  1.2158778439E-06  3.3860693076E-04  0.0000000000E+00 -1.5412376125E-04 -2.3529151346E-06

 Tensor_qq(ke,je,3,3), prototypical atom
 -1.1291350542E-04 -1.1079575831E-06 -9.1637931030E-05  1.6719322315E-07  1.1898572855E-04 -1.3172515320E-06
 -9.1637931030E-05  1.6719322315E-07 -1.4546297721E-05  1.0654212385E-06 -1.5412376125E-04  2.3529151346E-06
  1.1898572855E-04 -1.3172515320E-06 -1.5412376125E-04  2.3529151346E-06  2.8180724095E-04  0.0000000000E+00

 Crystal Tensor_dd(ke,ks) (Mbarn)
  3.3559385441E-01  0.0000000000E+00  0.0000000000E+00  2.7105054312E-20 -1.6922569893E-02  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  3.4475741309E-01  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20
 -1.6922569893E-02  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20  2.9798594917E-01  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  3.1262095551E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -2.5828361003E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -5.9929271947E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -2.5828361003E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22 -9.0330804334E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00 -8.4703294725E-22  1.5397101753E-03  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22
  1.5397101753E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -8.1001412480E-04  0.0000000000E+00
  0.0000000000E+00 -4.2351647363E-22 -8.1001412480E-04  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23

 Crystal Tensor_qq(ke,je,3,1)
 -2.5828361003E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22  8.3803127503E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -5.1018185207E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  8.3803127503E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22  9.5188582839E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  0.0000000000E+00  1.5397101753E-03  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22
  1.5397101753E-03  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22 -8.1001412480E-04  0.0000000000E+00
  0.0000000000E+00  4.2351647363E-22 -8.1001412480E-04  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23

 Crystal Tensor_qq(ke,je,2,2)
 -5.9929271947E-04  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22 -5.1018185207E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.8685321743E-03  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22
 -5.1018185207E-04  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22 -1.1637038177E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  0.0000000000E+00 -8.1001412480E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22
 -8.1001412480E-04  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22  2.7088554460E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.7088554460E-03  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22

 Crystal Tensor_qq(ke,je,1,3)
 -2.5828361003E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22  8.3803127503E-04  0.0000000000E+00
  0.0000000000E+00  4.2351647363E-22 -5.1018185207E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  8.3803127503E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  9.5188582839E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  4.2351647363E-22 -8.1001412480E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22
 -8.1001412480E-04  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22  2.7088554460E-03  0.0000000000E+00
  0.0000000000E+00  4.2351647363E-22  2.7088554460E-03  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22

 Crystal Tensor_qq(ke,je,3,3)
 -9.0330804334E-04  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23  9.5188582839E-04  0.0000000000E+00
  0.0000000000E+00 -5.2939559203E-23 -1.1637038177E-04  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22
  9.5188582839E-04  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22  2.2544579276E-03  0.0000000000E+00

 Convertion factor =  77.99382 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -15.100  3.39399E-01  3.41414E-01  3.46179E-01  3.22402E-01  2.98583E-01  3.02082E-01  3.27721E-01
   dip-dip  3.36572E-01  3.40665E-01  3.44757E-01  3.20883E-01  2.97008E-01  3.01022E-01  3.26112E-01
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  2.82725E-03  7.49504E-04  1.42132E-03  1.51937E-03  1.57482E-03  1.06003E-03  1.60853E-03

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -6.83062E-16 -1.08408E-04 -7.76018E-16 -7.25533E-05  1.72969E-17  3.82308E-04 -3.00709E-17  1.38549E-03
   dip-dip -6.82304E-16  1.02910E-15 -7.71848E-16  1.31168E-15 -6.35923E-18  2.52065E-04 -3.80088E-17  1.53238E-03
   dip-qua  9.88941E-19 -9.97791E-18 -2.64981E-18 -1.22967E-17  2.48791E-17  3.05620E-17  1.07851E-17  4.91512E-17
   qua-qua -1.74696E-18 -1.08408E-04 -1.52037E-18 -7.25533E-05 -1.22294E-18  1.30243E-04 -2.84719E-18 -1.46884E-04

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -15.00000 eV

 Vmoy = -20.15548 eV, Vmftabs(up) = -25.36133 eV, Vmftabs(dn) = -25.05403 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -3.108E-05   1.646E-02   2.539E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -2.147E-05   1.136E-02   1.753E-03
  1 -1    1  1    -2.207E-02   6.676E-01   6.366E-02
  1 -1    1  2     2.637E-03  -7.894E-02  -7.438E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -6.651E-03   2.024E-01   1.943E-02
  1  0    1  1    -1.759E-02   5.335E-01   5.102E-02
  1  0    1  2     2.294E-03  -6.865E-02  -6.469E-03
  1  0    2  1     2.610E-03  -7.661E-02  -7.059E-03
  1  0    2  2    -7.519E-03   2.279E-01   2.177E-02
  1  1    1  1    -1.414E-02   4.303E-01   4.130E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     2.270E-03  -6.663E-02  -6.139E-03
  1  1    2  2    -8.160E-03   2.467E-01   2.351E-02
  2 -2    1  1     1.617E-03  -8.029E-02  -1.294E-02
  2 -2    1  2    -9.189E-06   4.064E-04   5.961E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     1.513E-03  -7.525E-02  -1.214E-02
  2 -1    1  1     1.612E-03  -8.008E-02  -1.290E-02
  2 -1    1  2    -1.125E-05   4.976E-04   7.300E-05
  2 -1    2  1    -9.308E-06   4.095E-04   5.979E-05
  2 -1    2  2     1.518E-03  -7.545E-02  -1.217E-02
  2  0    1  1     1.607E-03  -7.986E-02  -1.287E-02
  2  0    1  2    -1.125E-05   4.976E-04   7.299E-05
  2  0    2  1    -1.140E-05   5.014E-04   7.322E-05
  2  0    2  2     1.522E-03  -7.564E-02  -1.219E-02
  2  1    1  1     1.602E-03  -7.965E-02  -1.284E-02
  2  1    1  2    -9.186E-06   4.062E-04   5.959E-05
  2  1    2  1    -1.140E-05   5.014E-04   7.321E-05
  2  1    2  2     1.527E-03  -7.584E-02  -1.222E-02
  2  2    1  1     1.597E-03  -7.944E-02  -1.281E-02
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -9.305E-06   4.093E-04   5.977E-05
  2  2    2  2     1.531E-03  -7.603E-02  -1.225E-02

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  3.4730061644E-02  5.3460551129E-21  1.7521187618E-03 -1.4395046656E-05 -4.7141099015E-03  4.5382635715E-05
  1.7521187618E-03  1.4395046656E-05  2.8478966389E-02  6.4917491158E-38  2.3758535096E-03 -1.3568932439E-05
 -4.7141099015E-03 -4.5382635715E-05  2.3758535096E-03  1.3568932439E-05  3.2573502038E-02  2.6730275565E-21

 Tensor_dq(1,ks,j2), prototypical atom
  4.5843691652E-04 -6.4668412338E-06 -1.0469674561E-05  1.9773835753E-06 -1.4209698358E-04  2.8709393198E-07
 -1.0469674561E-05  1.9773835753E-06  6.3115342614E-04  2.8084404734E-06  6.0345497598E-04  1.3640577323E-06
 -1.4209698358E-04  2.8709393198E-07  6.0345497598E-04  1.3640577323E-06 -2.2720473565E-04  1.2384539309E-06

 Tensor_dq(2,ks,j2), prototypical atom
  6.2293457727E-04 -6.1744956058E-06  5.8000690733E-04  5.4837379928E-06  2.9899783828E-04  7.3198947817E-06
  5.8000690733E-04  5.4837379928E-06 -7.0720339422E-04  1.1668260680E-05 -7.2186847264E-04 -3.1964064704E-06
  2.9899783828E-04  7.3198947817E-06 -7.2186847264E-04 -3.1964064704E-06  1.7621147314E-04 -5.0910020305E-06

 Tensor_dq(3,ks,j2), prototypical atom
 -4.6050889983E-04 -9.0974911455E-07  7.3428972053E-06  1.6750010088E-06 -3.0394510813E-04 -1.5169525014E-06
  7.3428972053E-06  1.6750010088E-06 -4.9606113398E-04 -4.7368681226E-06  3.9382411922E-04  2.1159545393E-07
 -3.0394510813E-04 -1.5169525014E-06  3.9382411922E-04  2.1159545393E-07 -5.8629605176E-04  4.1302896736E-06

 Tensor_qq(ke,je,1,1), prototypical atom
  2.1993597135E-04  0.0000000000E+00  1.1811909605E-04 -1.2155945459E-06 -1.9944132340E-05 -6.3967515598E-07
  1.1811909605E-04 -1.2155945459E-06  7.7348284149E-07 -7.3925056629E-07 -3.9781017225E-05  4.3682488803E-07
 -1.9944132340E-05 -6.3967515598E-07 -3.9781017225E-05  4.3682488803E-07 -5.1290544307E-05  5.3384677530E-07

 Tensor_qq(ke,je,2,1), prototypical atom
  1.1811909605E-04  1.2155945459E-06  1.0924171023E-04  0.0000000000E+00 -8.3423359406E-06 -3.2799015792E-07
  1.0924171023E-04 -2.3564313749E-23 -5.2858430443E-05 -9.4727328459E-07 -5.6190897996E-05 -1.7400870655E-07
 -8.3423359406E-06 -3.2799015792E-07 -5.6190897996E-05 -1.7400870655E-07 -4.7739348878E-05 -9.6338208687E-08

 Tensor_qq(ke,je,3,1), prototypical atom
 -1.9944132340E-05  6.3967515598E-07 -8.3423359406E-06  3.2799015792E-07  6.8890279592E-05  0.0000000000E+00
 -8.3423359406E-06  3.2799015792E-07 -3.0740750435E-05 -9.8507636696E-07 -7.2466736995E-05 -4.3377917093E-07
  6.8890279592E-05  0.0000000000E+00 -7.2466736995E-05 -4.3377917093E-07  6.6858324741E-05  5.7821127391E-07

 Tensor_qq(ke,je,1,2), prototypical atom
  1.1811909605E-04  1.2155945459E-06  1.0924171023E-04  1.0441513892E-23 -8.3423359406E-06 -3.2799015792E-07
  1.0924171023E-04 -2.6812859640E-24 -5.2858430443E-05 -9.4727328459E-07 -5.6190897996E-05 -1.7400870655E-07
 -8.3423359406E-06 -3.2799015792E-07 -5.6190897996E-05 -1.7400870655E-07 -4.7739348878E-05 -9.6338208687E-08

 Tensor_qq(ke,je,2,2), prototypical atom
  7.7348284149E-07  7.3925056629E-07 -5.2858430443E-05  9.4727328459E-07 -3.0740750435E-05  9.8507636696E-07
 -5.2858430443E-05  9.4727328459E-07  1.5334201626E-04 -3.4777227406E-38  1.0810948809E-04 -1.0357220966E-06
 -3.0740750435E-05  9.8507636696E-07  1.0810948809E-04 -1.0357220966E-06 -1.0375515424E-05 -3.2289912380E-07

 Tensor_qq(ke,je,3,2), prototypical atom
 -3.9781017225E-05 -4.3682488803E-07 -5.6190897996E-05  1.7400870655E-07 -7.2466736995E-05  4.3377917093E-07
 -5.6190897996E-05  1.7400870655E-07  1.0810948809E-04  1.0357220966E-06  1.8498045548E-04  1.9969724360E-23
 -7.2466736995E-05  4.3377917093E-07  1.8498045548E-04  2.0883027785E-23 -8.2996341407E-05 -8.9301006227E-07

 Tensor_qq(ke,je,1,3), prototypical atom
 -1.9944132340E-05  6.3967515598E-07 -8.3423359406E-06  3.2799015792E-07  6.8890279592E-05  0.0000000000E+00
 -8.3423359406E-06  3.2799015792E-07 -3.0740750435E-05 -9.8507636696E-07 -7.2466736995E-05 -4.3377917093E-07
  6.8890279592E-05 -4.1766055570E-23 -7.2466736995E-05 -4.3377917093E-07  6.6858324741E-05  5.7821127391E-07

 Tensor_qq(ke,je,2,3), prototypical atom
 -3.9781017225E-05 -4.3682488803E-07 -5.6190897996E-05  1.7400870655E-07 -7.2466736995E-05  4.3377917093E-07
 -5.6190897996E-05  1.7400870655E-07  1.0810948809E-04  1.0357220966E-06  1.8498045548E-04 -9.1330342482E-25
 -7.2466736995E-05  4.3377917093E-07  1.8498045548E-04  0.0000000000E+00 -8.2996341407E-05 -8.9301006227E-07

 Tensor_qq(ke,je,3,3), prototypical atom
 -5.1290544307E-05 -5.3384677530E-07 -4.7739348878E-05  9.6338208687E-08  6.6858324741E-05 -5.7821127391E-07
 -4.7739348878E-05  9.6338208687E-08 -1.0375515424E-05  3.2289912380E-07 -8.2996341407E-05  8.9301006227E-07
  6.6858324741E-05 -5.7821127391E-07 -8.2996341407E-05  8.9301006227E-07  1.7825757532E-04 -1.2529816671E-22

 Crystal Tensor_dd(ke,ks) (Mbarn)
  2.7784049315E-01  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21 -3.7712879212E-02  0.0000000000E+00
  0.0000000000E+00 -3.3881317890E-21  2.2783173111E-01  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
 -3.7712879212E-02  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21  2.6058801630E-01  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  1.7594877708E-03  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22 -1.5955305872E-04  0.0000000000E+00
  0.0000000000E+00 -4.2351647363E-22  6.1878627319E-06  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
 -1.5955305872E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22 -4.1032435446E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  4.2351647363E-22  8.7393368181E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  8.7393368181E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -4.4952718397E-04  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22 -4.4952718397E-04  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23

 Crystal Tensor_qq(ke,je,3,1)
 -1.5955305872E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  5.5112223674E-04  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22 -2.4592600348E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  5.5112223674E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  5.3486659793E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  4.2351647363E-22  8.7393368181E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  8.7393368181E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -4.4952718397E-04  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22 -4.4952718397E-04  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23

 Crystal Tensor_qq(ke,je,2,2)
  6.1878627319E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -2.4592600348E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.2267361301E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -2.4592600348E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -8.3004123388E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  1.0587911841E-22 -4.4952718397E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22
 -4.4952718397E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.4798436439E-03  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22  1.4798436439E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,3)
 -1.5955305872E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  5.5112223674E-04  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22 -2.4592600348E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  5.5112223674E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22  5.3486659793E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  1.0587911841E-22 -4.4952718397E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22
 -4.4952718397E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.4798436439E-03  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22  1.4798436439E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,3)
 -4.1032435446E-04  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23  5.3486659793E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -8.3004123388E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  5.3486659793E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.4260606026E-03  0.0000000000E+00

 Convertion factor =  77.99525 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -15.000  3.09402E-01  2.68264E-01  2.28615E-01  2.30067E-01  2.31473E-01  2.67577E-01  2.56328E-01
   dip-dip  3.07832E-01  2.67832E-01  2.27832E-01  2.29214E-01  2.30597E-01  2.66901E-01  2.55420E-01
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  1.57053E-03  4.31987E-04  7.83243E-04  8.53310E-04  8.76853E-04  6.75818E-04  9.07608E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -6.19613E-16 -5.01294E-05 -6.59196E-16 -3.46149E-05  2.58853E-18  4.37478E-04  9.44352E-18  2.36596E-03
   dip-dip -6.23313E-16  8.09070E-16 -6.60753E-16  1.00468E-15 -2.12963E-18  3.77092E-04  8.10376E-18  2.43205E-03
   dip-qua  4.33577E-18 -1.30165E-18  2.38755E-18 -2.85765E-18  5.09482E-18  9.27276E-18  2.18377E-18  1.18250E-17
   qua-qua -6.36037E-19 -5.01294E-05 -8.29696E-19 -3.46149E-05 -3.76655E-19  6.03863E-05 -8.44009E-19 -6.60851E-05

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -14.90000 eV

 Vmoy = -20.15684 eV, Vmftabs(up) = -25.36200 eV, Vmftabs(dn) = -25.05553 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -3.015E-05   1.597E-02   2.463E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -2.094E-05   1.108E-02   1.710E-03
  1 -1    1  1    -2.095E-02   6.337E-01   6.043E-02
  1 -1    1  2     2.501E-03  -7.484E-02  -7.051E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -6.324E-03   1.924E-01   1.847E-02
  1  0    1  1    -1.670E-02   5.066E-01   4.846E-02
  1  0    1  2     2.176E-03  -6.511E-02  -6.135E-03
  1  0    2  1     2.474E-03  -7.264E-02  -6.692E-03
  1  0    2  2    -7.147E-03   2.166E-01   2.070E-02
  1  1    1  1    -1.344E-02   4.088E-01   3.924E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     2.153E-03  -6.320E-02  -5.822E-03
  1  1    2  2    -7.757E-03   2.345E-01   2.235E-02
  2 -2    1  1     1.489E-03  -7.394E-02  -1.191E-02
  2 -2    1  2    -8.471E-06   3.746E-04   5.497E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     1.393E-03  -6.928E-02  -1.117E-02
  2 -1    1  1     1.485E-03  -7.374E-02  -1.188E-02
  2 -1    1  2    -1.037E-05   4.588E-04   6.731E-05
  2 -1    2  1    -8.581E-06   3.775E-04   5.513E-05
  2 -1    2  2     1.397E-03  -6.946E-02  -1.120E-02
  2  0    1  1     1.480E-03  -7.355E-02  -1.185E-02
  2  0    1  2    -1.037E-05   4.587E-04   6.731E-05
  2  0    2  1    -1.051E-05   4.623E-04   6.752E-05
  2  0    2  2     1.401E-03  -6.964E-02  -1.123E-02
  2  1    1  1     1.476E-03  -7.335E-02  -1.183E-02
  2  1    1  2    -8.468E-06   3.745E-04   5.495E-05
  2  1    2  1    -1.051E-05   4.623E-04   6.751E-05
  2  1    2  2     1.405E-03  -6.982E-02  -1.125E-02
  2  2    1  1     1.471E-03  -7.315E-02  -1.180E-02
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -8.578E-06   3.774E-04   5.511E-05
  2  2    2  2     1.409E-03  -7.000E-02  -1.128E-02

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  3.9782373753E-02  0.0000000000E+00  6.8404730300E-03 -7.1423176582E-06 -2.4809488186E-03  5.9511444383E-05
  6.8404730300E-03  7.1423176582E-06  2.8092027354E-02 -1.7968563852E-38  5.3855862339E-03 -5.9772423231E-06
 -2.4809488186E-03 -5.9511444383E-05  5.3855862339E-03  5.9772423231E-06  3.6866169794E-02  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
  5.6582916998E-04 -8.7595479400E-06 -3.3962704662E-04  1.5982093946E-06  2.7622147044E-04  4.1908503506E-06
 -3.3962704662E-04  1.5982093946E-06  2.8745511692E-04  4.5034668801E-06  6.6052618368E-04  2.3487285714E-06
  2.7622147044E-04  4.1908503506E-06  6.6052618368E-04  2.3487285714E-06  2.3132385903E-05  8.7955926140E-07

 Tensor_dq(2,ks,j2), prototypical atom
  5.2339732125E-04 -6.3909910260E-06  8.2482600694E-05  3.0272126434E-06  2.7982781243E-04  6.2597564775E-06
  8.2482600694E-05  3.0272126434E-06 -6.1869984765E-04  9.8925445490E-06  4.7535383789E-05 -9.3210323859E-07
  2.7982781243E-04  6.2597564775E-06  4.7535383789E-05 -9.3210323859E-07  1.0412280272E-04 -7.9298312507E-07

 Tensor_dq(3,ks,j2), prototypical atom
 -6.7262213449E-04 -5.4467353079E-06 -4.6152015431E-05 -6.1276331620E-07 -1.1466255464E-04 -6.1462185975E-07
 -4.6152015431E-05 -6.1276331620E-07 -9.3284466734E-04 -1.9421398310E-06  3.2477756992E-04  5.2027529708E-08
 -1.1466255464E-04 -6.1462185975E-07  3.2477756992E-04  5.2027529708E-08 -1.0333887248E-04  4.9357412918E-06

 Tensor_qq(ke,je,1,1), prototypical atom
  1.6386237451E-04 -4.1766821920E-23  4.4556636995E-05 -4.8418469595E-07 -9.3783818049E-06 -7.1025272882E-07
  4.4556636995E-05 -4.8418469595E-07  3.2728395325E-05 -4.8821884803E-07 -1.7543635154E-06 -1.6868175115E-08
 -9.3783818049E-06 -7.1025272882E-07 -1.7543635154E-06 -1.6868175115E-08 -3.7825165552E-05  4.1458974682E-07

 Tensor_qq(ke,je,2,1), prototypical atom
  4.4556636995E-05  4.8418469595E-07  9.6058604148E-05  0.0000000000E+00 -1.2155343897E-05  4.0591340921E-08
  9.6058604148E-05  9.3634408476E-26 -2.0125846347E-05 -2.8181895174E-07 -6.0029618636E-05 -8.8836915875E-09
 -1.2155343897E-05  4.0591340921E-08 -6.0029618636E-05 -8.8836915875E-09 -2.0127012029E-05 -6.7836010498E-08

 Tensor_qq(ke,je,3,1), prototypical atom
 -9.3783818049E-06  7.1025272882E-07 -1.2155343897E-05 -4.0591340921E-08  5.9780299072E-05  4.1766821920E-23
 -1.2155343897E-05 -4.0591340921E-08 -2.2818341978E-05 -8.0100383009E-07 -3.6586426445E-05 -1.0007751124E-07
  5.9780299072E-05  1.2530046576E-22 -3.6586426445E-05 -1.0007751124E-07  4.8023376184E-05  1.9847401069E-07

 Tensor_qq(ke,je,1,2), prototypical atom
  4.4556636995E-05  4.8418469595E-07  9.6058604148E-05  0.0000000000E+00 -1.2155343897E-05  4.0591340921E-08
  9.6058604148E-05  9.3634408476E-26 -2.0125846347E-05 -2.8181895174E-07 -6.0029618636E-05 -8.8836915875E-09
 -1.2155343897E-05  4.0591340921E-08 -6.0029618636E-05 -8.8836915875E-09 -2.0127012029E-05 -6.7836010498E-08

 Tensor_qq(ke,je,2,2), prototypical atom
  3.2728395325E-05  4.8821884803E-07 -2.0125846347E-05  2.8181895174E-07 -2.2818341978E-05  8.0100383009E-07
 -2.0125846347E-05  2.8181895174E-07  1.3341201120E-04 -8.6401259652E-39  5.2803595856E-05 -2.3724000604E-07
 -2.2818341978E-05  8.0100383009E-07  5.2803595856E-05 -2.3724000604E-07 -2.0718637649E-05 -4.3645564282E-08

 Tensor_qq(ke,je,3,2), prototypical atom
 -1.7543635154E-06  1.6868175115E-08 -6.0029618636E-05  8.8836915875E-09 -3.6586426445E-05  1.0007751124E-07
 -6.0029618636E-05  8.8836915875E-09  5.2803595856E-05  2.3724000604E-07  1.3712574786E-04  1.4396964290E-25
 -3.6586426445E-05  1.0007751124E-07  1.3712574786E-04  6.5260659249E-25 -5.6330102802E-05 -3.9141559511E-07

 Tensor_qq(ke,je,1,3), prototypical atom
 -9.3783818049E-06  7.1025272882E-07 -1.2155343897E-05 -4.0591340921E-08  5.9780299072E-05 -6.2650232879E-23
 -1.2155343897E-05 -4.0591340921E-08 -2.2818341978E-05 -8.0100383009E-07 -3.6586426445E-05 -1.0007751124E-07
  5.9780299072E-05 -8.3533643839E-23 -3.6586426445E-05 -1.0007751124E-07  4.8023376184E-05  1.9847401069E-07

 Tensor_qq(ke,je,2,3), prototypical atom
 -1.7543635154E-06  1.6868175115E-08 -6.0029618636E-05  8.8836915875E-09 -3.6586426445E-05  1.0007751124E-07
 -6.0029618636E-05  8.8836915875E-09  5.2803595856E-05  2.3724000604E-07  1.3712574786E-04 -5.0863694960E-25
 -3.6586426445E-05  1.0007751124E-07  1.3712574786E-04 -6.5260659249E-25 -5.6330102802E-05 -3.9141559511E-07

 Tensor_qq(ke,je,3,3), prototypical atom
 -3.7825165552E-05 -4.1458974682E-07 -2.0127012029E-05  6.7836010498E-08  4.8023376184E-05 -1.9847401069E-07
 -2.0127012029E-05  6.7836010498E-08 -2.0718637649E-05  4.3645564282E-08 -5.6330102802E-05  3.9141559511E-07
  4.8023376184E-05 -1.9847401069E-07 -5.6330102802E-05  3.9141559511E-07  1.4417610740E-04  4.1766821920E-23

 Crystal Tensor_dd(ke,ks) (Mbarn)
  3.1825899002E-01  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21 -1.9847590549E-02  0.0000000000E+00
  0.0000000000E+00  1.6940658945E-21  2.2473621883E-01  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21
 -1.9847590549E-02  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21  2.9492935835E-01  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  1.3108989961E-03  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22 -7.5027054439E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.6182716260E-04  0.0000000000E+00  0.0000000000E+00  6.6174449004E-24
 -7.5027054439E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -3.0260132442E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00 -2.1175823681E-22  7.6846883319E-04  0.0000000000E+00  0.0000000000E+00 -1.3234889801E-23
  7.6846883319E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22 -4.8023694909E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -4.8023694909E-04  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23

 Crystal Tensor_qq(ke,je,3,1)
 -7.5027054439E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.7824239258E-04  0.0000000000E+00
  0.0000000000E+00  1.3234889801E-23 -1.8254673583E-04  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23
  4.7824239258E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  3.8418700947E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  0.0000000000E+00  7.6846883319E-04  0.0000000000E+00  0.0000000000E+00 -1.3234889801E-23
  7.6846883319E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22 -4.8023694909E-04  0.0000000000E+00
  0.0000000000E+00 -1.3234889801E-23 -4.8023694909E-04  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23

 Crystal Tensor_qq(ke,je,2,2)
  2.6182716260E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22 -1.8254673583E-04  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22  1.0672960896E-03  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23
 -1.8254673583E-04  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23 -1.6574910119E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  0.0000000000E+00 -4.8023694909E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -4.8023694909E-04  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23  1.0970059829E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.0970059829E-03  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22

 Crystal Tensor_qq(ke,je,1,3)
 -7.5027054439E-05  0.0000000000E+00  0.0000000000E+00 -1.3234889801E-23  4.7824239258E-04  0.0000000000E+00
  0.0000000000E+00 -1.3234889801E-23 -1.8254673583E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  4.7824239258E-04  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23  3.8418700947E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  0.0000000000E+00 -4.8023694909E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -4.8023694909E-04  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23  1.0970059829E-03  0.0000000000E+00
  0.0000000000E+00  2.6469779602E-23  1.0970059829E-03  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22

 Crystal Tensor_qq(ke,je,3,3)
 -3.0260132442E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  3.8418700947E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -1.6574910119E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22
  3.8418700947E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  1.1534088592E-03  0.0000000000E+00

 Convertion factor =  77.99668 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -14.900  3.29468E-01  2.76731E-01  2.25222E-01  2.55598E-01  2.85785E-01  2.98909E-01  2.80026E-01
   dip-dip  3.28089E-01  2.76412E-01  2.24736E-01  2.54918E-01  2.85100E-01  2.98349E-01  2.79308E-01
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  1.37946E-03  3.18515E-04  4.86014E-04  6.79716E-04  6.85153E-04  5.60467E-04  7.17952E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -6.16461E-16 -3.14825E-05 -6.61992E-16 -3.25158E-05  1.27275E-16  5.27870E-04 -4.73541E-17  3.13718E-03
   dip-dip -6.19154E-16  9.15956E-16 -6.63395E-16  9.95279E-16  1.31579E-16  4.87112E-04 -4.57063E-17  3.17896E-03
   dip-qua  3.44926E-18  4.47366E-18  2.35273E-18  5.33497E-18 -3.51910E-18 -2.74127E-18 -8.54732E-19  8.79618E-19
   qua-qua -7.56606E-19 -3.14825E-05 -9.50704E-19 -3.25158E-05 -7.84501E-19  4.07587E-05 -7.93110E-19 -4.17718E-05

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -14.80000 eV

 Vmoy = -20.15820 eV, Vmftabs(up) = -25.36267 eV, Vmftabs(dn) = -25.05694 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -2.929E-05   1.551E-02   2.393E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -2.045E-05   1.082E-02   1.670E-03
  1 -1    1  1    -1.995E-02   6.035E-01   5.755E-02
  1 -1    1  2     2.379E-03  -7.119E-02  -6.707E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -6.034E-03   1.836E-01   1.762E-02
  1  0    1  1    -1.592E-02   4.828E-01   4.618E-02
  1  0    1  2     2.070E-03  -6.196E-02  -5.838E-03
  1  0    2  1     2.354E-03  -6.909E-02  -6.365E-03
  1  0    2  2    -6.818E-03   2.066E-01   1.974E-02
  1  1    1  1    -1.281E-02   3.898E-01   3.741E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     2.049E-03  -6.014E-02  -5.541E-03
  1  1    2  2    -7.398E-03   2.237E-01   2.131E-02
  2 -2    1  1     1.379E-03  -6.849E-02  -1.103E-02
  2 -2    1  2    -7.855E-06   3.474E-04   5.098E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     1.290E-03  -6.416E-02  -1.035E-02
  2 -1    1  1     1.375E-03  -6.831E-02  -1.101E-02
  2 -1    1  2    -9.619E-06   4.255E-04   6.243E-05
  2 -1    2  1    -7.958E-06   3.501E-04   5.114E-05
  2 -1    2  2     1.294E-03  -6.433E-02  -1.037E-02
  2  0    1  1     1.371E-03  -6.812E-02  -1.098E-02
  2  0    1  2    -9.618E-06   4.254E-04   6.243E-05
  2  0    2  1    -9.745E-06   4.288E-04   6.263E-05
  2  0    2  2     1.298E-03  -6.449E-02  -1.040E-02
  2  1    1  1     1.367E-03  -6.794E-02  -1.095E-02
  2  1    1  2    -7.852E-06   3.473E-04   5.097E-05
  2  1    2  1    -9.744E-06   4.287E-04   6.262E-05
  2  1    2  2     1.302E-03  -6.466E-02  -1.042E-02
  2  2    1  1     1.363E-03  -6.776E-02  -1.093E-02
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -7.955E-06   3.500E-04   5.112E-05
  2  2    2  2     1.305E-03  -6.482E-02  -1.044E-02

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  4.7617037788E-02 -2.1385005194E-20  2.9964865939E-03 -2.0765507557E-04  6.5988355171E-03 -2.0324612015E-04
  2.9964865939E-03  2.0765507557E-04  2.7705845019E-02 -3.3387363489E-37  7.0274171219E-03 -1.7461826502E-04
  6.5988355171E-03  2.0324612015E-04  7.0274171219E-03  1.7461826502E-04  5.4153570885E-02  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
  4.7229309098E-04  5.2307609396E-06  5.8430379130E-04 -6.0374146021E-06  5.9753915293E-04  3.7353492575E-06
  5.8430379130E-04 -6.0374146021E-06 -3.7769280498E-04  8.2377339413E-06  6.8927811241E-04 -4.7128414937E-06
  5.9753915293E-04  3.7353492575E-06  6.8927811241E-04 -4.7128414937E-06  5.0619535742E-04  3.0189983137E-06

 Tensor_dq(2,ks,j2), prototypical atom
  7.9942670359E-04  2.0797921646E-05  1.9059058793E-04 -4.9181567758E-06  1.6571543154E-04  5.4335224840E-06
  1.9059058793E-04 -4.9181567758E-06 -9.2680909964E-04 -3.8323315203E-06  3.6489045098E-04 -7.1440823067E-06
  1.6571543154E-04  5.4335224840E-06  3.6489045098E-04 -7.1440823067E-06 -3.6031623273E-05 -3.5567729623E-06

 Tensor_dq(3,ks,j2), prototypical atom
 -7.1811760916E-04  2.2677568507E-05  8.3443911672E-04 -9.3982311658E-06  1.0492381619E-04  7.6688378287E-06
  8.3443911672E-04 -9.3982311658E-06 -2.1199854696E-03 -1.2179833925E-05  1.0768566792E-03  2.3171013070E-06
  1.0492381619E-04  7.6688378287E-06  1.0768566792E-03  2.3171013070E-06  5.9754188480E-04  6.0752649461E-07

 Tensor_qq(ke,je,1,1), prototypical atom
  2.0108749267E-04  0.0000000000E+00 -2.7402257103E-05  4.5977222689E-07  5.5949319141E-07  2.1339458667E-07
 -2.7402257103E-05  4.5977222689E-07  2.9269808283E-06 -1.3691726296E-06 -1.2697851729E-05  1.1753765187E-06
  5.5949319141E-07  2.1339458667E-07 -1.2697851729E-05  1.1753765187E-06 -6.4168204727E-05  4.9201214676E-07

 Tensor_qq(ke,je,2,1), prototypical atom
 -2.7402257103E-05 -4.5977222689E-07  1.0829995432E-04  4.1767588269E-23  1.3698612558E-05 -5.1711074957E-07
  1.0829995432E-04  5.6303999036E-23 -4.5569425938E-05  5.5564068806E-07 -5.2904299947E-06 -6.4278667428E-07
  1.3698612558E-05 -5.1711074957E-07 -5.2904299947E-06 -6.4278667428E-07  5.0261815914E-05 -2.0256606934E-07

 Tensor_qq(ke,je,3,1), prototypical atom
  5.5949319141E-07 -2.1339458667E-07  1.3698612558E-05  5.1711074957E-07  5.8861699255E-05  5.2209485336E-24
  1.3698612558E-05  5.1711074957E-07 -3.7710411281E-05 -3.5615244479E-07 -9.8594948792E-06 -1.6423448639E-07
  5.8861699255E-05  0.0000000000E+00 -9.8594948792E-06 -1.6423448639E-07  4.7747854987E-05  1.5908486945E-08

 Tensor_qq(ke,je,1,2), prototypical atom
 -2.7402257103E-05 -4.5977222689E-07  1.0829995432E-04  0.0000000000E+00  1.3698612558E-05 -5.1711074957E-07
  1.0829995432E-04 -2.7231177502E-23 -4.5569425938E-05  5.5564068806E-07 -5.2904299947E-06 -6.4278667428E-07
  1.3698612558E-05 -5.1711074957E-07 -5.2904299947E-06 -6.4278667428E-07  5.0261815914E-05 -2.0256606934E-07

 Tensor_qq(ke,je,2,2), prototypical atom
  2.9269808283E-06  1.3691726296E-06 -4.5569425938E-05 -5.5564068806E-07 -3.7710411281E-05  3.5615244479E-07
 -4.5569425938E-05 -5.5564068806E-07  2.3180666645E-04  0.0000000000E+00 -2.9045259474E-05 -4.5798599576E-07
 -3.7710411281E-05  3.5615244479E-07 -2.9045259474E-05 -4.5798599576E-07 -5.7196048242E-05  5.4075386385E-08

 Tensor_qq(ke,je,3,2), prototypical atom
 -1.2697851729E-05 -1.1753765187E-06 -5.2904299947E-06  6.4278667428E-07 -9.8594948792E-06  1.6423448639E-07
 -5.2904299947E-06  6.4278667428E-07 -2.9045259474E-05  4.5798599576E-07  1.1191341585E-04  1.0519050525E-22
 -9.8594948792E-06  1.6423448639E-07  1.1191341585E-04  8.3535176538E-23  2.9366932795E-06  3.0058122619E-07

 Tensor_qq(ke,je,1,3), prototypical atom
  5.5949319141E-07 -2.1339458667E-07  1.3698612558E-05  5.1711074957E-07  5.8861699255E-05  6.5261856671E-24
  1.3698612558E-05  5.1711074957E-07 -3.7710411281E-05 -3.5615244479E-07 -9.8594948792E-06 -1.6423448639E-07
  5.8861699255E-05  0.0000000000E+00 -9.8594948792E-06 -1.6423448639E-07  4.7747854987E-05  1.5908486945E-08

 Tensor_qq(ke,je,2,3), prototypical atom
 -1.2697851729E-05 -1.1753765187E-06 -5.2904299947E-06  6.4278667428E-07 -9.8594948792E-06  1.6423448639E-07
 -5.2904299947E-06  6.4278667428E-07 -2.9045259474E-05  4.5798599576E-07  1.1191341585E-04  6.3422916984E-23
 -9.8594948792E-06  1.6423448639E-07  1.1191341585E-04  0.0000000000E+00  2.9366932795E-06  3.0058122619E-07

 Tensor_qq(ke,je,3,3), prototypical atom
 -6.4168204727E-05 -4.9201214676E-07  5.0261815914E-05  2.0256606934E-07  4.7747854987E-05 -1.5908486945E-08
  5.0261815914E-05  2.0256606934E-07 -5.7196048242E-05 -5.4075386385E-08  2.9366932795E-06 -3.0058122619E-07
  4.7747854987E-05 -1.5908486945E-08  2.9366932795E-06 -3.0058122619E-07  1.7146925198E-04  1.5662845601E-23

 Crystal Tensor_dd(ke,ks) (Mbarn)
  3.8093630230E-01  0.0000000000E+00  0.0000000000E+00 -5.4210108624E-20  5.2790684137E-02  0.0000000000E+00
  0.0000000000E+00  5.4210108624E-20  2.2164676015E-01  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  5.2790684137E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.3322856708E-01  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  1.6086999414E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.4759455313E-06  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.3415846627E-05  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22
  4.4759455313E-06  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22 -5.1334563781E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00 -1.0587911841E-22  8.6639963457E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  8.6639963457E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22 -4.2323439958E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -4.2323439958E-05  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23

 Crystal Tensor_qq(ke,je,3,1)
  4.4759455313E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.7089359404E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -3.0168329025E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  4.7089359404E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  3.8198283989E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00 -1.0587911841E-22  8.6639963457E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  8.6639963457E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -4.2323439958E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -4.2323439958E-05  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23

 Crystal Tensor_qq(ke,je,2,2)
  2.3415846627E-05  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22 -3.0168329025E-04  0.0000000000E+00
  0.0000000000E+00  2.1175823681E-22  1.8544533316E-03  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22
 -3.0168329025E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22 -4.5756838593E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  4.2351647363E-22 -4.2323439958E-05  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23
 -4.2323439958E-05  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  8.9530732679E-04  0.0000000000E+00
  0.0000000000E+00  5.2939559203E-23  8.9530732679E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,3)
  4.4759455313E-06  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22  4.7089359404E-04  0.0000000000E+00
  0.0000000000E+00 -2.1175823681E-22 -3.0168329025E-04  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23
  4.7089359404E-04  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23  3.8198283989E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  4.2351647363E-22 -4.2323439958E-05  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23
 -4.2323439958E-05  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  8.9530732679E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  8.9530732679E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,3)
 -5.1334563781E-04  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23  3.8198283989E-04  0.0000000000E+00
  0.0000000000E+00 -5.2939559203E-23 -4.5756838593E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.8198283989E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.3717540159E-03  0.0000000000E+00

 Convertion factor =  77.99811 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -14.800  3.51634E-01  2.86752E-01  2.22488E-01  3.43639E-01  4.64378E-01  4.24747E-01  3.46103E-01
   dip-dip  3.50713E-01  2.86180E-01  2.21647E-01  3.42549E-01  4.63451E-01  4.24200E-01  3.45271E-01
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  9.20227E-04  5.71879E-04  8.41480E-04  1.08985E-03  9.26277E-04  5.46403E-04  8.32014E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -7.23286E-16 -1.70648E-05 -7.68536E-16 -4.02979E-06  1.17404E-16 -1.52604E-03 -1.40745E-16 -1.07068E-02
   dip-dip -7.30684E-16  1.31562E-15 -7.68551E-16  1.27053E-15  1.31918E-16 -1.54712E-03 -1.47603E-16 -1.06610E-02
   dip-qua  7.76572E-18  1.98943E-17  8.59703E-19  7.54664E-18 -1.41876E-17 -2.69572E-17  6.79782E-18  1.04988E-17
   qua-qua -3.68178E-19 -1.70648E-05 -8.45270E-19 -4.02979E-06 -3.26759E-19  2.10806E-05  6.07084E-20 -4.58725E-05

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -14.70000 eV

 Vmoy = -20.15954 eV, Vmftabs(up) = -25.36314 eV, Vmftabs(dn) = -25.05760 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -2.849E-05   1.509E-02   2.327E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.999E-05   1.058E-02   1.632E-03
  1 -1    1  1    -1.906E-02   5.765E-01   5.497E-02
  1 -1    1  2     2.269E-03  -6.790E-02  -6.398E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -5.774E-03   1.757E-01   1.686E-02
  1  0    1  1    -1.521E-02   4.615E-01   4.414E-02
  1  0    1  2     1.976E-03  -5.914E-02  -5.572E-03
  1  0    2  1     2.246E-03  -6.591E-02  -6.072E-03
  1  0    2  2    -6.522E-03   1.977E-01   1.889E-02
  1  1    1  1    -1.225E-02   3.727E-01   3.578E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     1.956E-03  -5.740E-02  -5.288E-03
  1  1    2  2    -7.077E-03   2.140E-01   2.039E-02
  2 -2    1  1     1.284E-03  -6.377E-02  -1.027E-02
  2 -2    1  2    -7.321E-06   3.239E-04   4.753E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     1.201E-03  -5.972E-02  -9.632E-03
  2 -1    1  1     1.280E-03  -6.360E-02  -1.025E-02
  2 -1    1  2    -8.965E-06   3.966E-04   5.821E-05
  2 -1    2  1    -7.417E-06   3.264E-04   4.768E-05
  2 -1    2  2     1.204E-03  -5.987E-02  -9.654E-03
  2  0    1  1     1.276E-03  -6.342E-02  -1.022E-02
  2  0    1  2    -8.964E-06   3.965E-04   5.820E-05
  2  0    2  1    -9.083E-06   3.997E-04   5.839E-05
  2  0    2  2     1.208E-03  -6.003E-02  -9.677E-03
  2  1    1  1     1.273E-03  -6.325E-02  -1.020E-02
  2  1    1  2    -7.318E-06   3.237E-04   4.751E-05
  2  1    2  1    -9.082E-06   3.997E-04   5.838E-05
  2  1    2  2     1.211E-03  -6.018E-02  -9.700E-03
  2  2    1  1     1.269E-03  -6.308E-02  -1.017E-02
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -7.414E-06   3.263E-04   4.766E-05
  2  2    2  2     1.215E-03  -6.034E-02  -9.722E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  3.3665439009E-02  2.6731746956E-21  1.0774997736E-03 -8.4594583473E-05 -7.0347029130E-03 -3.8559566057E-05
  1.0774997736E-03  8.4594583473E-05  2.5409381158E-02  4.4517301439E-37  4.4367800403E-04 -6.5650902864E-05
 -7.0347029130E-03  3.8559566057E-05  4.4367800403E-04  6.5650902864E-05  2.9638388643E-02  2.6731746956E-21

 Tensor_dq(1,ks,j2), prototypical atom
  5.6755097416E-04 -1.2725314958E-07  1.7352750364E-04 -2.2188021641E-06  2.8745442398E-04 -2.2825344685E-06
  1.7352750364E-04 -2.2188021641E-06  5.0506147286E-04  5.3988560238E-06  5.6721097721E-04 -1.8756361838E-06
  2.8745442398E-04 -2.2825344685E-06  5.6721097721E-04 -1.8756361838E-06 -1.0117520321E-04  4.2848520435E-07

 Tensor_dq(2,ks,j2), prototypical atom
  7.1062143152E-04 -2.6343738612E-06  2.1805805886E-04  4.1843060516E-06  7.7584960461E-05  3.3668947189E-06
  2.1805805886E-04  4.1843060516E-06 -4.1773182526E-04  5.7646814712E-06  6.3938272514E-06 -1.5339664540E-07
  7.7584960461E-05  3.3668947189E-06  6.3938272514E-06 -1.5339664540E-07 -1.8703754633E-04 -2.9521258424E-06

 Tensor_dq(3,ks,j2), prototypical atom
 -1.3920441692E-04  1.8081924029E-06  3.1196795814E-04  2.6726995489E-06 -3.8778574107E-04  2.9459918216E-06
  3.1196795814E-04  2.6726995489E-06 -9.0237484294E-04  1.1506310619E-06  2.9716126748E-04 -1.2035121051E-06
 -3.8778574107E-04  2.9459918216E-06  2.9716126748E-04 -1.2035121051E-06 -3.9411676158E-04 -5.9867625174E-07

 Tensor_qq(ke,je,1,1), prototypical atom
  1.6355307254E-04 -1.0442088655E-23  3.0567015624E-05 -8.3741611301E-08  1.4195127809E-05  2.0062468669E-08
  3.0567015624E-05 -8.3741611301E-08 -3.9902648578E-05 -1.5111333693E-07  4.8003920703E-06  9.4573598576E-08
  1.4195127809E-05  2.0062468669E-08  4.8003920703E-06  9.4573598576E-08 -1.5312078616E-05  1.7322823526E-07

 Tensor_qq(ke,je,2,1), prototypical atom
  3.0567015624E-05  8.3741611301E-08  6.4213863381E-05  5.2210443274E-24 -1.7969942085E-06 -7.8196085680E-08
  6.4213863381E-05  5.4080820542E-24 -2.8487357593E-05 -2.7759163532E-08  1.5714193966E-05 -9.2851864595E-08
 -1.7969942085E-06 -7.8196085680E-08  1.5714193966E-05 -9.2851864595E-08 -4.4143770712E-06 -1.7069694249E-07

 Tensor_qq(ke,je,3,1), prototypical atom
  1.4195127809E-05 -2.0062468669E-08 -1.7969942085E-06  7.8196085680E-08  4.5456770070E-05  0.0000000000E+00
 -1.7969942085E-06  7.8196085680E-08 -1.8392610684E-06 -2.5330676561E-07 -1.5395130452E-05  8.8969204921E-08
  4.5456770070E-05  1.3052610818E-24 -1.5395130452E-05  8.8969204921E-08  1.6540890736E-05  1.1175112866E-07

 Tensor_qq(ke,je,1,2), prototypical atom
  3.0567015624E-05  8.3741611301E-08  6.4213863381E-05 -5.2210443274E-24 -1.7969942085E-06 -7.8196085680E-08
  6.4213863381E-05 -1.0255050928E-23 -2.8487357593E-05 -2.7759163532E-08  1.5714193966E-05 -9.2851864595E-08
 -1.7969942085E-06 -7.8196085680E-08  1.5714193966E-05 -9.2851864595E-08 -4.4143770712E-06 -1.7069694249E-07

 Tensor_qq(ke,je,2,2), prototypical atom
 -3.9902648578E-05  1.5111333693E-07 -2.8487357593E-05  2.7759163532E-08 -1.8392610684E-06  2.5330676561E-07
 -2.8487357593E-05  2.7759163532E-08  1.5184777498E-04  0.0000000000E+00  1.0738121078E-05 -1.5194115917E-07
 -1.8392610684E-06  2.5330676561E-07  1.0738121078E-05 -1.5194115917E-07  9.4457793854E-06 -2.4805968915E-07

 Tensor_qq(ke,je,3,2), prototypical atom
  4.8003920703E-06 -9.4573598576E-08  1.5714193966E-05  9.2851864595E-08 -1.5395130452E-05 -8.8969204921E-08
  1.5714193966E-05  9.2851864595E-08  1.0738121078E-05  1.5194115917E-07  9.1514266514E-05  5.6741810367E-24
 -1.5395130452E-05 -8.8969204921E-08  9.1514266514E-05  0.0000000000E+00 -1.8001577194E-05 -2.6736271435E-08

 Tensor_qq(ke,je,1,3), prototypical atom
  1.4195127809E-05 -2.0062468669E-08 -1.7969942085E-06  7.8196085680E-08  4.5456770070E-05  0.0000000000E+00
 -1.7969942085E-06  7.8196085680E-08 -1.8392610684E-06 -2.5330676561E-07 -1.5395130452E-05  8.8969204921E-08
  4.5456770070E-05 -1.3052610818E-24 -1.5395130452E-05  8.8969204921E-08  1.6540890736E-05  1.1175112866E-07

 Tensor_qq(ke,je,2,3), prototypical atom
  4.8003920703E-06 -9.4573598576E-08  1.5714193966E-05  9.2851864595E-08 -1.5395130452E-05 -8.8969204921E-08
  1.5714193966E-05  9.2851864595E-08  1.0738121078E-05  1.5194115917E-07  9.1514266514E-05  5.6741810367E-24
 -1.5395130452E-05 -8.8969204921E-08  9.1514266514E-05  0.0000000000E+00 -1.8001577194E-05 -2.6736271435E-08

 Tensor_qq(ke,je,3,3), prototypical atom
 -1.5312078616E-05 -1.7322823526E-07 -4.4143770712E-06  1.7069694249E-07  1.6540890736E-05 -1.1175112866E-07
 -4.4143770712E-06  1.7069694249E-07  9.4457793854E-06  2.4805968915E-07 -1.8001577194E-05  2.6736271435E-08
  1.6540890736E-05 -1.1175112866E-07 -1.8001577194E-05  2.6736271435E-08  8.3892078514E-05 -1.0442088655E-23

 Crystal Tensor_dd(ke,ks) (Mbarn)
  2.6932351207E-01  0.0000000000E+00  0.0000000000E+00 -2.7105054312E-20 -5.6277623304E-02  0.0000000000E+00
  0.0000000000E+00  2.7105054312E-20  2.0327504926E-01  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -5.6277623304E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  2.3710710915E-01  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  1.3084245803E-03  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23  1.1356102247E-04  0.0000000000E+00
  0.0000000000E+00  2.6469779602E-23 -3.1922118862E-04  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23
  1.1356102247E-04  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23 -1.2249662893E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00 -2.6469779602E-23  5.1371090705E-04  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23
  5.1371090705E-04  0.0000000000E+00  0.0000000000E+00  6.6174449004E-24  1.2571355173E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.2571355173E-04  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23

 Crystal Tensor_qq(ke,je,3,1)
  1.1356102247E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  3.6365416056E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -1.4714088547E-05  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23
  3.6365416056E-04  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23  1.3232712589E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  0.0000000000E+00  5.1371090705E-04  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23
  5.1371090705E-04  0.0000000000E+00  0.0000000000E+00 -6.6174449004E-24  1.2571355173E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.2571355173E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,2)
 -3.1922118862E-04  0.0000000000E+00  0.0000000000E+00  6.6174449004E-24 -1.4714088547E-05  0.0000000000E+00
  0.0000000000E+00 -6.6174449004E-24  1.2147821999E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -1.4714088547E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  7.5566235083E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00 -2.6469779602E-23  1.2571355173E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.2571355173E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  7.3211413211E-04  0.0000000000E+00
  0.0000000000E+00 -2.6469779602E-23  7.3211413211E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,3)
  1.1356102247E-04  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23  3.6365416056E-04  0.0000000000E+00
  0.0000000000E+00  2.6469779602E-23 -1.4714088547E-05  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23
  3.6365416056E-04  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23  1.3232712589E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  0.0000000000E+00  1.2571355173E-04  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23
  1.2571355173E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  7.3211413211E-04  0.0000000000E+00
  0.0000000000E+00 -2.6469779602E-23  7.3211413211E-04  0.0000000000E+00  0.0000000000E+00  6.6174449004E-24

 Crystal Tensor_qq(ke,je,3,3)
 -1.2249662893E-04  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23  1.3232712589E-04  0.0000000000E+00
  0.0000000000E+00 -5.2939559203E-23  7.5566235083E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.3232712589E-04  0.0000000000E+00  0.0000000000E+00 -6.6174449004E-24  6.7113662811E-04  0.0000000000E+00

 Convertion factor =  77.99954 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -14.700  3.11856E-01  2.57852E-01  2.04040E-01  1.99770E-01  1.95604E-01  2.46944E-01  2.37128E-01
   dip-dip  3.11375E-01  2.57325E-01  2.03275E-01  1.99165E-01  1.95056E-01  2.46572E-01  2.36569E-01
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  4.80966E-04  5.27402E-04  7.64859E-04  6.04583E-04  5.47902E-04  3.71891E-04  5.59262E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -5.05220E-16 -1.24113E-05 -5.43813E-16 -6.09565E-06 -1.84804E-17 -2.60144E-04  4.83310E-17 -2.00205E-03
   dip-dip -5.07994E-16  7.95571E-16 -5.44791E-16  1.05925E-15 -2.32914E-17 -2.75015E-04  4.71384E-17 -1.98553E-03
   dip-qua  3.03426E-18  2.25377E-18  1.33943E-18  2.80747E-18  4.80529E-18 -7.30882E-19  1.26568E-18  3.50796E-18
   qua-qua -2.60755E-19 -1.24113E-05 -3.61018E-19 -6.09565E-06  5.70399E-21  1.48705E-05 -7.30326E-20 -1.65258E-05

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -14.60000 eV

 Vmoy = -20.16087 eV, Vmftabs(up) = -25.36338 eV, Vmftabs(dn) = -25.05825 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -2.774E-05   1.469E-02   2.266E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.956E-05   1.035E-02   1.597E-03
  1 -1    1  1    -1.825E-02   5.520E-01   5.264E-02
  1 -1    1  2     2.170E-03  -6.494E-02  -6.118E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -5.540E-03   1.686E-01   1.618E-02
  1  0    1  1    -1.458E-02   4.422E-01   4.229E-02
  1  0    1  2     1.891E-03  -5.658E-02  -5.330E-03
  1  0    2  1     2.148E-03  -6.303E-02  -5.806E-03
  1  0    2  2    -6.256E-03   1.896E-01   1.812E-02
  1  1    1  1    -1.174E-02   3.574E-01   3.430E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     1.871E-03  -5.492E-02  -5.059E-03
  1  1    2  2    -6.788E-03   2.052E-01   1.955E-02
  2 -2    1  1     1.201E-03  -5.964E-02  -9.608E-03
  2 -2    1  2    -6.854E-06   3.032E-04   4.451E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     1.123E-03  -5.584E-02  -9.006E-03
  2 -1    1  1     1.197E-03  -5.948E-02  -9.584E-03
  2 -1    1  2    -8.393E-06   3.714E-04   5.451E-05
  2 -1    2  1    -6.945E-06   3.056E-04   4.465E-05
  2 -1    2  2     1.126E-03  -5.598E-02  -9.027E-03
  2  0    1  1     1.194E-03  -5.932E-02  -9.561E-03
  2  0    1  2    -8.392E-06   3.713E-04   5.450E-05
  2  0    2  1    -8.504E-06   3.743E-04   5.468E-05
  2  0    2  2     1.129E-03  -5.613E-02  -9.048E-03
  2  1    1  1     1.190E-03  -5.916E-02  -9.537E-03
  2  1    1  2    -6.851E-06   3.031E-04   4.449E-05
  2  1    2  1    -8.503E-06   3.742E-04   5.468E-05
  2  1    2  2     1.133E-03  -5.627E-02  -9.069E-03
  2  2    1  1     1.187E-03  -5.900E-02  -9.514E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -6.942E-06   3.055E-04   4.464E-05
  2  2    2  2     1.136E-03  -5.642E-02  -9.090E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  3.5070737662E-02  0.0000000000E+00  1.5029737784E-03 -3.3476398101E-05 -8.7565130593E-03  6.8478944488E-06
  1.5029737784E-03  3.3476398101E-05  2.6634952595E-02 -2.0404137520E-37  3.9969511561E-04 -3.0708844736E-05
 -8.7565130593E-03 -6.8478944488E-06  3.9969511561E-04  3.0708844736E-05  2.9904803020E-02  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
  4.8561831180E-04  1.0989971161E-06  7.9064881547E-05 -2.1739929970E-07  4.0917378706E-04 -1.9229304473E-06
  7.9064881547E-05 -2.1739929970E-07  6.9332105671E-04  2.9524447756E-06  4.4173451325E-04 -1.8692443003E-06
  4.0917378706E-04 -1.9229304473E-06  4.4173451325E-04 -1.8692443003E-06 -1.0366738615E-04 -1.7731477742E-06

 Tensor_dq(2,ks,j2), prototypical atom
  4.9588262904E-04 -1.2096793477E-06  1.9405395695E-04  1.3392545047E-06  5.9060140081E-05  3.0659143602E-06
  1.9405395695E-04  1.3392545047E-06 -2.7892928182E-04  3.8374275284E-06  8.7359523406E-05  7.6196877792E-07
  5.9060140081E-05  3.0659143602E-06  8.7359523406E-05  7.6196877792E-07 -1.3259522871E-04 -2.6194887828E-06

 Tensor_dq(3,ks,j2), prototypical atom
 -5.0311695650E-04  5.5835565026E-07  1.3765104082E-04  1.3125309233E-06 -4.7605066816E-04  1.8137025592E-06
  1.3765104082E-04  1.3125309233E-06 -7.8720503741E-04 -6.8531629771E-07  1.2526396271E-04 -3.3097228572E-07
 -4.7605066816E-04  1.8137025592E-06  1.2526396271E-04 -3.3097228572E-07 -2.6859596017E-04  7.8480665134E-07

 Tensor_qq(ke,je,1,1), prototypical atom
  1.4356192079E-04 -9.1369952118E-24  3.4514451240E-05 -3.7272821054E-08  1.2813677653E-05 -1.2726883326E-08
  3.4514451240E-05 -3.7272821054E-08 -1.5993159361E-05 -1.3423911909E-07  1.6480887601E-06  4.4877335536E-08
  1.2813677653E-05 -1.2726883326E-08  1.6480887601E-06  4.4877335536E-08 -1.6410803430E-05  1.2978050877E-07

 Tensor_qq(ke,je,2,1), prototypical atom
  3.4514451240E-05  3.7272821054E-08  5.0843432225E-05 -2.6105700605E-24 -2.9716168774E-06 -1.7184365579E-08
  5.0843432225E-05 -1.9538832882E-24 -2.0267606210E-05  3.8296570447E-09  6.1282986996E-06 -4.7077271363E-08
 -2.9716168774E-06 -1.7184365579E-08  6.1282986996E-06 -4.7077271363E-08 -1.1371778329E-05 -4.8124906595E-08

 Tensor_qq(ke,je,3,1), prototypical atom
  1.2813677653E-05  1.2726883326E-08 -2.9716168774E-06  1.7184365579E-08  4.7107982254E-05 -1.0442280242E-23
 -2.9716168774E-06  1.7184365579E-08  9.5551694347E-06 -2.6632531422E-07 -1.4717414706E-05  1.5247968854E-07
  4.7107982254E-05 -9.1369952118E-24 -1.4717414706E-05  1.5247968854E-07  1.2085245805E-05  1.4289079397E-07

 Tensor_qq(ke,je,1,2), prototypical atom
  3.4514451240E-05  3.7272821054E-08  5.0843432225E-05  2.6105700605E-24 -2.9716168774E-06 -1.7184365579E-08
  5.0843432225E-05  5.8778268934E-24 -2.0267606210E-05  3.8296570447E-09  6.1282986996E-06 -4.7077271363E-08
 -2.9716168774E-06 -1.7184365579E-08  6.1282986996E-06 -4.7077271363E-08 -1.1371778329E-05 -4.8124906595E-08

 Tensor_qq(ke,je,2,2), prototypical atom
 -1.5993159361E-05  1.3423911909E-07 -2.0267606210E-05 -3.8296570447E-09  9.5551694347E-06  2.6632531422E-07
 -2.0267606210E-05 -3.8296570447E-09  1.2318206530E-04  5.7966299772E-40  2.2382118844E-05  3.2151890093E-08
  9.5551694347E-06  2.6632531422E-07  2.2382118844E-05  3.2151890093E-08  6.5821288489E-06 -1.1005488785E-07

 Tensor_qq(ke,je,3,2), prototypical atom
  1.6480887601E-06 -4.4877335536E-08  6.1282986996E-06  4.7077271363E-08 -1.4717414706E-05 -1.5247968854E-07
  6.1282986996E-06  4.7077271363E-08  2.2382118844E-05 -3.2151890093E-08  7.6096572762E-05 -4.8223710028E-24
 -1.4717414706E-05 -1.5247968854E-07  7.6096572762E-05 -2.6105700605E-24 -2.1081572879E-05  4.8081268516E-08

 Tensor_qq(ke,je,1,3), prototypical atom
  1.2813677653E-05  1.2726883326E-08 -2.9716168774E-06  1.7184365579E-08  4.7107982254E-05 -2.0884560484E-23
 -2.9716168774E-06  1.7184365579E-08  9.5551694347E-06 -2.6632531422E-07 -1.4717414706E-05  1.5247968854E-07
  4.7107982254E-05 -2.0884560484E-23 -1.4717414706E-05  1.5247968854E-07  1.2085245805E-05  1.4289079397E-07

 Tensor_qq(ke,je,2,3), prototypical atom
  1.6480887601E-06 -4.4877335536E-08  6.1282986996E-06  4.7077271363E-08 -1.4717414706E-05 -1.5247968854E-07
  6.1282986996E-06  4.7077271363E-08  2.2382118844E-05 -3.2151890093E-08  7.6096572762E-05 -2.2118009423E-24
 -1.4717414706E-05 -1.5247968854E-07  7.6096572762E-05  0.0000000000E+00 -2.1081572879E-05  4.8081268516E-08

 Tensor_qq(ke,je,3,3), prototypical atom
 -1.6410803430E-05 -1.2978050877E-07 -1.1371778329E-05  4.8124906595E-08  1.2085245805E-05 -1.4289079397E-07
 -1.1371778329E-05  4.8124906595E-08  6.5821288489E-06  1.1005488785E-07 -2.1081572879E-05 -4.8081268516E-08
  1.2085245805E-05 -1.4289079397E-07 -2.1081572879E-05 -4.8081268516E-08  7.3986833304E-05  3.1326840726E-23

 Crystal Tensor_dd(ke,ks) (Mbarn)
  2.8056590130E-01  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20 -7.0052104474E-02  0.0000000000E+00
  0.0000000000E+00  1.3552527156E-20  2.1307962076E-01  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20
 -7.0052104474E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  2.3923842416E-01  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  1.1484953664E-03  0.0000000000E+00  0.0000000000E+00  1.3234889801E-23  1.0250942122E-04  0.0000000000E+00
  0.0000000000E+00  1.3234889801E-23 -1.2794527489E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.0250942122E-04  0.0000000000E+00  0.0000000000E+00 -1.3234889801E-23 -1.3128642744E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00 -1.3234889801E-23  4.0674745780E-04  0.0000000000E+00  0.0000000000E+00  6.6174449004E-24
  4.0674745780E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.9026389597E-05  0.0000000000E+00
  0.0000000000E+00 -6.6174449004E-24  4.9026389597E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,1)
  1.0250942122E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  3.7686385803E-04  0.0000000000E+00
  0.0000000000E+00 -6.6174449004E-24  7.6441355478E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.7686385803E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  9.6681966441E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00 -1.3234889801E-23  4.0674745780E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  4.0674745780E-04  0.0000000000E+00  0.0000000000E+00 -1.6543612251E-24  4.9026389597E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  4.9026389597E-05  0.0000000000E+00  0.0000000000E+00  1.3234889801E-23

 Crystal Tensor_qq(ke,je,2,2)
 -1.2794527489E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  7.6441355478E-05  0.0000000000E+00
  0.0000000000E+00  1.6543612251E-24  9.8545652243E-04  0.0000000000E+00  0.0000000000E+00  1.3234889801E-23
  7.6441355478E-05  0.0000000000E+00  0.0000000000E+00  1.3234889801E-23  5.2657030791E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00 -1.3234889801E-23  4.9026389597E-05  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23
  4.9026389597E-05  0.0000000000E+00  0.0000000000E+00 -1.3234889801E-23  6.0877258209E-04  0.0000000000E+00
  0.0000000000E+00  5.2939559203E-23  6.0877258209E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,3)
  1.0250942122E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  3.7686385803E-04  0.0000000000E+00
  0.0000000000E+00  6.6174449004E-24  7.6441355478E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.7686385803E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  9.6681966441E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00 -1.3234889801E-23  4.9026389597E-05  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23
  4.9026389597E-05  0.0000000000E+00  0.0000000000E+00 -1.3234889801E-23  6.0877258209E-04  0.0000000000E+00
  0.0000000000E+00  5.2939559203E-23  6.0877258209E-04  0.0000000000E+00  0.0000000000E+00  1.3234889801E-23

 Crystal Tensor_qq(ke,je,3,3)
 -1.3128642744E-04  0.0000000000E+00  0.0000000000E+00 -1.3234889801E-23  9.6681966441E-05  0.0000000000E+00
  0.0000000000E+00 -1.3234889801E-23  5.2657030791E-05  0.0000000000E+00  0.0000000000E+00 -1.3234889801E-23
  9.6681966441E-05  0.0000000000E+00  0.0000000000E+00 -1.3234889801E-23  5.9189466644E-04  0.0000000000E+00

 Convertion factor =  78.00097 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -14.600  3.32840E-01  2.73198E-01  2.13652E-01  2.00688E-01  1.87905E-01  2.51408E-01  2.44769E-01
   dip-dip  3.32397E-01  2.72738E-01  2.13080E-01  2.00243E-01  1.87407E-01  2.51028E-01  2.44295E-01
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  4.42804E-04  4.59794E-04  5.72716E-04  4.44937E-04  4.98341E-04  3.79263E-04  4.73972E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -4.62098E-16 -1.29743E-05 -6.07943E-16 -5.91826E-06  1.02423E-16  8.93824E-05 -1.36261E-17  3.78396E-04
   dip-dip -4.62218E-16  7.94024E-16 -6.12806E-16  1.06499E-15  1.04330E-16  7.44244E-05 -1.06671E-17  3.93942E-04
   dip-qua  6.08423E-19  8.42992E-19  5.38704E-18  4.94999E-18 -1.87632E-18  8.07823E-19 -2.92353E-18  2.80275E-18
   qua-qua -4.88115E-19 -1.29743E-05 -5.23488E-19 -5.91826E-06 -3.03038E-20  1.49580E-05 -3.55225E-20 -1.55460E-05

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -14.50000 eV

 Vmoy = -20.16224 eV, Vmftabs(up) = -25.36363 eV, Vmftabs(dn) = -25.05890 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -2.704E-05   1.432E-02   2.209E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.916E-05   1.014E-02   1.565E-03
  1 -1    1  1    -1.751E-02   5.298E-01   5.052E-02
  1 -1    1  2     2.080E-03  -6.222E-02  -5.862E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -5.328E-03   1.621E-01   1.556E-02
  1  0    1  1    -1.400E-02   4.246E-01   4.061E-02
  1  0    1  2     1.813E-03  -5.425E-02  -5.111E-03
  1  0    2  1     2.058E-03  -6.040E-02  -5.563E-03
  1  0    2  2    -6.015E-03   1.823E-01   1.742E-02
  1  1    1  1    -1.129E-02   3.434E-01   3.296E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     1.794E-03  -5.266E-02  -4.850E-03
  1  1    2  2    -6.526E-03   1.973E-01   1.880E-02
  2 -2    1  1     1.128E-03  -5.600E-02  -9.022E-03
  2 -2    1  2    -6.442E-06   2.851E-04   4.185E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     1.054E-03  -5.242E-02  -8.454E-03
  2 -1    1  1     1.124E-03  -5.585E-02  -9.000E-03
  2 -1    1  2    -7.889E-06   3.491E-04   5.125E-05
  2 -1    2  1    -6.528E-06   2.874E-04   4.199E-05
  2 -1    2  2     1.057E-03  -5.255E-02  -8.474E-03
  2  0    1  1     1.121E-03  -5.570E-02  -8.978E-03
  2  0    1  2    -7.888E-06   3.491E-04   5.124E-05
  2  0    2  1    -7.994E-06   3.519E-04   5.142E-05
  2  0    2  2     1.060E-03  -5.269E-02  -8.494E-03
  2  1    1  1     1.118E-03  -5.555E-02  -8.955E-03
  2  1    1  2    -6.440E-06   2.850E-04   4.183E-05
  2  1    2  1    -7.993E-06   3.519E-04   5.141E-05
  2  1    2  2     1.063E-03  -5.283E-02  -8.514E-03
  2  2    1  1     1.114E-03  -5.540E-02  -8.933E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -6.526E-06   2.873E-04   4.197E-05
  2  2    2  2     1.067E-03  -5.296E-02  -8.534E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  3.7514043336E-02  0.0000000000E+00  1.9639185179E-03 -1.3997680232E-05 -8.5819555601E-03  1.2434297740E-05
  1.9639185179E-03  1.3997680232E-05  2.8946692129E-02 -2.4114423131E-37  7.5404033415E-04 -1.3604403534E-05
 -8.5819555601E-03 -1.2434297740E-05  7.5404033415E-04  1.3604403534E-05  3.2367907394E-02  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
  4.3316299288E-04  1.6946349699E-06  4.8740818088E-05  9.9824745655E-07  5.3519282225E-04 -2.1824932344E-06
  4.8740818088E-05  9.9824745655E-07  7.8500545281E-04  1.7246724171E-06  4.4328430325E-04 -2.0931630184E-06
  5.3519282225E-04 -2.1824932344E-06  4.4328430325E-04 -2.0931630184E-06 -8.8708819280E-05 -2.1093431688E-06

 Tensor_dq(2,ks,j2), prototypical atom
  4.5368700419E-04 -4.5750325861E-07  1.7137862079E-04  5.1425309597E-07  5.6888049025E-05  2.8272810126E-06
  1.7137862079E-04  5.1425309597E-07 -2.8506805209E-04  2.8882509907E-06  1.8970310848E-04  1.0056049246E-06
  5.6888049025E-05  2.8272810126E-06  1.8970310848E-04  1.0056049246E-06 -1.1495398323E-04 -2.4908763880E-06

 Tensor_dq(3,ks,j2), prototypical atom
 -6.8468590818E-04  1.6766629642E-07  7.4628553625E-05  9.8754823441E-07 -5.2265028269E-04  1.2840033101E-06
  7.4628553625E-05  9.8754823441E-07 -8.4669919698E-04 -1.8070206162E-06  1.0429641822E-04 -6.1809256204E-07
 -5.2265028269E-04  1.2840033101E-06  1.0429641822E-04 -6.1809256204E-07 -1.4541789145E-04  1.0576295381E-06

 Tensor_qq(ke,je,1,1), prototypical atom
  1.3103963185E-04  2.6106179574E-24  3.1209887075E-05  8.7861011293E-09  1.3137965218E-05 -2.9568615911E-08
  3.1209887075E-05  8.7861011293E-09 -6.4337493596E-06 -1.4402564485E-07  1.1796009616E-06  3.5589246362E-08
  1.3137965218E-05 -2.9568615911E-08  1.1796009616E-06  3.5589246362E-08 -1.9075442332E-05  1.0174586037E-07

 Tensor_qq(ke,je,2,1), prototypical atom
  3.1209887075E-05 -8.7861011293E-09  4.5248789340E-05  0.0000000000E+00 -3.1283125835E-06  3.2012120140E-08
  4.5248789340E-05 -1.5346664306E-24 -1.6538460135E-05  6.2671024021E-08  3.0805166390E-06 -2.1735434342E-08
 -3.1283125835E-06  3.2012120140E-08  3.0805166390E-06 -2.1735434342E-08 -1.1499508648E-05 -1.9260449263E-08

 Tensor_qq(ke,je,3,1), prototypical atom
  1.3137965218E-05  2.9568615911E-08 -3.1283125835E-06 -3.2012120140E-08  5.0774859967E-05 -2.0884943659E-23
 -3.1283125835E-06 -3.2012120140E-08  1.7127063732E-05 -2.5263247872E-07 -1.1348773725E-05  2.1055215485E-07
  5.0774859967E-05  2.6106179574E-24 -1.1348773725E-05  2.1055215485E-07  8.1343207347E-06  1.5873845141E-07

 Tensor_qq(ke,je,1,2), prototypical atom
  3.1209887075E-05 -8.7861011293E-09  4.5248789340E-05  1.3053089787E-24 -3.1283125835E-06  3.2012120140E-08
  4.5248789340E-05  1.0759515268E-24 -1.6538460135E-05  6.2671024021E-08  3.0805166390E-06 -2.1735434342E-08
 -3.1283125835E-06  3.2012120140E-08  3.0805166390E-06 -2.1735434342E-08 -1.1499508648E-05 -1.9260449263E-08

 Tensor_qq(ke,je,2,2), prototypical atom
 -6.4337493596E-06  1.4402564485E-07 -1.6538460135E-05 -6.2671024021E-08  1.7127063732E-05  2.5263247872E-07
 -1.6538460135E-05 -6.2671024021E-08  1.1601160420E-04  5.7967363296E-40  2.2145847795E-05  1.1432164350E-07
  1.7127063732E-05  2.5263247872E-07  2.2145847795E-05  1.1432164350E-07 -5.1133323099E-07 -8.5448030027E-08

 Tensor_qq(ke,je,3,2), prototypical atom
  1.1796009616E-06 -3.5589246362E-08  3.0805166390E-06  2.1735434342E-08 -1.1348773725E-05 -2.1055215485E-07
  3.0805166390E-06  2.1735434342E-08  2.2145847795E-05 -1.1432164350E-07  6.9984089016E-05 -3.2182890987E-25
 -1.1348773725E-05 -2.1055215485E-07  6.9984089016E-05  1.3053089787E-24 -1.9002016876E-05  1.2246872725E-07

 Tensor_qq(ke,je,1,3), prototypical atom
  1.3137965218E-05  2.9568615911E-08 -3.1283125835E-06 -3.2012120140E-08  5.0774859967E-05  0.0000000000E+00
 -3.1283125835E-06 -3.2012120140E-08  1.7127063732E-05 -2.5263247872E-07 -1.1348773725E-05  2.1055215485E-07
  5.0774859967E-05  1.0442471830E-23 -1.1348773725E-05  2.1055215485E-07  8.1343207347E-06  1.5873845141E-07

 Tensor_qq(ke,je,2,3), prototypical atom
  1.1796009616E-06 -3.5589246362E-08  3.0805166390E-06  2.1735434342E-08 -1.1348773725E-05 -2.1055215485E-07
  3.0805166390E-06  2.1735434342E-08  2.2145847795E-05 -1.1432164350E-07  6.9984089016E-05 -1.6271378886E-24
 -1.1348773725E-05 -2.1055215485E-07  6.9984089016E-05  0.0000000000E+00 -1.9002016876E-05  1.2246872725E-07

 Tensor_qq(ke,je,3,3), prototypical atom
 -1.9075442332E-05 -1.0174586037E-07 -1.1499508648E-05  1.9260449263E-08  8.1343207347E-06 -1.5873845141E-07
 -1.1499508648E-05  1.9260449263E-08 -5.1133323099E-07  8.5448030027E-08 -1.9002016876E-05 -1.2246872725E-07
  8.1343207347E-06 -1.5873845141E-07 -1.9002016876E-05 -1.2246872725E-07  6.9640270805E-05  2.0884943659E-23

 Crystal Tensor_dd(ke,ks) (Mbarn)
  3.0011234668E-01  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21 -6.8655644481E-02  0.0000000000E+00
  0.0000000000E+00 -3.3881317890E-21  2.3157353703E-01  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
 -6.8655644481E-02  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21  2.5894325915E-01  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  1.0483170548E-03  0.0000000000E+00  0.0000000000E+00 -3.3087224502E-24  1.0510372174E-04  0.0000000000E+00
  0.0000000000E+00 -3.3087224502E-24 -5.1469994877E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.0510372174E-04  0.0000000000E+00  0.0000000000E+00 -1.3234889801E-23 -1.5260353866E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00 -3.3087224502E-24  3.6199031472E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.6199031472E-04  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23  2.4644133112E-05  0.0000000000E+00
  0.0000000000E+00  1.3234889801E-23  2.4644133112E-05  0.0000000000E+00  0.0000000000E+00 -6.6174449004E-24

 Crystal Tensor_qq(ke,je,3,1)
  1.0510372174E-04  0.0000000000E+00  0.0000000000E+00 -1.3234889801E-23  4.0619887974E-04  0.0000000000E+00
  0.0000000000E+00 -1.3234889801E-23  1.3701650986E-04  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23
  4.0619887974E-04  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23  6.5074565877E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  0.0000000000E+00  3.6199031472E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.6199031472E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  2.4644133112E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.4644133112E-05  0.0000000000E+00  0.0000000000E+00 -6.6174449004E-24

 Crystal Tensor_qq(ke,je,2,2)
 -5.1469994877E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.3701650986E-04  0.0000000000E+00
  0.0000000000E+00  2.6469779602E-23  9.2809283363E-04  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23
  1.3701650986E-04  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23 -4.0906658479E-06  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  0.0000000000E+00  2.4644133112E-05  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23
  2.4644133112E-05  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23  5.5987271213E-04  0.0000000000E+00
  0.0000000000E+00 -5.2939559203E-23  5.5987271213E-04  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23

 Crystal Tensor_qq(ke,je,1,3)
  1.0510372174E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.0619887974E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.3701650986E-04  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23
  4.0619887974E-04  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23  6.5074565877E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00 -1.3234889801E-23  2.4644133112E-05  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23
  2.4644133112E-05  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23  5.5987271213E-04  0.0000000000E+00
  0.0000000000E+00 -5.2939559203E-23  5.5987271213E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,3)
 -1.5260353866E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  6.5074565877E-05  0.0000000000E+00
  0.0000000000E+00  6.6174449004E-24 -4.0906658479E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  6.5074565877E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  5.5712216644E-04  0.0000000000E+00

 Convertion factor =  78.00240 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -14.500  3.51053E-01  2.91568E-01  2.32075E-01  2.20388E-01  2.08905E-01  2.70904E-01  2.63991E-01
   dip-dip  3.50632E-01  2.91103E-01  2.31574E-01  2.19998E-01  2.08423E-01  2.70503E-01  2.63543E-01
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  4.20367E-04  4.65232E-04  5.01496E-04  3.89944E-04  4.82220E-04  4.01641E-04  4.48392E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -5.49503E-16 -1.28669E-05 -7.06589E-16 -6.11795E-06 -1.60651E-16  1.24352E-04 -3.41747E-18  6.61000E-04
   dip-dip -5.50696E-16  8.79923E-16 -7.09964E-16  1.10480E-15 -1.59144E-16  1.09477E-04 -4.48406E-19  6.75203E-04
   dip-qua  1.79143E-18  1.85367E-18  4.01311E-18  4.82649E-18 -1.65937E-18  1.21255E-19 -2.89793E-18 -8.36327E-19
   qua-qua -5.98221E-19 -1.28669E-05 -6.37919E-19 -6.11795E-06  1.52423E-19  1.48746E-05 -7.11315E-20 -1.42032E-05

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -14.40000 eV

 Vmoy = -20.16361 eV, Vmftabs(up) = -25.36387 eV, Vmftabs(dn) = -25.05927 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -2.638E-05   1.397E-02   2.155E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.878E-05   9.941E-03   1.534E-03
  1 -1    1  1    -1.684E-02   5.094E-01   4.858E-02
  1 -1    1  2     1.997E-03  -5.974E-02  -5.628E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -5.135E-03   1.562E-01   1.500E-02
  1  0    1  1    -1.347E-02   4.086E-01   3.908E-02
  1  0    1  2     1.742E-03  -5.212E-02  -4.909E-03
  1  0    2  1     1.976E-03  -5.799E-02  -5.341E-03
  1  0    2  2    -5.796E-03   1.756E-01   1.678E-02
  1  1    1  1    -1.087E-02   3.306E-01   3.173E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     1.724E-03  -5.059E-02  -4.659E-03
  1  1    2  2    -6.287E-03   1.901E-01   1.811E-02
  2 -2    1  1     1.063E-03  -5.277E-02  -8.502E-03
  2 -2    1  2    -6.077E-06   2.690E-04   3.949E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     9.932E-04  -4.938E-02  -7.965E-03
  2 -1    1  1     1.060E-03  -5.263E-02  -8.481E-03
  2 -1    1  2    -7.442E-06   3.294E-04   4.836E-05
  2 -1    2  1    -6.159E-06   2.711E-04   3.962E-05
  2 -1    2  2     9.961E-04  -4.951E-02  -7.984E-03
  2  0    1  1     1.056E-03  -5.249E-02  -8.460E-03
  2  0    1  2    -7.441E-06   3.293E-04   4.835E-05
  2  0    2  1    -7.542E-06   3.320E-04   4.852E-05
  2  0    2  2     9.990E-04  -4.964E-02  -8.002E-03
  2  1    1  1     1.053E-03  -5.234E-02  -8.439E-03
  2  1    1  2    -6.075E-06   2.689E-04   3.948E-05
  2  1    2  1    -7.541E-06   3.320E-04   4.851E-05
  2  1    2  2     1.002E-03  -4.977E-02  -8.021E-03
  2  2    1  1     1.050E-03  -5.220E-02  -8.418E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -6.157E-06   2.710E-04   3.961E-05
  2  2    2  2     1.005E-03  -4.990E-02  -8.040E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  3.9103569122E-02 -6.6833045868E-22  2.7412619226E-03 -1.8165214498E-05 -8.0057528334E-03 -6.6745078986E-06
  2.7412619226E-03  1.8165214498E-05  3.0549060201E-02  1.4839917266E-37  1.1018906399E-03  4.0158469115E-06
 -8.0057528334E-03  6.6745078986E-06  1.1018906399E-03 -4.0158469115E-06  3.3704894535E-02 -6.6833045868E-22

 Tensor_dq(1,ks,j2), prototypical atom
  4.3225428317E-04 -6.3728341190E-07  4.2589620544E-05  1.7662361304E-06  6.1547720659E-04 -2.5178376053E-06
  4.2589620544E-05  1.7662361304E-06  8.1235004935E-04  8.0779652845E-07  4.7179518814E-04 -3.1365117592E-06
  6.1547720659E-04 -2.5178376053E-06  4.7179518814E-04 -3.1365117592E-06 -5.0111803631E-05 -5.5853928618E-06

 Tensor_dq(2,ks,j2), prototypical atom
  4.1689388983E-04  5.5497642426E-07  1.4403401891E-04  4.7362991524E-07  7.8819771434E-05  2.7096357421E-06
  1.4403401891E-04  4.7362991524E-07 -3.2784923775E-04  2.1422772727E-06  2.7667110391E-04  1.4291147272E-06
  7.8819771434E-05  2.7096357421E-06  2.7667110391E-04  1.4291147272E-06 -1.4429594393E-04 -1.5633140905E-06

 Tensor_dq(3,ks,j2), prototypical atom
 -7.2576216963E-04 -8.6422742377E-07  5.7601729955E-05  2.2969572561E-07 -5.5038878320E-04  9.9899194840E-07
  5.7601729955E-05  2.2969572561E-07 -8.6205932143E-04 -1.2801325540E-06  1.0334747408E-04 -6.3791366024E-07
 -5.5038878320E-04  9.9899194840E-07  1.0334747408E-04 -6.3791366024E-07 -1.3653671127E-05 -3.5500658082E-09

 Tensor_qq(ke,je,1,1), prototypical atom
  1.1842852318E-04 -1.0442663417E-23  2.6288953413E-05 -4.0235154464E-08  1.5967459187E-05 -9.6048763009E-08
  2.6288953413E-05 -4.0235154464E-08 -3.0784762049E-06 -1.0544390575E-07  1.9954468479E-06  4.7172667881E-08
  1.5967459187E-05 -9.6048763009E-08  1.9954468479E-06  4.7172667881E-08 -2.5275429375E-05  5.5212893102E-08

 Tensor_qq(ke,je,2,1), prototypical atom
  2.6288953413E-05  4.0235154464E-08  4.1519115487E-05  0.0000000000E+00 -2.7007210182E-06  5.8162935551E-08
  4.1519115487E-05  2.9047749823E-24 -1.4611265711E-05  1.1917525385E-07  1.6327874069E-06  3.6633489949E-08
 -2.7007210182E-06  5.8162935551E-08  1.6327874069E-06  3.6633489949E-08 -1.1864326824E-05  5.3436926154E-08

 Tensor_qq(ke,je,3,1), prototypical atom
  1.5967459187E-05  9.6048763009E-08 -2.7007210182E-06 -5.8162935551E-08  5.4778973150E-05  2.0885326834E-23
 -2.7007210182E-06 -5.8162935551E-08  2.4322033935E-05 -2.5671761499E-07 -8.2115387632E-06  2.8343448609E-07
  5.4778973150E-05  1.0442663417E-23 -8.2115387632E-06  2.8343448609E-07  5.6326189373E-06  2.8341445722E-07

 Tensor_qq(ke,je,1,2), prototypical atom
  2.6288953413E-05  4.0235154464E-08  4.1519115487E-05  2.6106658542E-24 -2.7007210182E-06  5.8162935551E-08
  4.1519115487E-05  5.5154408366E-24 -1.4611265711E-05  1.1917525385E-07  1.6327874069E-06  3.6633489949E-08
 -2.7007210182E-06  5.8162935551E-08  1.6327874069E-06  3.6633489949E-08 -1.1864326824E-05  5.3436926154E-08

 Tensor_qq(ke,je,2,2), prototypical atom
 -3.0784762049E-06  1.0544390575E-07 -1.4611265711E-05 -1.1917525385E-07  2.4322033935E-05  2.5671761499E-07
 -1.4611265711E-05 -1.1917525385E-07  1.1628598646E-04  2.3187370728E-39  1.9620345692E-05  2.1643881865E-07
  2.4322033935E-05  2.5671761499E-07  1.9620345692E-05  2.1643881865E-07 -8.8536570299E-06 -4.4220089732E-08

 Tensor_qq(ke,je,3,2), prototypical atom
  1.9954468479E-06 -4.7172667881E-08  1.6327874069E-06 -3.6633489949E-08 -8.2115387632E-06 -2.8343448609E-07
  1.6327874069E-06 -3.6633489949E-08  1.9620345692E-05 -2.1643881865E-07  6.7669077910E-05 -1.8397547031E-24
 -8.2115387632E-06 -2.8343448609E-07  6.7669077910E-05 -2.6106658542E-24 -1.6039540986E-05  2.0059214061E-07

 Tensor_qq(ke,je,1,3), prototypical atom
  1.5967459187E-05  9.6048763009E-08 -2.7007210182E-06 -5.8162935551E-08  5.4778973150E-05  0.0000000000E+00
 -2.7007210182E-06 -5.8162935551E-08  2.4322033935E-05 -2.5671761499E-07 -8.2115387632E-06  2.8343448609E-07
  5.4778973150E-05 -1.0442663417E-23 -8.2115387632E-06  2.8343448609E-07  5.6326189373E-06  2.8341445722E-07

 Tensor_qq(ke,je,2,3), prototypical atom
  1.9954468479E-06 -4.7172667881E-08  1.6327874069E-06 -3.6633489949E-08 -8.2115387632E-06 -2.8343448609E-07
  1.6327874069E-06 -3.6633489949E-08  1.9620345692E-05 -2.1643881865E-07  6.7669077910E-05 -4.4504205573E-24
 -8.2115387632E-06 -2.8343448609E-07  6.7669077910E-05 -5.2213317085E-24 -1.6039540986E-05  2.0059214061E-07

 Tensor_qq(ke,je,3,3), prototypical atom
 -2.5275429375E-05 -5.5212893102E-08 -1.1864326824E-05 -5.3436926154E-08  5.6326189373E-06 -2.8341445722E-07
 -1.1864326824E-05 -5.3436926154E-08 -8.8536570299E-06  4.4220089732E-08 -1.6039540986E-05 -2.0059214061E-07
  5.6326189373E-06 -2.8341445722E-07 -1.6039540986E-05 -2.0059214061E-07  6.5169964875E-05  0.0000000000E+00

 Crystal Tensor_dd(ke,ks) (Mbarn)
  3.1282855298E-01  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21 -6.4046022667E-02  0.0000000000E+00
  0.0000000000E+00  6.7762635780E-21  2.4439248161E-01  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -6.4046022667E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  2.6963915628E-01  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  9.4742818545E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.2773967349E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -2.4627809639E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.2773967349E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -2.0220343500E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  1.3234889801E-23  3.3215292390E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.3215292390E-04  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23  1.3062299255E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.3062299255E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,1)
  1.2773967349E-04  0.0000000000E+00  0.0000000000E+00  1.3234889801E-23  4.3823178520E-04  0.0000000000E+00
  0.0000000000E+00 -1.3234889801E-23  1.9457627148E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  4.3823178520E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.5060951498E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  0.0000000000E+00  3.3215292390E-04  0.0000000000E+00  0.0000000000E+00 -1.3234889801E-23
  3.3215292390E-04  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23  1.3062299255E-05  0.0000000000E+00
  0.0000000000E+00  1.3234889801E-23  1.3062299255E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,2)
 -2.4627809639E-05  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23  1.9457627148E-04  0.0000000000E+00
  0.0000000000E+00  2.6469779602E-23  9.3028789166E-04  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23
  1.9457627148E-04  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23 -7.0829256239E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  1.3234889801E-23  1.3062299255E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.3062299255E-05  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23  5.4135262328E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  5.4135262328E-04  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23

 Crystal Tensor_qq(ke,je,1,3)
  1.2773967349E-04  0.0000000000E+00  0.0000000000E+00  1.3234889801E-23  4.3823178520E-04  0.0000000000E+00
  0.0000000000E+00 -1.3234889801E-23  1.9457627148E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  4.3823178520E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.5060951498E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  0.0000000000E+00  1.3062299255E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.3062299255E-05  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23  5.4135262328E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  5.4135262328E-04  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23

 Crystal Tensor_qq(ke,je,3,3)
 -2.0220343500E-04  0.0000000000E+00  0.0000000000E+00  1.3234889801E-23  4.5060951498E-05  0.0000000000E+00
  0.0000000000E+00 -1.3234889801E-23 -7.0829256239E-05  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23
  4.5060951498E-05  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23  5.2135971900E-04  0.0000000000E+00

 Convertion factor =  78.00383 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -14.400  3.58364E-01  3.01665E-01  2.44859E-01  2.34821E-01  2.24991E-01  2.80881E-01  2.76062E-01
   dip-dip  3.57957E-01  3.01175E-01  2.44392E-01  2.34451E-01  2.24510E-01  2.80455E-01  2.75620E-01
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  4.06683E-04  4.89577E-04  4.66823E-04  3.69166E-04  4.80886E-04  4.25644E-04  4.42130E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -5.15117E-16 -1.60832E-05 -8.21904E-16 -6.96405E-06  5.92182E-17 -4.18705E-05 -9.87883E-17 -3.59291E-04
   dip-dip -5.16503E-16  8.36547E-16 -8.23003E-16  1.14284E-15  5.85715E-17 -5.98882E-05 -9.75305E-17 -3.44448E-04
   dip-qua  1.97550E-18  1.49822E-18  1.69266E-18  6.07887E-18  4.34932E-19  3.94113E-19 -1.04725E-18 -2.05168E-18
   qua-qua -5.90278E-19 -1.60832E-05 -5.93360E-19 -6.96405E-06  2.11772E-19  1.80177E-05 -2.10502E-19 -1.48432E-05

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -14.30000 eV

 Vmoy = -20.16501 eV, Vmftabs(up) = -25.36411 eV, Vmftabs(dn) = -25.05951 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -2.575E-05   1.364E-02   2.104E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.842E-05   9.751E-03   1.504E-03
  1 -1    1  1    -1.622E-02   4.907E-01   4.679E-02
  1 -1    1  2     1.920E-03  -5.745E-02  -5.412E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -4.958E-03   1.509E-01   1.448E-02
  1  0    1  1    -1.299E-02   3.939E-01   3.767E-02
  1  0    1  2     1.676E-03  -5.015E-02  -4.724E-03
  1  0    2  1     1.901E-03  -5.577E-02  -5.136E-03
  1  0    2  2    -5.594E-03   1.695E-01   1.620E-02
  1  1    1  1    -1.048E-02   3.189E-01   3.061E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     1.659E-03  -4.868E-02  -4.483E-03
  1  1    2  2    -6.068E-03   1.834E-01   1.748E-02
  2 -2    1  1     1.005E-03  -4.989E-02  -8.037E-03
  2 -2    1  2    -5.752E-06   2.546E-04   3.738E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     9.387E-04  -4.668E-02  -7.528E-03
  2 -1    1  1     1.002E-03  -4.975E-02  -8.018E-03
  2 -1    1  2    -7.043E-06   3.118E-04   4.578E-05
  2 -1    2  1    -5.829E-06   2.567E-04   3.751E-05
  2 -1    2  2     9.415E-04  -4.680E-02  -7.546E-03
  2  0    1  1     9.986E-04  -4.962E-02  -7.998E-03
  2  0    1  2    -7.042E-06   3.117E-04   4.577E-05
  2  0    2  1    -7.138E-06   3.143E-04   4.593E-05
  2  0    2  2     9.442E-04  -4.692E-02  -7.564E-03
  2  1    1  1     9.956E-04  -4.949E-02  -7.978E-03
  2  1    1  2    -5.749E-06   2.545E-04   3.737E-05
  2  1    2  1    -7.138E-06   3.143E-04   4.593E-05
  2  1    2  2     9.470E-04  -4.704E-02  -7.581E-03
  2  2    1  1     9.926E-04  -4.935E-02  -7.958E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -5.827E-06   2.566E-04   3.750E-05
  2  2    2  2     9.497E-04  -4.716E-02  -7.599E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  3.9722849520E-02  2.6733708811E-21  2.9017006235E-03 -1.4233583761E-05 -6.8565947790E-03  3.0955031536E-05
  2.9017006235E-03  1.4233583761E-05  3.1120954701E-02  0.0000000000E+00  1.3905672375E-03  8.1831984718E-06
 -6.8565947790E-03 -3.0955031536E-05  1.3905672375E-03 -8.1831984718E-06  3.2776503060E-02  2.6733708811E-21

 Tensor_dq(1,ks,j2), prototypical atom
  3.7123638065E-04 -1.8791520954E-06  3.0050156256E-05  1.3958920469E-06  6.5117734711E-04 -9.0735234478E-07
  3.0050156256E-05  1.3958920469E-06  7.4698498596E-04  4.7034510317E-06  4.8093560636E-04 -3.2317023500E-06
  6.5117734711E-04 -9.0735234478E-07  4.8093560636E-04 -3.2317023500E-06 -6.2067328669E-05 -8.2887524737E-06

 Tensor_dq(2,ks,j2), prototypical atom
  4.2166831343E-04  1.3741910924E-06  1.2893633716E-04 -2.4352228541E-07  1.3581538665E-04  1.3741616487E-06
  1.2893633716E-04 -2.4352228541E-07 -2.7545415864E-04  2.8279730048E-06  3.2131646215E-04  4.3620769443E-07
  1.3581538665E-04  1.3741616487E-06  3.2131646215E-04  4.3620769443E-07 -1.9258577374E-04 -2.9337921363E-06

 Tensor_dq(3,ks,j2), prototypical atom
 -7.0285652781E-04 -1.6931761959E-07  5.5591004122E-05 -1.5470150842E-06 -5.7731878035E-04  1.8027285169E-07
  5.5591004122E-05 -1.5470150842E-06 -8.6839425321E-04 -1.4565634004E-06  9.5208716974E-05 -4.1324451370E-07
 -5.7731878035E-04  1.8027285169E-07  9.5208716974E-05 -4.1324451370E-07  1.0580435188E-04  1.0107277049E-06

 Tensor_qq(ke,je,1,1), prototypical atom
  1.1334854961E-04  5.2214275022E-24  2.3757939017E-05 -6.6010689930E-09  1.8357272399E-05 -9.2334319478E-08
  2.3757939017E-05 -6.6010689930E-09  2.9129763963E-06 -2.2311283895E-07  1.2927051215E-06  7.9769820375E-08
  1.8357272399E-05 -9.2334319478E-08  1.2927051215E-06  7.9769820375E-08 -2.9708618473E-05  1.5585532561E-07

 Tensor_qq(ke,je,2,1), prototypical atom
  2.3757939017E-05  6.6010689930E-09  3.8778595862E-05 -2.6107137511E-24 -1.9399783626E-06  7.7768482668E-08
  3.8778595862E-05 -3.4190848542E-24 -1.2362605548E-05  1.6979450523E-07  8.3341553090E-07  4.2265775549E-08
 -1.9399783626E-06  7.7768482668E-08  8.3341553090E-07  4.2265775549E-08 -1.0926015487E-05  4.3311955091E-08

 Tensor_qq(ke,je,3,1), prototypical atom
  1.8357272399E-05  9.2334319478E-08 -1.9399783626E-06 -7.7768482668E-08  5.5787885448E-05  0.0000000000E+00
 -1.9399783626E-06 -7.7768482668E-08  2.5449908652E-05 -3.3154073098E-07 -4.9135544483E-06  3.1190483230E-07
  5.5787885448E-05 -5.2214275022E-24 -4.9135544483E-06  3.1190483230E-07  5.9098892901E-06  3.3591638190E-07

 Tensor_qq(ke,je,1,2), prototypical atom
  2.3757939017E-05  6.6010689930E-09  3.8778595862E-05 -2.6107137511E-24 -1.9399783626E-06  7.7768482668E-08
  3.8778595862E-05 -3.4190848542E-24 -1.2362605548E-05  1.6979450523E-07  8.3341553090E-07  4.2265775549E-08
 -1.9399783626E-06  7.7768482668E-08  8.3341553090E-07  4.2265775549E-08 -1.0926015487E-05  4.3311955091E-08

 Tensor_qq(ke,je,2,2), prototypical atom
  2.9129763963E-06  2.2311283895E-07 -1.2362605548E-05 -1.6979450523E-07  2.5449908652E-05  3.3154073098E-07
 -1.2362605548E-05 -1.6979450523E-07  1.1445830223E-04  0.0000000000E+00  1.8693282230E-05  3.8945388887E-07
  2.5449908652E-05  3.3154073098E-07  1.8693282230E-05  3.8945388887E-07 -9.1998586552E-06  1.1444747069E-07

 Tensor_qq(ke,je,3,2), prototypical atom
  1.2927051215E-06 -7.9769820375E-08  8.3341553090E-07 -4.2265775549E-08 -4.9135544483E-06 -3.1190483230E-07
  8.3341553090E-07 -4.2265775549E-08  1.8693282230E-05 -3.8945388887E-07  6.6051466970E-05  4.2567851785E-24
 -4.9135544483E-06 -3.1190483230E-07  6.6051466970E-05  7.8321412533E-24 -1.6037096065E-05  2.7162428930E-07

 Tensor_qq(ke,je,1,3), prototypical atom
  1.8357272399E-05  9.2334319478E-08 -1.9399783626E-06 -7.7768482668E-08  5.5787885448E-05  0.0000000000E+00
 -1.9399783626E-06 -7.7768482668E-08  2.5449908652E-05 -3.3154073098E-07 -4.9135544483E-06  3.1190483230E-07
  5.5787885448E-05 -2.0885710009E-23 -4.9135544483E-06  3.1190483230E-07  5.9098892901E-06  3.3591638190E-07

 Tensor_qq(ke,je,2,3), prototypical atom
  1.2927051215E-06 -7.9769820375E-08  8.3341553090E-07 -4.2265775549E-08 -4.9135544483E-06 -3.1190483230E-07
  8.3341553090E-07 -4.2265775549E-08  1.8693282230E-05 -3.8945388887E-07  6.6051466970E-05  1.6460714274E-24
 -4.9135544483E-06 -3.1190483230E-07  6.6051466970E-05  2.6107137511E-24 -1.6037096065E-05  2.7162428930E-07

 Tensor_qq(ke,je,3,3), prototypical atom
 -2.9708618473E-05 -1.5585532561E-07 -1.0926015487E-05 -4.3311955091E-08  5.9098892901E-06 -3.3591638190E-07
 -1.0926015487E-05 -4.3311955091E-08 -9.1998586552E-06 -1.1444747069E-07 -1.6037096065E-05 -2.7162428930E-07
  5.9098892901E-06 -3.3591638190E-07 -1.6037096065E-05 -2.7162428930E-07  5.9671929586E-05 -2.0885710009E-23

 Crystal Tensor_dd(ke,ks) (Mbarn)
  3.1778279616E-01  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21 -5.4852758232E-02  0.0000000000E+00
  0.0000000000E+00 -3.3881317890E-21  2.4896763761E-01  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21
 -5.4852758232E-02  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21  2.6221202448E-01  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  9.0678839692E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.4685817919E-04  0.0000000000E+00
  0.0000000000E+00 -1.6543612251E-24  2.3303811170E-05  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23
  1.4685817919E-04  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23 -2.3766894779E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  1.6543612251E-24  3.1022876690E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.1022876690E-04  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23  6.6673242472E-06  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  6.6673242472E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,1)
  1.4685817919E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.4630308358E-04  0.0000000000E+00
  0.0000000000E+00 -2.6469779602E-23  2.0359926922E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  4.4630308358E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22  4.7279114321E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00 -1.6543612251E-24  3.1022876690E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.1022876690E-04  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23  6.6673242472E-06  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  6.6673242472E-06  0.0000000000E+00  0.0000000000E+00 -1.3234889801E-23

 Crystal Tensor_qq(ke,je,2,2)
  2.3303811170E-05  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23  2.0359926922E-04  0.0000000000E+00
  0.0000000000E+00 -5.2939559203E-23  9.1566641785E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22
  2.0359926922E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22 -7.3598869242E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00 -2.6469779602E-23  6.6673242472E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  6.6673242472E-06  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22  5.2841173576E-04  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22  5.2841173576E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,3)
  1.4685817919E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.4630308358E-04  0.0000000000E+00
  0.0000000000E+00 -2.6469779602E-23  2.0359926922E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  4.4630308358E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22  4.7279114321E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  0.0000000000E+00  6.6673242472E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  6.6673242472E-06  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22  5.2841173576E-04  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22  5.2841173576E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,3)
 -2.3766894779E-04  0.0000000000E+00  0.0000000000E+00  1.3234889801E-23  4.7279114321E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -7.3598869242E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  4.7279114321E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.7737543669E-04  0.0000000000E+00

 Convertion factor =  78.00526 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -14.300  3.49065E-01  2.99282E-01  2.49411E-01  2.40495E-01  2.31806E-01  2.72032E-01  2.76750E-01
   dip-dip  3.48670E-01  2.98819E-01  2.48968E-01  2.40146E-01  2.31325E-01  2.71602E-01  2.76321E-01
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  3.94821E-04  4.63339E-04  4.43820E-04  3.48579E-04  4.80512E-04  4.30667E-04  4.29508E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -3.57808E-16 -1.99091E-05 -5.92707E-16 -8.41948E-06 -9.85419E-17  2.65560E-04 -7.65871E-17  1.64019E-03
   dip-dip -3.57793E-16  8.84593E-16 -5.97797E-16  1.20789E-15 -9.85296E-17  2.43258E-04 -6.98772E-17  1.65853E-03
   dip-qua  7.68773E-19  1.46018E-18  5.86278E-18  7.20333E-18 -2.79834E-19 -1.15557E-19 -6.54647E-18 -6.72354E-19
   qua-qua -7.84172E-19 -1.99091E-05 -7.73558E-19 -8.41948E-06  2.67548E-19  2.23022E-05 -1.63460E-19 -1.83426E-05

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -14.20000 eV

 Vmoy = -20.16639 eV, Vmftabs(up) = -25.36435 eV, Vmftabs(dn) = -25.05974 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -2.516E-05   1.332E-02   2.055E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.808E-05   9.570E-03   1.476E-03
  1 -1    1  1    -1.565E-02   4.734E-01   4.514E-02
  1 -1    1  2     1.850E-03  -5.534E-02  -5.213E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -4.796E-03   1.459E-01   1.400E-02
  1  0    1  1    -1.254E-02   3.803E-01   3.637E-02
  1  0    1  2     1.616E-03  -4.834E-02  -4.553E-03
  1  0    2  1     1.831E-03  -5.372E-02  -4.947E-03
  1  0    2  2    -5.409E-03   1.639E-01   1.566E-02
  1  1    1  1    -1.013E-02   3.082E-01   2.958E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     1.599E-03  -4.692E-02  -4.321E-03
  1  1    2  2    -5.867E-03   1.773E-01   1.690E-02
  2 -2    1  1     9.527E-04  -4.730E-02  -7.621E-03
  2 -2    1  2    -5.459E-06   2.417E-04   3.549E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     8.899E-04  -4.425E-02  -7.136E-03
  2 -1    1  1     9.498E-04  -4.718E-02  -7.602E-03
  2 -1    1  2    -6.685E-06   2.960E-04   4.346E-05
  2 -1    2  1    -5.533E-06   2.437E-04   3.562E-05
  2 -1    2  2     8.925E-04  -4.436E-02  -7.153E-03
  2  0    1  1     9.469E-04  -4.705E-02  -7.583E-03
  2  0    1  2    -6.684E-06   2.959E-04   4.346E-05
  2  0    2  1    -6.776E-06   2.984E-04   4.361E-05
  2  0    2  2     8.951E-04  -4.448E-02  -7.170E-03
  2  1    1  1     9.440E-04  -4.692E-02  -7.565E-03
  2  1    1  2    -5.457E-06   2.416E-04   3.548E-05
  2  1    2  1    -6.775E-06   2.983E-04   4.361E-05
  2  1    2  2     8.977E-04  -4.459E-02  -7.187E-03
  2  2    1  1     9.411E-04  -4.679E-02  -7.546E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -5.531E-06   2.436E-04   3.560E-05
  2  2    2  2     9.003E-04  -4.471E-02  -7.204E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  3.7078507705E-02  0.0000000000E+00  2.3713705912E-03  2.0383311599E-05 -6.4154235000E-03  1.5666813726E-05
  2.3713705912E-03 -2.0383311599E-05  3.0524828909E-02 -1.4840461790E-37  6.5443893047E-04  1.4054051403E-05
 -6.4154235000E-03 -1.5666813726E-05  6.5443893047E-04 -1.4054051403E-05  2.8544179903E-02  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
  3.6369681297E-04  1.6004847172E-06 -2.5821935249E-05  2.3112084700E-07  6.1988672197E-04 -2.3679626097E-06
 -2.5821935249E-05  2.3112084700E-07  6.9592424282E-04  6.7079917398E-06  4.3696058207E-04  1.0236438833E-07
  6.1988672197E-04 -2.3679626097E-06  4.3696058207E-04  1.0236438833E-07 -1.2969875573E-04 -7.5419005306E-06

 Tensor_dq(2,ks,j2), prototypical atom
  4.4716958975E-04  5.5347230139E-06  1.3330026592E-04 -2.6579098637E-06  1.4698656514E-04 -1.6713319880E-06
  1.3330026592E-04 -2.6579098637E-06 -2.1773473709E-04  4.0053302373E-06  3.7967420455E-04  7.7569493706E-07
  1.4698656514E-04 -1.6713319880E-06  3.7967420455E-04  7.7569493706E-07 -1.8482279977E-04 -4.0138436132E-06

 Tensor_dq(3,ks,j2), prototypical atom
 -6.0749958953E-04  1.2819969425E-06  9.4154962283E-06 -2.8412153225E-06 -5.4297321784E-04  2.1713474475E-07
  9.4154962283E-06 -2.8412153225E-06 -7.5833722874E-04 -1.3682544653E-06  8.3772650532E-05 -3.8752253921E-07
 -5.4297321784E-04  2.1713474475E-07  8.3772650532E-05 -3.8752253921E-07  1.4074568839E-04  9.6833836691E-07

 Tensor_qq(ke,je,1,1), prototypical atom
  1.1080994038E-04  7.8322849438E-24  2.2392940815E-05  2.0929619087E-08  1.5540963679E-05 -3.8511420858E-08
  2.2392940815E-05  2.0929619087E-08 -2.0138698511E-07 -3.4058709640E-07 -3.8229708499E-07  4.6556354546E-08
  1.5540963679E-05 -3.8511420858E-08 -3.8229708499E-07  4.6556354546E-08 -3.0510035364E-05  6.8545268457E-08

 Tensor_qq(ke,je,2,1), prototypical atom
  2.2392940815E-05 -2.0929619087E-08  3.6320808780E-05 -5.2215232959E-24 -1.6829026038E-06  1.5249377853E-07
  3.6320808780E-05 -7.8799921400E-24 -1.0453216074E-05  3.4566148395E-07  2.9878708501E-07  5.2987094987E-08
 -1.6829026038E-06  1.5249377853E-07  2.9878708501E-07  5.2987094987E-08 -9.5968349950E-06  5.4531959214E-08

 Tensor_qq(ke,je,3,1), prototypical atom
  1.5540963679E-05  3.8511420858E-08 -1.6829026038E-06 -1.5249377853E-07  5.6171382296E-05 -2.0886093184E-23
 -1.6829026038E-06 -1.5249377853E-07  2.4264324906E-05 -4.1692165588E-07 -3.0560615881E-06  2.2558332419E-07
  5.6171382296E-05  1.0443046592E-23 -3.0560615881E-06  2.2558332419E-07  4.0976634075E-06  3.2417320864E-07

 Tensor_qq(ke,je,1,2), prototypical atom
  2.2392940815E-05 -2.0929619087E-08  3.6320808780E-05 -5.2215232959E-24 -1.6829026038E-06  1.5249377853E-07
  3.6320808780E-05 -2.6584688441E-24 -1.0453216074E-05  3.4566148395E-07  2.9878708501E-07  5.2987094987E-08
 -1.6829026038E-06  1.5249377853E-07  2.9878708501E-07  5.2987094987E-08 -9.5968349950E-06  5.4531959214E-08

 Tensor_qq(ke,je,2,2), prototypical atom
 -2.0138698511E-07  3.4058709640E-07 -1.0453216074E-05 -3.4566148395E-07  2.4264324906E-05  4.1692165588E-07
 -1.0453216074E-05 -3.4566148395E-07  1.0486657776E-04  1.1594110773E-39  1.9751578128E-05  4.1679895923E-07
  2.4264324906E-05  4.1692165588E-07  1.9751578128E-05  4.1679895923E-07 -9.1141182263E-06  8.3016560976E-08

 Tensor_qq(ke,je,3,2), prototypical atom
 -3.8229708499E-07 -4.6556354546E-08  2.9878708501E-07 -5.2987094987E-08 -3.0560615881E-06 -2.2558332419E-07
  2.9878708501E-07 -5.2987094987E-08  1.9751578128E-05 -4.1679895923E-07  7.0753310358E-05  6.7389840280E-24
 -3.0560615881E-06 -2.2558332419E-07  7.0753310358E-05  5.2215232959E-24 -1.5209767477E-05  2.9937101095E-07

 Tensor_qq(ke,je,1,3), prototypical atom
  1.5540963679E-05  3.8511420858E-08 -1.6829026038E-06 -1.5249377853E-07  5.6171382296E-05 -2.0886093184E-23
 -1.6829026038E-06 -1.5249377853E-07  2.4264324906E-05 -4.1692165588E-07 -3.0560615881E-06  2.2558332419E-07
  5.6171382296E-05  1.0443046592E-23 -3.0560615881E-06  2.2558332419E-07  4.0976634075E-06  3.2417320864E-07

 Tensor_qq(ke,je,2,3), prototypical atom
 -3.8229708499E-07 -4.6556354546E-08  2.9878708501E-07 -5.2987094987E-08 -3.0560615881E-06 -2.2558332419E-07
  2.9878708501E-07 -5.2987094987E-08  1.9751578128E-05 -4.1679895923E-07  7.0753310358E-05  1.5174607321E-24
 -3.0560615881E-06 -2.2558332419E-07  7.0753310358E-05  5.2215232959E-24 -1.5209767477E-05  2.9937101095E-07

 Tensor_qq(ke,je,3,3), prototypical atom
 -3.0510035364E-05 -6.8545268457E-08 -9.5968349950E-06 -5.4531959214E-08  4.0976634075E-06 -3.2417320864E-07
 -9.5968349950E-06 -5.4531959214E-08 -9.1141182263E-06 -8.3016560976E-08 -1.5209767477E-05 -2.9937101095E-07
  4.0976634075E-06 -3.2417320864E-07 -1.5209767477E-05 -2.9937101095E-07  5.9249720306E-05  4.1772186367E-23

 Crystal Tensor_dd(ke,ks) (Mbarn)
  2.9662806164E-01  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -5.1323388000E-02  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.4419863127E-01  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -5.1323388000E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  2.2835343923E-01  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  8.8647952307E-04  0.0000000000E+00  0.0000000000E+00  6.6174449004E-24  1.2432770943E-04  0.0000000000E+00
  0.0000000000E+00  6.6174449004E-24 -1.6110958809E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.2432770943E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -2.4408028291E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00 -6.6174449004E-24  2.9056647024E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  2.9056647024E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  2.3902966801E-06  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.3902966801E-06  0.0000000000E+00  0.0000000000E+00  1.3234889801E-23

 Crystal Tensor_qq(ke,je,3,1)
  1.2432770943E-04  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23  4.4937105836E-04  0.0000000000E+00
  0.0000000000E+00  5.2939559203E-23  1.9411459925E-04  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23
  4.4937105836E-04  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23  3.2781307260E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  6.6174449004E-24  2.9056647024E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  2.9056647024E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  2.3902966801E-06  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.3902966801E-06  0.0000000000E+00  0.0000000000E+00  1.3234889801E-23

 Crystal Tensor_qq(ke,je,2,2)
 -1.6110958809E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.9411459925E-04  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22  8.3893262207E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  1.9411459925E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22 -7.2912945810E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  1.3234889801E-23  2.3902966801E-06  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23
  2.3902966801E-06  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  5.6602648286E-04  0.0000000000E+00
  0.0000000000E+00  5.2939559203E-23  5.6602648286E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,3)
  1.2432770943E-04  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23  4.4937105836E-04  0.0000000000E+00
  0.0000000000E+00  5.2939559203E-23  1.9411459925E-04  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23
  4.4937105836E-04  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23  3.2781307260E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  1.3234889801E-23  2.3902966801E-06  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23
  2.3902966801E-06  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  5.6602648286E-04  0.0000000000E+00
  0.0000000000E+00  5.2939559203E-23  5.6602648286E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,3)
 -2.4408028291E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  3.2781307260E-05  0.0000000000E+00
  0.0000000000E+00 -1.3234889801E-23 -7.2912945810E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.2781307260E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.7399776244E-04  0.0000000000E+00

 Convertion factor =  78.00670 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -14.200  3.19129E-01  2.81916E-01  2.44652E-01  2.25557E-01  2.06733E-01  2.37684E-01  2.56822E-01
   dip-dip  3.18725E-01  2.81462E-01  2.44199E-01  2.25227E-01  2.06256E-01  2.37249E-01  2.56393E-01
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  4.03311E-04  4.54141E-04  4.53282E-04  3.29067E-04  4.76650E-04  4.34880E-04  4.29060E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -4.72018E-16 -2.21947E-05 -5.15484E-16 -9.46794E-06 -1.43578E-16  1.44475E-04  5.41261E-17  7.98935E-04
   dip-dip -4.71915E-16  8.40064E-16 -5.16628E-16  1.11857E-15 -1.42552E-16  1.19435E-04  5.60914E-17  8.18796E-04
   dip-qua  6.06339E-19  1.87659E-18  1.82428E-18  7.34534E-18 -1.28260E-18  1.74156E-19 -1.93558E-18 -2.48215E-18
   qua-qua -7.09005E-19 -2.21947E-05 -6.80507E-19 -9.46794E-06  2.56412E-19  2.50403E-05 -2.97386E-20 -1.98612E-05

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -14.10000 eV

 Vmoy = -20.16777 eV, Vmftabs(up) = -25.36458 eV, Vmftabs(dn) = -25.05998 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -2.460E-05   1.303E-02   2.009E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.776E-05   9.399E-03   1.450E-03
  1 -1    1  1    -1.513E-02   4.575E-01   4.362E-02
  1 -1    1  2     1.785E-03  -5.338E-02  -5.028E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -4.646E-03   1.414E-01   1.357E-02
  1  0    1  1    -1.213E-02   3.678E-01   3.517E-02
  1  0    1  2     1.560E-03  -4.666E-02  -4.394E-03
  1  0    2  1     1.766E-03  -5.182E-02  -4.772E-03
  1  0    2  2    -5.238E-03   1.587E-01   1.517E-02
  1  1    1  1    -9.801E-03   2.982E-01   2.862E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     1.544E-03  -4.530E-02  -4.171E-03
  1  1    2  2    -5.681E-03   1.717E-01   1.636E-02
  2 -2    1  1     9.057E-04  -4.497E-02  -7.245E-03
  2 -2    1  2    -5.196E-06   2.300E-04   3.379E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     8.458E-04  -4.206E-02  -6.783E-03
  2 -1    1  1     9.030E-04  -4.485E-02  -7.228E-03
  2 -1    1  2    -6.363E-06   2.817E-04   4.138E-05
  2 -1    2  1    -5.267E-06   2.319E-04   3.391E-05
  2 -1    2  2     8.483E-04  -4.217E-02  -6.799E-03
  2  0    1  1     9.002E-04  -4.473E-02  -7.210E-03
  2  0    1  2    -6.362E-06   2.817E-04   4.137E-05
  2  0    2  1    -6.450E-06   2.840E-04   4.152E-05
  2  0    2  2     8.508E-04  -4.227E-02  -6.815E-03
  2  1    1  1     8.975E-04  -4.461E-02  -7.192E-03
  2  1    1  2    -5.194E-06   2.300E-04   3.378E-05
  2  1    2  1    -6.449E-06   2.840E-04   4.152E-05
  2  1    2  2     8.533E-04  -4.238E-02  -6.831E-03
  2  2    1  1     8.947E-04  -4.449E-02  -7.174E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -5.265E-06   2.319E-04   3.389E-05
  2  2    2  2     8.558E-04  -4.249E-02  -6.847E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  3.2560262978E-02  5.3469379477E-21  4.5820506180E-03  1.9912341937E-05 -3.2251702571E-03  9.2974990848E-05
  4.5820506180E-03 -1.9912341937E-05  2.6115137927E-02 -2.9681468104E-37  6.9761743363E-04 -1.9401960284E-05
 -3.2251702571E-03 -9.2974990848E-05  6.9761743363E-04  1.9401960284E-05  2.5968233239E-02  5.3469379477E-21

 Tensor_dq(1,ks,j2), prototypical atom
  2.1922274852E-04  2.6200367464E-06 -8.3544430026E-05  5.0865458010E-07  5.2349281773E-04 -4.6115246994E-06
 -8.3544430026E-05  5.0865458010E-07  5.3971780122E-04  4.3990316944E-06  6.5320907143E-04  3.0579935993E-06
  5.2349281773E-04 -4.6115246994E-06  6.5320907143E-04  3.0579935993E-06 -1.1580654150E-04 -3.7848877274E-06

 Tensor_dq(2,ks,j2), prototypical atom
  5.4596863154E-04  5.9344717318E-07  1.5715634875E-04 -3.1679748468E-06  7.1538112796E-05  1.3200021918E-07
  1.5715634875E-04 -3.1679748468E-06 -2.2990423384E-04 -4.0111205254E-06  2.8314841832E-04  1.0409498501E-06
  7.1538112796E-05  1.3200021918E-07  2.8314841832E-04  1.0409498501E-06 -2.4604331369E-04  8.6716444953E-07

 Tensor_dq(3,ks,j2), prototypical atom
 -6.3935546932E-04 -3.1853710130E-06  7.6504279166E-05 -1.9415906749E-06 -4.4475322974E-04  1.3523638877E-06
  7.6504279166E-05 -1.9415906749E-06 -6.0192702364E-04 -2.7680372548E-06  2.7759540859E-04  9.5843853866E-07
 -4.4475322974E-04  1.3523638877E-06  2.7759540859E-04  9.5843853866E-07  2.0453751286E-04  4.7007465886E-07

 Tensor_qq(ke,je,1,1), prototypical atom
  1.1694200363E-04  1.5664857269E-23  1.3171568136E-05  1.6449542796E-07  9.8536252435E-06  8.4796451865E-08
  1.3171568136E-05  1.6449542796E-07 -7.0852865590E-06 -3.9457010984E-08 -5.3087614805E-06  1.9522626899E-07
  9.8536252435E-06  8.4796451865E-08 -5.3087614805E-06  1.9522626899E-07 -3.4534103522E-05  9.4262814244E-08

 Tensor_qq(ke,je,2,1), prototypical atom
  1.3171568136E-05 -1.6449542796E-07  3.6987697434E-05  0.0000000000E+00 -1.2192530553E-06  1.0678616055E-07
  3.6987697434E-05 -1.1185499912E-23 -9.3230033933E-06  1.1384088192E-07  5.8452353622E-06 -1.2883144859E-07
 -1.2192530553E-06  1.0678616055E-07  5.8452353622E-06 -1.2883144859E-07 -5.8067549692E-06  3.7434306060E-08

 Tensor_qq(ke,je,3,1), prototypical atom
  9.8536252435E-06 -8.4796451865E-08 -1.2192530553E-06 -1.0678616055E-07  5.4860868001E-05 -1.0443238179E-23
 -1.2192530553E-06 -1.0678616055E-07  2.3231323997E-05 -2.7138384817E-07  2.8027231245E-08  3.2027822796E-07
  5.4860868001E-05 -5.2216190896E-24  2.8027231245E-08  3.2027822796E-07  1.9729644887E-06  1.1264395802E-07

 Tensor_qq(ke,je,1,2), prototypical atom
  1.3171568136E-05 -1.6449542796E-07  3.6987697434E-05  1.0443238179E-23 -1.2192530553E-06  1.0678616055E-07
  3.6987697434E-05 -7.4226173276E-25 -9.3230033933E-06  1.1384088192E-07  5.8452353622E-06 -1.2883144859E-07
 -1.2192530553E-06  1.0678616055E-07  5.8452353622E-06 -1.2883144859E-07 -5.8067549692E-06  3.7434306060E-08

 Tensor_qq(ke,je,2,2), prototypical atom
 -7.0852865590E-06  3.9457010984E-08 -9.3230033933E-06 -1.1384088192E-07  2.3231323997E-05  2.7138384817E-07
 -9.3230033933E-06 -1.1384088192E-07  9.5461858418E-05  6.9565940869E-39  1.3612744383E-05  4.1569261283E-07
  2.3231323997E-05  2.7138384817E-07  1.3612744383E-05  4.1569261283E-07 -8.8290179981E-06  4.6386581913E-08

 Tensor_qq(ke,je,3,2), prototypical atom
 -5.3087614805E-06 -1.9522626899E-07  5.8452353622E-06  1.2883144859E-07  2.8027231245E-08 -3.2027822796E-07
  5.8452353622E-06  1.2883144859E-07  1.3612744383E-05 -4.1569261283E-07  6.7383817950E-05 -2.3437953780E-23
  2.8027231245E-08 -3.2027822796E-07  6.7383817950E-05 -2.0886476358E-23 -1.0452723713E-05  2.7683559423E-07

 Tensor_qq(ke,je,1,3), prototypical atom
  9.8536252435E-06 -8.4796451865E-08 -1.2192530553E-06 -1.0678616055E-07  5.4860868001E-05  0.0000000000E+00
 -1.2192530553E-06 -1.0678616055E-07  2.3231323997E-05 -2.7138384817E-07  2.8027231245E-08  3.2027822796E-07
  5.4860868001E-05  5.2216190896E-24  2.8027231245E-08  3.2027822796E-07  1.9729644887E-06  1.1264395802E-07

 Tensor_qq(ke,je,2,3), prototypical atom
 -5.3087614805E-06 -1.9522626899E-07  5.8452353622E-06  1.2883144859E-07  2.8027231245E-08 -3.2027822796E-07
  5.8452353622E-06  1.2883144859E-07  1.3612744383E-05 -4.1569261283E-07  6.7383817950E-05  7.8917607576E-24
  2.8027231245E-08 -3.2027822796E-07  6.7383817950E-05  1.0443238179E-23 -1.0452723713E-05  2.7683559423E-07

 Tensor_qq(ke,je,3,3), prototypical atom
 -3.4534103522E-05 -9.4262814244E-08 -5.8067549692E-06 -3.7434306060E-08  1.9729644887E-06 -1.1264395802E-07
 -5.8067549692E-06 -3.7434306060E-08 -8.8290179981E-06 -4.6386581913E-08 -1.0452723713E-05 -2.7683559423E-07
  1.9729644887E-06 -1.1264395802E-07 -1.0452723713E-05 -2.7683559423E-07  5.9392669201E-05  0.0000000000E+00

 Crystal Tensor_dd(ke,ks) (Mbarn)
  2.6048210383E-01  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -2.5801362057E-02  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.0892110342E-01  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -2.5801362057E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  2.0774586591E-01  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  9.3553602902E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  7.8829001948E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -5.6682292472E-05  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23
  7.8829001948E-05  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23 -2.7627282817E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00 -5.2939559203E-23  2.9590157947E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  2.9590157947E-04  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23  4.6761882897E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  4.6761882897E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,1)
  7.8829001948E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.3888694401E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.8585059198E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  4.3888694401E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22  1.5783715910E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00 -5.2939559203E-23  2.9590157947E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  2.9590157947E-04  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23  4.6761882897E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  4.6761882897E-05  0.0000000000E+00  0.0000000000E+00  1.3234889801E-23

 Crystal Tensor_qq(ke,je,2,2)
 -5.6682292472E-05  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23  1.8585059198E-04  0.0000000000E+00
  0.0000000000E+00  2.6469779602E-23  7.6369486734E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  1.8585059198E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22 -7.0632143985E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00 -5.2939559203E-23  4.6761882897E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  4.6761882897E-05  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  5.3907054360E-04  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22  5.3907054360E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,3)
  7.8829001948E-05  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23  4.3888694401E-04  0.0000000000E+00
  0.0000000000E+00 -2.6469779602E-23  1.8585059198E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  4.3888694401E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22  1.5783715910E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00 -5.2939559203E-23  4.6761882897E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  4.6761882897E-05  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  5.3907054360E-04  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22  5.3907054360E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,3)
 -2.7627282817E-04  0.0000000000E+00  0.0000000000E+00 -1.3234889801E-23  1.5783715910E-05  0.0000000000E+00
  0.0000000000E+00  1.3234889801E-23 -7.0632143985E-05  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22
  1.5783715910E-05  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  4.7514135361E-04  0.0000000000E+00

 Convertion factor =  78.00813 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -14.100  2.64248E-01  2.36870E-01  2.09405E-01  2.06933E-01  2.04831E-01  2.12773E-01  2.26143E-01
   dip-dip  2.63897E-01  2.36409E-01  2.08921E-01  2.06626E-01  2.04331E-01  2.12343E-01  2.25716E-01
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  3.51384E-04  4.61116E-04  4.83588E-04  3.06691E-04  4.99622E-04  4.30071E-04  4.26636E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -4.40037E-16 -1.13458E-05 -6.86989E-16 -3.44300E-08  8.33382E-17  7.84422E-04 -7.36488E-17  4.92999E-03
   dip-dip -4.40401E-16  7.67096E-16 -6.91607E-16  9.05238E-16  8.42079E-17  7.73243E-04 -7.23965E-17  4.94830E-03
   dip-qua  1.06316E-18  2.88173E-18  5.22488E-18  6.32019E-18 -1.11900E-18 -2.31804E-19 -1.26068E-18  1.16701E-19
   qua-qua -6.99439E-19 -1.13458E-05 -6.06820E-19 -3.44300E-08  2.49351E-19  1.11795E-05  8.30005E-21 -1.83101E-05

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -14.00000 eV

 Vmoy = -20.16914 eV, Vmftabs(up) = -25.36482 eV, Vmftabs(dn) = -25.06021 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -2.407E-05   1.274E-02   1.966E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.745E-05   9.236E-03   1.425E-03
  1 -1    1  1    -1.463E-02   4.426E-01   4.220E-02
  1 -1    1  2     1.724E-03  -5.156E-02  -4.856E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -4.507E-03   1.371E-01   1.316E-02
  1  0    1  1    -1.174E-02   3.561E-01   3.406E-02
  1  0    1  2     1.507E-03  -4.509E-02  -4.247E-03
  1  0    2  1     1.706E-03  -5.005E-02  -4.609E-03
  1  0    2  2    -5.080E-03   1.539E-01   1.471E-02
  1  1    1  1    -9.497E-03   2.889E-01   2.773E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     1.492E-03  -4.378E-02  -4.031E-03
  1  1    2  2    -5.509E-03   1.665E-01   1.587E-02
  2 -2    1  1     8.632E-04  -4.286E-02  -6.905E-03
  2 -2    1  2    -4.957E-06   2.195E-04   3.225E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     8.059E-04  -4.007E-02  -6.463E-03
  2 -1    1  1     8.606E-04  -4.274E-02  -6.888E-03
  2 -1    1  2    -6.070E-06   2.688E-04   3.949E-05
  2 -1    2  1    -5.025E-06   2.213E-04   3.236E-05
  2 -1    2  2     8.083E-04  -4.018E-02  -6.478E-03
  2  0    1  1     8.580E-04  -4.263E-02  -6.871E-03
  2  0    1  2    -6.069E-06   2.688E-04   3.948E-05
  2  0    2  1    -6.154E-06   2.710E-04   3.963E-05
  2  0    2  2     8.107E-04  -4.028E-02  -6.493E-03
  2  1    1  1     8.554E-04  -4.251E-02  -6.854E-03
  2  1    1  2    -4.955E-06   2.194E-04   3.223E-05
  2  1    2  1    -6.153E-06   2.710E-04   3.962E-05
  2  1    2  2     8.130E-04  -4.038E-02  -6.509E-03
  2  2    1  1     8.527E-04  -4.240E-02  -6.837E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -5.023E-06   2.213E-04   3.235E-05
  2  2    2  2     8.154E-04  -4.049E-02  -6.524E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  3.0755634994E-02  6.6837950506E-22  3.2688838376E-03  1.4495754571E-05 -7.9366651909E-04 -4.1118811373E-06
  3.2688838376E-03 -1.4495754571E-05  2.6821813409E-02 -7.4205031571E-38  4.8677414713E-04  6.3612128295E-06
 -7.9366651909E-04  4.1118811373E-06  4.8677414713E-04 -6.3612128295E-06  2.3470019961E-02  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
  6.7907700749E-05 -2.5473076262E-06 -9.6755219003E-06  9.4852455138E-07  5.9799131070E-04  3.9893383678E-06
 -9.6755219003E-06  9.4852455138E-07  4.6976681004E-04  2.1548560715E-06  6.2359892900E-04 -6.7329341000E-07
  5.9799131070E-04  3.9893383678E-06  6.2359892900E-04 -6.7329341000E-07 -4.3514749764E-05 -5.9172879067E-08

 Tensor_dq(2,ks,j2), prototypical atom
  6.0289246918E-04 -1.8659717270E-06  4.9508538205E-05 -1.1687140337E-07  4.6226035427E-05  3.1656595467E-07
  4.9508538205E-05 -1.1687140337E-07 -3.0206740659E-04 -1.4314861709E-06  2.8556992574E-04 -1.2531218844E-07
  4.6226035427E-05  3.1656595467E-07  2.8556992574E-04 -1.2531218844E-07 -2.3147717611E-04  3.6405690852E-07

 Tensor_dq(3,ks,j2), prototypical atom
 -5.1379098805E-04  7.9992956804E-07  6.6242400571E-05 -7.9534763564E-07 -4.3421845868E-04 -5.7140927048E-07
  6.6242400571E-05 -7.9534763564E-07 -5.6134388955E-04  2.4929534487E-08  2.3423834563E-04  1.5496958110E-06
 -4.3421845868E-04 -5.7140927048E-07  2.3423834563E-04  1.5496958110E-06  2.0449191454E-04 -1.2994991877E-06

 Tensor_qq(ke,je,1,1), prototypical atom
  1.0290666391E-04 -2.0886859533E-23  1.2349043342E-05  1.6013869298E-07  1.3630394949E-05 -2.6272409015E-07
  1.2349043342E-05  1.6013869298E-07 -8.8989980571E-06 -2.1899505621E-07  4.2278068508E-08  6.6342818897E-08
  1.3630394949E-05 -2.6272409015E-07  4.2278068508E-08  6.6342818897E-08 -2.9204853067E-05  9.4963400143E-08

 Tensor_qq(ke,je,2,1), prototypical atom
  1.2349043342E-05 -1.6013869298E-07  3.8380709993E-05  1.9581430812E-24 -1.0659965047E-06  1.0768523197E-07
  3.8380709993E-05  1.9873983604E-24 -7.1921970686E-06  2.6584671232E-07  3.1409981301E-06 -9.7521366014E-09
 -1.0659965047E-06  1.0768523197E-07  3.1409981301E-06 -9.7521366014E-09 -6.0104044687E-06 -1.1005272714E-08

 Tensor_qq(ke,je,3,1), prototypical atom
  1.3630394949E-05  2.6272409015E-07 -1.0659965047E-06 -1.0768523197E-07  5.4821459201E-05 -7.1798579645E-24
 -1.0659965047E-06 -1.0768523197E-07  2.0882566827E-05  2.9962744625E-09  5.1020818206E-07  4.1279521087E-07
  5.4821459201E-05 -4.1773719066E-23  5.1020818206E-07  4.1279521087E-07 -1.8722990757E-06 -1.7555076422E-09

 Tensor_qq(ke,je,1,2), prototypical atom
  1.2349043342E-05 -1.6013869298E-07  3.8380709993E-05 -6.5271436041E-25 -1.0659965047E-06  1.0768523197E-07
  3.8380709993E-05  2.9255279127E-26 -7.1921970686E-06  2.6584671232E-07  3.1409981301E-06 -9.7521366014E-09
 -1.0659965047E-06  1.0768523197E-07  3.1409981301E-06 -9.7521366014E-09 -6.0104044687E-06 -1.1005272714E-08

 Tensor_qq(ke,je,2,2), prototypical atom
 -8.8989980571E-06  2.1899505621E-07 -7.1921970686E-06 -2.6584671232E-07  2.0882566827E-05 -2.9962744625E-09
 -7.1921970686E-06 -2.6584671232E-07  9.1580568968E-05  1.1594536183E-39  1.0825172488E-05  3.8658029846E-07
  2.0882566827E-05 -2.9962744625E-09  1.0825172488E-05  3.8658029846E-07 -1.2815701395E-05 -8.7772149861E-08

 Tensor_qq(ke,je,3,2), prototypical atom
  4.2278068508E-08 -6.6342818897E-08  3.1409981301E-06  9.7521366014E-09  5.1020818206E-07 -4.1279521087E-07
  3.1409981301E-06  9.7521366014E-09  1.0825172488E-05 -3.8658029846E-07  6.2326916955E-05  2.9215805468E-25
  5.1020818206E-07 -4.1279521087E-07  6.2326916955E-05  6.5271436041E-25 -1.0792325826E-05  2.9256352542E-07

 Tensor_qq(ke,je,1,3), prototypical atom
  1.3630394949E-05  2.6272409015E-07 -1.0659965047E-06 -1.0768523197E-07  5.4821459201E-05  8.6484652754E-24
 -1.0659965047E-06 -1.0768523197E-07  2.0882566827E-05  2.9962744625E-09  5.1020818206E-07  4.1279521087E-07
  5.4821459201E-05  0.0000000000E+00  5.1020818206E-07  4.1279521087E-07 -1.8722990757E-06 -1.7555076422E-09

 Tensor_qq(ke,je,2,3), prototypical atom
  4.2278068508E-08 -6.6342818897E-08  3.1409981301E-06  9.7521366014E-09  5.1020818206E-07 -4.1279521087E-07
  3.1409981301E-06  9.7521366014E-09  1.0825172488E-05 -3.8658029846E-07  6.2326916955E-05 -3.6055630573E-25
  5.1020818206E-07 -4.1279521087E-07  6.2326916955E-05  0.0000000000E+00 -1.0792325826E-05  2.9256352542E-07

 Tensor_qq(ke,je,3,3), prototypical atom
 -2.9204853067E-05 -9.4963400143E-08 -6.0104044687E-06  1.1005272714E-08 -1.8722990757E-06  1.7555076422E-09
 -6.0104044687E-06  1.1005272714E-08 -1.2815701395E-05  8.7772149861E-08 -1.0792325826E-05 -2.9256352542E-07
 -1.8722990757E-06  1.7555076422E-09 -1.0792325826E-05 -2.9256352542E-07  5.7028166504E-05 -1.0606608357E-23

 Crystal Tensor_dd(ke,ks) (Mbarn)
  2.4604507995E-01  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21 -6.3493321527E-03  0.0000000000E+00
  0.0000000000E+00 -3.3881317890E-21  2.1457450727E-01  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21
 -6.3493321527E-03  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21  1.8776015969E-01  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  8.2325331125E-04  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23  1.0904315959E-04  0.0000000000E+00
  0.0000000000E+00  5.2939559203E-23 -7.1191984456E-05  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23
  1.0904315959E-04  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23 -2.3363882454E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  5.2939559203E-23  3.0704567994E-04  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23
  3.0704567994E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  2.5127985041E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.5127985041E-05  0.0000000000E+00  0.0000000000E+00 -3.3087224502E-24

 Crystal Tensor_qq(ke,je,3,1)
  1.0904315959E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.3857167361E-04  0.0000000000E+00
  0.0000000000E+00  2.6469779602E-23  1.6706053461E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22
  4.3857167361E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22 -1.4978392606E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00 -5.2939559203E-23  3.0704567994E-04  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23
  3.0704567994E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  2.5127985041E-05  0.0000000000E+00
  0.0000000000E+00 -2.6469779602E-23  2.5127985041E-05  0.0000000000E+00  0.0000000000E+00  3.3087224502E-24

 Crystal Tensor_qq(ke,je,2,2)
 -7.1191984456E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.6706053461E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  7.3264455175E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.6706053461E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -1.0252561116E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  0.0000000000E+00  2.5127985041E-05  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  2.5127985041E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.9861533564E-04  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22  4.9861533564E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,3)
  1.0904315959E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.3857167361E-04  0.0000000000E+00
  0.0000000000E+00  2.6469779602E-23  1.6706053461E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22
  4.3857167361E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22 -1.4978392606E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  0.0000000000E+00  2.5127985041E-05  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22
  2.5127985041E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.9861533564E-04  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22  4.9861533564E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22

 Crystal Tensor_qq(ke,je,3,3)
 -2.3363882454E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -1.4978392606E-05  0.0000000000E+00
  0.0000000000E+00 -3.3087224502E-24 -1.0252561116E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -1.4978392606E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.5622533203E-04  0.0000000000E+00

 Convertion factor =  78.00956 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -14.000  2.28316E-01  2.21711E-01  2.15018E-01  2.10530E-01  2.06309E-01  1.89618E-01  2.16537E-01
   dip-dip  2.27954E-01  2.21264E-01  2.14575E-01  2.10213E-01  2.05852E-01  1.89199E-01  2.16127E-01
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  3.62307E-04  4.47408E-04  4.43354E-04  3.16509E-04  4.56839E-04  4.18422E-04  4.10145E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -3.70826E-16 -1.07460E-06 -4.18981E-16 -8.45021E-06  1.98507E-17 -3.19888E-05 -3.28267E-17 -2.33496E-04
   dip-dip -3.72082E-16  6.89494E-16 -4.20846E-16  8.29809E-16  2.00101E-17 -3.62345E-05 -3.02275E-17 -2.30339E-04
   dip-qua  1.74692E-18  2.35160E-18  2.52160E-18  4.72809E-18 -3.76873E-19 -1.13056E-18 -2.44913E-18 -1.66718E-18
   qua-qua -4.91228E-19 -1.07460E-06 -6.57342E-19 -8.45021E-06  2.17491E-19  4.24570E-06 -1.50045E-19 -3.15699E-06

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -13.90000 eV

 Vmoy = -20.17051 eV, Vmftabs(up) = -25.36505 eV, Vmftabs(dn) = -25.06045 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -2.356E-05   1.247E-02   1.924E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.716E-05   9.080E-03   1.401E-03
  1 -1    1  1    -1.417E-02   4.287E-01   4.087E-02
  1 -1    1  2     1.667E-03  -4.985E-02  -4.694E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -4.378E-03   1.332E-01   1.278E-02
  1  0    1  1    -1.138E-02   3.452E-01   3.302E-02
  1  0    1  2     1.459E-03  -4.363E-02  -4.109E-03
  1  0    2  1     1.650E-03  -4.840E-02  -4.456E-03
  1  0    2  2    -4.932E-03   1.495E-01   1.428E-02
  1  1    1  1    -9.214E-03   2.803E-01   2.690E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     1.444E-03  -4.236E-02  -3.900E-03
  1  1    2  2    -5.348E-03   1.617E-01   1.540E-02
  2 -2    1  1     8.245E-04  -4.094E-02  -6.596E-03
  2 -2    1  2    -4.740E-06   2.099E-04   3.084E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     7.696E-04  -3.826E-02  -6.172E-03
  2 -1    1  1     8.220E-04  -4.083E-02  -6.579E-03
  2 -1    1  2    -5.804E-06   2.571E-04   3.777E-05
  2 -1    2  1    -4.805E-06   2.117E-04   3.095E-05
  2 -1    2  2     7.719E-04  -3.837E-02  -6.186E-03
  2  0    1  1     8.195E-04  -4.072E-02  -6.563E-03
  2  0    1  2    -5.803E-06   2.570E-04   3.776E-05
  2  0    2  1    -5.885E-06   2.592E-04   3.790E-05
  2  0    2  2     7.741E-04  -3.847E-02  -6.201E-03
  2  1    1  1     8.170E-04  -4.061E-02  -6.547E-03
  2  1    1  2    -4.738E-06   2.098E-04   3.083E-05
  2  1    2  1    -5.884E-06   2.592E-04   3.790E-05
  2  1    2  2     7.764E-04  -3.857E-02  -6.215E-03
  2  2    1  1     8.145E-04  -4.050E-02  -6.531E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -4.804E-06   2.116E-04   3.094E-05
  2  2    2  2     7.787E-04  -3.867E-02  -6.230E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  2.7001825368E-02  0.0000000000E+00  2.7638701690E-03  2.7829919700E-05  1.0640700200E-03 -1.8244457938E-06
  2.7638701690E-03 -2.7829919700E-05  2.4499078012E-02 -1.4841278576E-37  1.3013106908E-04  3.5384161231E-05
  1.0640700200E-03  1.8244457938E-06  1.3013106908E-04 -3.5384161231E-05  1.9149053374E-02  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
  2.5513873819E-05 -8.9452788280E-07 -1.0601898301E-05  6.7705685371E-07  4.7879857949E-04  2.2279756347E-06
 -1.0601898301E-05  6.7705685371E-07  2.9481360780E-04  5.5425068397E-08  5.7379631151E-04 -1.5121407503E-07
  4.7879857949E-04  2.2279756347E-06  5.7379631151E-04 -1.5121407503E-07 -4.2832907790E-05 -8.4789099599E-07

 Tensor_dq(2,ks,j2), prototypical atom
  5.5666027637E-04 -2.5843339773E-06  3.1406020305E-05 -1.0536744202E-06  7.8217819329E-05 -1.3469198857E-06
  3.1406020305E-05 -1.0536744202E-06 -2.6778281292E-04 -2.9187955130E-06  2.6931787025E-04 -8.6042551210E-07
  7.8217819329E-05 -1.3469198857E-06  2.6931787025E-04 -8.6042551210E-07 -1.9274978766E-04 -7.0456464412E-07

 Tensor_dq(3,ks,j2), prototypical atom
 -3.9244495922E-04 -9.6113165295E-07  6.9933717225E-05 -1.3237326085E-06 -2.9262462523E-04 -5.6435229976E-07
  6.9933717225E-05 -1.3237326085E-06 -3.8390740392E-04  1.4999290920E-07  2.0958794893E-04  2.5457716423E-07
 -2.9262462523E-04 -5.6435229976E-07  2.0958794893E-04  2.5457716423E-07  2.1018157937E-04 -2.4912524369E-09

 Tensor_qq(ke,je,1,1), prototypical atom
  9.7055352705E-05  1.0443621354E-23  1.0917373153E-05  2.2913411585E-07  1.0141837730E-05 -1.6744865230E-07
  1.0917373153E-05  2.2913411585E-07 -1.5337210912E-05 -7.0611952376E-08  1.4523643864E-06  6.4841728911E-08
  1.0141837730E-05 -1.6744865230E-07  1.4523643864E-06  6.4841728911E-08 -2.8441318257E-05  1.6762515925E-07

 Tensor_qq(ke,je,2,1), prototypical atom
  1.0917373153E-05 -2.2913411585E-07  3.7978198331E-05  0.0000000000E+00 -2.4791874568E-06  1.5230580203E-07
  3.7978198331E-05 -6.6004930859E-25 -7.2400789300E-06  3.2067126982E-07  2.0509585890E-06 -3.5655234025E-08
 -2.4791874568E-06  1.5230580203E-07  2.0509585890E-06 -3.5655234025E-08 -5.7216285798E-06  4.8747467568E-09

 Tensor_qq(ke,je,3,1), prototypical atom
  1.0141837730E-05  1.6744865230E-07 -2.4791874568E-06 -1.5230580203E-07  4.8547244376E-05  7.8327160155E-24
 -2.4791874568E-06 -1.5230580203E-07  1.1044308660E-05 -4.1013965191E-08  1.7633300076E-06  3.1778920081E-07
  4.8547244376E-05  2.0887242708E-23  1.7633300076E-06  3.1778920081E-07 -2.5356145981E-06  3.7928256419E-08

 Tensor_qq(ke,je,1,2), prototypical atom
  1.0917373153E-05 -2.2913411585E-07  3.7978198331E-05  0.0000000000E+00 -2.4791874568E-06  1.5230580203E-07
  3.7978198331E-05 -6.6004930859E-25 -7.2400789300E-06  3.2067126982E-07  2.0509585890E-06 -3.5655234025E-08
 -2.4791874568E-06  1.5230580203E-07  2.0509585890E-06 -3.5655234025E-08 -5.7216285798E-06  4.8747467568E-09

 Tensor_qq(ke,je,2,2), prototypical atom
 -1.5337210912E-05  7.0611952376E-08 -7.2400789300E-06 -3.2067126982E-07  1.1044308660E-05  4.1013965191E-08
 -7.2400789300E-06 -3.2067126982E-07  7.9379307303E-05  2.0290810553E-39  9.1437002618E-06  3.0208806871E-07
  1.1044308660E-05  4.1013965191E-08  9.1437002618E-06  3.0208806871E-07 -1.4898915308E-05 -3.6807465955E-08

 Tensor_qq(ke,je,3,2), prototypical atom
  1.4523643864E-06 -6.4841728911E-08  2.0509585890E-06  3.5655234025E-08  1.7633300076E-06 -3.1778920081E-07
  2.0509585890E-06  3.5655234025E-08  9.1437002618E-06 -3.0208806871E-07  6.0901186781E-05 -2.4691262923E-25
  1.7633300076E-06 -3.1778920081E-07  6.0901186781E-05  0.0000000000E+00 -9.5267659633E-06  3.2494225207E-07

 Tensor_qq(ke,je,1,3), prototypical atom
  1.0141837730E-05  1.6744865230E-07 -2.4791874568E-06 -1.5230580203E-07  4.8547244376E-05  1.0443621354E-23
 -2.4791874568E-06 -1.5230580203E-07  1.1044308660E-05 -4.1013965191E-08  1.7633300076E-06  3.1778920081E-07
  4.8547244376E-05  2.0887242708E-23  1.7633300076E-06  3.1778920081E-07 -2.5356145981E-06  3.7928256419E-08

 Tensor_qq(ke,je,2,3), prototypical atom
  1.4523643864E-06 -6.4841728911E-08  2.0509585890E-06  3.5655234025E-08  1.7633300076E-06 -3.1778920081E-07
  2.0509585890E-06  3.5655234025E-08  9.1437002618E-06 -3.0208806871E-07  6.0901186781E-05 -2.8578179677E-24
  1.7633300076E-06 -3.1778920081E-07  6.0901186781E-05 -2.6109053385E-24 -9.5267659633E-06  3.2494225207E-07

 Tensor_qq(ke,je,3,3), prototypical atom
 -2.8441318257E-05 -1.6762515925E-07 -5.7216285798E-06 -4.8747467568E-09 -2.5356145981E-06 -3.7928256419E-08
 -5.7216285798E-06 -4.8747467568E-09 -1.4898915308E-05  3.6807465955E-08 -9.5267659633E-06 -3.2494225207E-07
 -2.5356145981E-06 -3.7928256419E-08 -9.5267659633E-06 -3.2494225207E-07  5.7278593011E-05 -7.8327160155E-24

 Crystal Tensor_dd(ke,ks) (Mbarn)
  2.1601460294E-01  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  8.5125601603E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.9599262409E-01  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  8.5125601603E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.5319242699E-01  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  7.7644282164E-04  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23  8.1134701843E-05  0.0000000000E+00
  0.0000000000E+00 -5.2939559203E-23 -1.2269768729E-04  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23
  8.1134701843E-05  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23 -2.2753054606E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  5.2939559203E-23  3.0382558665E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.0382558665E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22  1.6407668712E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.6407668712E-05  0.0000000000E+00  0.0000000000E+00  1.6543612251E-24

 Crystal Tensor_qq(ke,je,3,1)
  8.1134701843E-05  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23  3.8837795501E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  8.8354469278E-05  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  3.8837795501E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22 -2.0284916785E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00 -5.2939559203E-23  3.0382558665E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.0382558665E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22  1.6407668712E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.6407668712E-05  0.0000000000E+00  0.0000000000E+00 -1.6543612251E-24

 Crystal Tensor_qq(ke,je,2,2)
 -1.2269768729E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  8.8354469278E-05  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22  6.3503445842E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22
  8.8354469278E-05  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22 -1.1919132246E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00 -2.6469779602E-23  1.6407668712E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.6407668712E-05  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22  4.8720949425E-04  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22  4.8720949425E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22

 Crystal Tensor_qq(ke,je,1,3)
  8.1134701843E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  3.8837795501E-04  0.0000000000E+00
  0.0000000000E+00 -5.2939559203E-23  8.8354469278E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.8837795501E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -2.0284916785E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00 -2.6469779602E-23  1.6407668712E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.6407668712E-05  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22  4.8720949425E-04  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22  4.8720949425E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22

 Crystal Tensor_qq(ke,je,3,3)
 -2.2753054606E-04  0.0000000000E+00  0.0000000000E+00 -1.6543612251E-24 -2.0284916785E-05  0.0000000000E+00
  0.0000000000E+00  1.6543612251E-24 -1.1919132246E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
 -2.0284916785E-05  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22  4.5822874409E-04  0.0000000000E+00

 Convertion factor =  78.01099 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -13.900  1.81732E-01  1.89076E-01  1.96419E-01  1.92242E-01  1.88278E-01  1.52594E-01  1.88792E-01
   dip-dip  1.81367E-01  1.88680E-01  1.95993E-01  1.91916E-01  1.87840E-01  1.52221E-01  1.88400E-01
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  3.64268E-04  3.96422E-04  4.26767E-04  3.25922E-04  4.37950E-04  3.72861E-04  3.91824E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -3.27676E-16 -3.08698E-06 -3.27030E-16 -5.41156E-06 -6.38793E-17 -3.28540E-05  8.61708E-18 -1.29294E-04
   dip-dip -3.28729E-16  6.28097E-16 -3.30272E-16  7.11313E-16 -6.08258E-17 -3.79922E-05  1.13823E-17 -1.23250E-04
   dip-qua  1.58114E-18  2.11094E-18  3.71752E-18  3.66805E-18 -3.10514E-18 -1.67871E-18 -2.83324E-18 -1.03942E-18
   qua-qua -5.28177E-19 -3.08698E-06 -4.75645E-19 -5.41156E-06  5.16344E-20  5.13820E-06  6.80070E-20 -6.04488E-06

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -13.80000 eV

 Vmoy = -20.17195 eV, Vmftabs(up) = -25.36529 eV, Vmftabs(dn) = -25.06068 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -2.307E-05   1.222E-02   1.885E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.687E-05   8.931E-03   1.378E-03
  1 -1    1  1    -1.374E-02   4.156E-01   3.963E-02
  1 -1    1  2     1.613E-03  -4.824E-02  -4.542E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -4.257E-03   1.295E-01   1.243E-02
  1  0    1  1    -1.105E-02   3.350E-01   3.204E-02
  1  0    1  2     1.413E-03  -4.225E-02  -3.979E-03
  1  0    2  1     1.597E-03  -4.683E-02  -4.311E-03
  1  0    2  2    -4.795E-03   1.453E-01   1.388E-02
  1  1    1  1    -8.948E-03   2.722E-01   2.613E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     1.399E-03  -4.102E-02  -3.776E-03
  1  1    2  2    -5.199E-03   1.571E-01   1.497E-02
  2 -2    1  1     7.892E-04  -3.918E-02  -6.313E-03
  2 -2    1  2    -4.541E-06   2.012E-04   2.956E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     7.364E-04  -3.661E-02  -5.905E-03
  2 -1    1  1     7.868E-04  -3.908E-02  -6.297E-03
  2 -1    1  2    -5.561E-06   2.463E-04   3.620E-05
  2 -1    2  1    -4.605E-06   2.029E-04   2.967E-05
  2 -1    2  2     7.386E-04  -3.671E-02  -5.919E-03
  2  0    1  1     7.844E-04  -3.897E-02  -6.282E-03
  2  0    1  2    -5.561E-06   2.463E-04   3.619E-05
  2  0    2  1    -5.639E-06   2.484E-04   3.633E-05
  2  0    2  2     7.408E-04  -3.681E-02  -5.933E-03
  2  1    1  1     7.820E-04  -3.886E-02  -6.266E-03
  2  1    1  2    -4.540E-06   2.011E-04   2.955E-05
  2  1    2  1    -5.638E-06   2.484E-04   3.633E-05
  2  1    2  2     7.429E-04  -3.690E-02  -5.947E-03
  2  2    1  1     7.796E-04  -3.876E-02  -6.250E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -4.603E-06   2.028E-04   2.966E-05
  2  2    2  2     7.451E-04  -3.700E-02  -5.961E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  2.4594408949E-02  0.0000000000E+00  2.1417625209E-03 -4.2124558309E-05 -2.1276184570E-04  3.0330739424E-05
  2.1417625209E-03  4.2124558309E-05  2.1559347287E-02 -3.7103877096E-37  1.6119751100E-04 -2.6258095084E-05
 -2.1276184570E-04 -3.0330739424E-05  1.6119751100E-04  2.6258095084E-05  1.8897213351E-02  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
 -5.2882668231E-05 -4.5073264226E-06  4.6477724802E-05 -7.6414710682E-07  4.9571925462E-04 -3.5802386613E-07
  4.6477724802E-05 -7.6414710682E-07  4.2955964892E-04 -2.1641781258E-06  4.6707963787E-04  3.8672326207E-07
  4.9571925462E-04 -3.5802386613E-07  4.6707963787E-04  3.8672326207E-07 -5.6007224144E-05  3.3435212918E-07

 Tensor_dq(2,ks,j2), prototypical atom
  5.1202180449E-04 -1.0145290002E-06  7.8540666442E-06 -1.8450793673E-08  6.0292254145E-05  2.1598723842E-06
  7.8540666442E-06 -1.8450793673E-08 -2.8455451090E-04  3.8330540777E-06  2.4711942803E-04 -1.6583081619E-06
  6.0292254145E-05  2.1598723842E-06  2.4711942803E-04 -1.6583081619E-06 -1.5742053275E-04 -6.6800756687E-07

 Tensor_dq(3,ks,j2), prototypical atom
 -2.4946839728E-04  1.8773422595E-06 -1.3749093478E-05  1.8208104664E-07 -3.6914916210E-04 -1.2010799357E-07
 -1.3749093478E-05  1.8208104664E-07 -6.2617153504E-04 -5.9333685854E-07  2.6145258257E-04 -3.3693145373E-07
 -3.6914916210E-04 -1.2010799357E-07  2.6145258257E-04 -3.3693145373E-07  2.3068705822E-04  3.2545550542E-07

 Tensor_qq(ke,je,1,1), prototypical atom
  8.7788270651E-05  2.0887625883E-23  9.7688536296E-06  4.3613511188E-07  1.9330478858E-06 -2.2357448590E-07
  9.7688536296E-06  4.3613511188E-07 -2.4248227087E-05 -4.4032766283E-08  1.5742099943E-06  3.0197506748E-08
  1.9330478858E-06 -2.2357448590E-07  1.5742099943E-06  3.0197506748E-08 -2.5948943363E-05  8.8808361859E-08

 Tensor_qq(ke,je,2,1), prototypical atom
  9.7688536296E-06 -4.3613511188E-07  3.9507669173E-05  0.0000000000E+00  2.4612547931E-06  3.4197733969E-07
  3.9507669173E-05  1.1903182064E-24  2.1324447726E-06  5.4333132380E-07  1.7092504185E-07 -1.2590871025E-07
  2.4612547931E-06  3.4197733969E-07  1.7092504185E-07 -1.2590871025E-07 -6.2937254443E-06 -1.7875486939E-07

 Tensor_qq(ke,je,3,1), prototypical atom
  1.9330478858E-06  2.2357448590E-07  2.4612547931E-06 -3.4197733969E-07  5.6155346547E-05 -5.2219064707E-24
  2.4612547931E-06 -3.4197733969E-07  2.8544014759E-05 -3.1064292304E-07 -2.6192728045E-06  2.7785958703E-07
  5.6155346547E-05  0.0000000000E+00 -2.6192728045E-06  2.7785958703E-07 -5.8378214985E-06  4.4091351933E-08

 Tensor_qq(ke,je,1,2), prototypical atom
  9.7688536296E-06 -4.3613511188E-07  3.9507669173E-05 -2.0887625883E-23  2.4612547931E-06  3.4197733969E-07
  3.9507669173E-05 -1.9697307676E-23  2.1324447726E-06  5.4333132380E-07  1.7092504185E-07 -1.2590871025E-07
  2.4612547931E-06  3.4197733969E-07  1.7092504185E-07 -1.2590871025E-07 -6.2937254443E-06 -1.7875486939E-07

 Tensor_qq(ke,je,2,2), prototypical atom
 -2.4248227087E-05  4.4032766283E-08  2.1324447726E-06 -5.4333132380E-07  2.8544014759E-05  3.1064292304E-07
  2.1324447726E-06 -5.4333132380E-07  1.1572685427E-04 -1.3913953911E-38 -4.5641950518E-07  1.8705419660E-07
  2.8544014759E-05  3.1064292304E-07 -4.5641950518E-07  1.8705419660E-07 -2.1966290691E-05 -1.9940600732E-07

 Tensor_qq(ke,je,3,2), prototypical atom
  1.5742099943E-06 -3.0197506748E-08  1.7092504185E-07  1.2590871025E-07 -2.6192728045E-06 -2.7785958703E-07
  1.7092504185E-07  1.2590871025E-07 -4.5641950518E-07 -1.8705419660E-07  6.0915298541E-05  2.6954227504E-24
 -2.6192728045E-06 -2.7785958703E-07  6.0915298541E-05  2.0887625883E-23 -7.0188398148E-06  3.1935167369E-07

 Tensor_qq(ke,je,1,3), prototypical atom
  1.9330478858E-06  2.2357448590E-07  2.4612547931E-06 -3.4197733969E-07  5.6155346547E-05 -5.2219064707E-24
  2.4612547931E-06 -3.4197733969E-07  2.8544014759E-05 -3.1064292304E-07 -2.6192728045E-06  2.7785958703E-07
  5.6155346547E-05  0.0000000000E+00 -2.6192728045E-06  2.7785958703E-07 -5.8378214985E-06  4.4091351933E-08

 Tensor_qq(ke,je,2,3), prototypical atom
  1.5742099943E-06 -3.0197506748E-08  1.7092504185E-07  1.2590871025E-07 -2.6192728045E-06 -2.7785958703E-07
  1.7092504185E-07  1.2590871025E-07 -4.5641950518E-07 -1.8705419660E-07  6.0915298541E-05  2.6954227504E-24
 -2.6192728045E-06 -2.7785958703E-07  6.0915298541E-05  2.0887625883E-23 -7.0188398148E-06  3.1935167369E-07

 Tensor_qq(ke,je,3,3), prototypical atom
 -2.5948943363E-05 -8.8808361859E-08 -6.2937254443E-06  1.7875486939E-07 -5.8378214985E-06 -4.4091351933E-08
 -6.2937254443E-06  1.7875486939E-07 -2.1966290691E-05  1.9940600732E-07 -7.0188398148E-06 -3.1935167369E-07
 -5.8378214985E-06 -4.4091351933E-08 -7.0188398148E-06 -3.1935167369E-07  5.8941091773E-05  0.0000000000E+00

 Crystal Tensor_dd(ke,ks) (Mbarn)
  1.9675527159E-01  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20 -1.7020947656E-03  0.0000000000E+00
  0.0000000000E+00  1.3552527156E-20  1.7247477829E-01  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21
 -1.7020947656E-03  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21  1.5117770681E-01  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  7.0230616521E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.5464383087E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -1.9398581669E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.5464383087E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -2.0759154690E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  0.0000000000E+00  3.1606135338E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.1606135338E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.3674003348E-06  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.3674003348E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,1)
  1.5464383087E-05  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  4.4924277237E-04  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22  2.2835211807E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  4.4924277237E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22 -4.6702571988E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00 -1.0587911841E-22  3.1606135338E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  3.1606135338E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.3674003348E-06  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22  1.3674003348E-06  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23

 Crystal Tensor_qq(ke,je,2,2)
 -1.9398581669E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  2.2835211807E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  9.2581483413E-04  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23
  2.2835211807E-04  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23 -1.7573032553E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  0.0000000000E+00  1.3674003348E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.3674003348E-06  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23  4.8732238833E-04  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22  4.8732238833E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,3)
  1.5464383087E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.4924277237E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.2835211807E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  4.4924277237E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -4.6702571988E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  0.0000000000E+00  1.3674003348E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.3674003348E-06  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23  4.8732238833E-04  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22  4.8732238833E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,3)
 -2.0759154690E-04  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23 -4.6702571988E-05  0.0000000000E+00
  0.0000000000E+00  5.2939559203E-23 -1.7573032553E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -4.6702571988E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.7152873419E-04  0.0000000000E+00

 Convertion factor =  78.01242 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -13.800  1.79776E-01  1.76539E-01  1.72892E-01  1.70864E-01  1.68952E-01  1.52205E-01  1.73898E-01
   dip-dip  1.79389E-01  1.75932E-01  1.72475E-01  1.70509E-01  1.68543E-01  1.51767E-01  1.73469E-01
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  3.86275E-04  6.06557E-04  4.17109E-04  3.54922E-04  4.08733E-04  4.37765E-04  4.28989E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -3.27486E-16 -1.10924E-05 -3.80230E-16 -9.00028E-06 -6.20904E-17  2.74631E-04  5.78823E-18  1.62987E-03
   dip-dip -3.27636E-16  5.38924E-16 -3.84010E-16  6.46994E-16 -6.11942E-17  2.60642E-04  8.75027E-18  1.65120E-03
   dip-qua  1.01901E-18  2.90254E-18  4.61636E-18  2.81885E-18 -1.38804E-18 -2.36203E-18 -2.75549E-18 -3.52713E-18
   qua-qua -8.68647E-19 -1.10924E-05 -8.36829E-19 -9.00028E-06  4.91851E-19  1.39890E-05 -2.06550E-19 -2.13348E-05

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -13.70000 eV

 Vmoy = -20.17342 eV, Vmftabs(up) = -25.36552 eV, Vmftabs(dn) = -25.06091 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -2.261E-05   1.197E-02   1.847E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.660E-05   8.788E-03   1.356E-03
  1 -1    1  1    -1.334E-02   4.033E-01   3.846E-02
  1 -1    1  2     1.562E-03  -4.672E-02  -4.399E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -4.145E-03   1.261E-01   1.210E-02
  1  0    1  1    -1.073E-02   3.254E-01   3.112E-02
  1  0    1  2     1.369E-03  -4.095E-02  -3.856E-03
  1  0    2  1     1.547E-03  -4.536E-02  -4.175E-03
  1  0    2  2    -4.666E-03   1.414E-01   1.351E-02
  1  1    1  1    -8.699E-03   2.647E-01   2.540E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     1.356E-03  -3.976E-02  -3.660E-03
  1  1    2  2    -5.058E-03   1.529E-01   1.457E-02
  2 -2    1  1     7.568E-04  -3.757E-02  -6.054E-03
  2 -2    1  2    -4.359E-06   1.931E-04   2.838E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     7.060E-04  -3.510E-02  -5.661E-03
  2 -1    1  1     7.545E-04  -3.747E-02  -6.039E-03
  2 -1    1  2    -5.338E-06   2.365E-04   3.476E-05
  2 -1    2  1    -4.420E-06   1.948E-04   2.849E-05
  2 -1    2  2     7.081E-04  -3.519E-02  -5.675E-03
  2  0    1  1     7.522E-04  -3.737E-02  -6.024E-03
  2  0    1  2    -5.338E-06   2.365E-04   3.475E-05
  2  0    2  1    -5.413E-06   2.385E-04   3.489E-05
  2  0    2  2     7.102E-04  -3.529E-02  -5.688E-03
  2  1    1  1     7.499E-04  -3.727E-02  -6.009E-03
  2  1    1  2    -4.358E-06   1.930E-04   2.837E-05
  2  1    2  1    -5.413E-06   2.385E-04   3.488E-05
  2  1    2  2     7.123E-04  -3.538E-02  -5.702E-03
  2  2    1  1     7.476E-04  -3.717E-02  -5.994E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -4.419E-06   1.947E-04   2.848E-05
  2  2    2  2     7.144E-04  -3.547E-02  -5.715E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  2.3042889849E-02  3.3420814492E-22  1.7915605704E-03 -1.6374001091E-05 -1.7292618468E-03  5.5732250788E-06
  1.7915605704E-03  1.6374001091E-05  1.8915649126E-02  7.4209115502E-38  1.6491070773E-04 -2.1896803061E-05
 -1.7292618468E-03 -5.5732250788E-06  1.6491070773E-04  2.1896803061E-05  1.8168240210E-02  3.3420814492E-22

 Tensor_dq(1,ks,j2), prototypical atom
  5.9592565788E-05 -1.5540475731E-06  4.0294838284E-05  1.2601562012E-06  5.8271548627E-04  2.6073269719E-07
  4.0294838284E-05  1.2601562012E-06  5.0427721193E-04  1.4467927687E-06  4.2017333802E-04 -3.1310172886E-07
  5.8271548627E-04  2.6073269719E-07  4.2017333802E-04 -3.1310172886E-07 -9.5159763294E-05 -6.8332473685E-07

 Tensor_dq(2,ks,j2), prototypical atom
  4.5047342826E-04  9.3174569965E-07  3.3665473960E-06  2.6913756481E-07  7.1422068860E-05 -2.3897977033E-06
  3.3665473960E-06  2.6913756481E-07 -2.3138452746E-04 -1.6122518964E-06  2.0785932133E-04 -4.7949302588E-07
  7.1422068860E-05 -2.3897977033E-06  2.0785932133E-04 -4.7949302588E-07 -1.5456977543E-04  1.5555650440E-06

 Tensor_dq(3,ks,j2), prototypical atom
 -3.2898066422E-04  8.0182935895E-07 -2.2761227056E-06 -4.2814936693E-07 -4.5801766600E-04  1.1601318411E-06
 -2.2761227056E-06 -4.2814936693E-07 -6.6640485234E-04 -4.0614705709E-07  2.2706237522E-04  6.2573558590E-08
 -4.5801766600E-04  1.1601318411E-06  2.2706237522E-04  6.2573558590E-08  2.4569186640E-04 -5.3999570049E-07

 Tensor_qq(ke,je,1,1), prototypical atom
  8.6214236739E-05 -1.0444004529E-23  1.0806302345E-05  2.4833042647E-07  1.2490289335E-05  1.0435172397E-07
  1.0806302345E-05  2.4833042647E-07 -9.0741878036E-06  6.0942867392E-08 -6.5305861494E-07  1.1263036998E-08
  1.2490289335E-05  1.0435172397E-07 -6.5305861494E-07  1.1263036998E-08 -2.9534532537E-05 -3.5598784026E-08

 Tensor_qq(ke,je,2,1), prototypical atom
  1.0806302345E-05 -2.4833042647E-07  3.8645263350E-05  2.6110011322E-24  1.5902884473E-06  3.4076606716E-07
  3.8645263350E-05  1.6896893556E-24 -5.9545002053E-07  5.1729637046E-07  1.0287279427E-06 -4.3253224114E-08
  1.5902884473E-06  3.4076606716E-07  1.0287279427E-06 -4.3253224114E-08 -5.2542711342E-06 -1.5390454235E-07

 Tensor_qq(ke,je,3,1), prototypical atom
  1.2490289335E-05 -1.0435172397E-07  1.5902884473E-06 -3.4076606716E-07  6.6970301061E-05 -2.0888009058E-23
  1.5902884473E-06 -3.4076606716E-07  3.6258324597E-05 -3.6290838858E-07 -1.1020126962E-06  3.2636070939E-07
  6.6970301061E-05 -2.0888009058E-23 -1.1020126962E-06  3.2636070939E-07 -9.5123952313E-06  1.7433362724E-07

 Tensor_qq(ke,je,1,2), prototypical atom
  1.0806302345E-05 -2.4833042647E-07  3.8645263350E-05  2.6110011322E-24  1.5902884473E-06  3.4076606716E-07
  3.8645263350E-05  1.6896893556E-24 -5.9545002053E-07  5.1729637046E-07  1.0287279427E-06 -4.3253224114E-08
  1.5902884473E-06  3.4076606716E-07  1.0287279427E-06 -4.3253224114E-08 -5.2542711342E-06 -1.5390454235E-07

 Tensor_qq(ke,je,2,2), prototypical atom
 -9.0741878036E-06 -6.0942867392E-08 -5.9545002053E-07 -5.1729637046E-07  3.6258324597E-05  3.6290838858E-07
 -5.9545002053E-07 -5.1729637046E-07  1.1518862520E-04  4.6380697189E-39  1.9869652118E-06  3.4035720516E-07
  3.6258324597E-05  3.6290838858E-07  1.9869652118E-06  3.4035720516E-07 -2.5884937225E-05 -6.6107762255E-08

 Tensor_qq(ke,je,3,2), prototypical atom
 -6.5305861494E-07 -1.1263036998E-08  1.0287279427E-06  4.3253224114E-08 -1.1020126962E-06 -3.2636070939E-07
  1.0287279427E-06  4.3253224114E-08  1.9869652118E-06 -3.4035720516E-07  5.8661589295E-05 -1.8096782790E-24
 -1.1020126962E-06 -3.2636070939E-07  5.8661589295E-05 -5.2220022644E-24 -6.4689821693E-06  3.5743631738E-07

 Tensor_qq(ke,je,1,3), prototypical atom
  1.2490289335E-05 -1.0435172397E-07  1.5902884473E-06 -3.4076606716E-07  6.6970301061E-05 -2.0888009058E-23
  1.5902884473E-06 -3.4076606716E-07  3.6258324597E-05 -3.6290838858E-07 -1.1020126962E-06  3.2636070939E-07
  6.6970301061E-05 -1.0444004529E-23 -1.1020126962E-06  3.2636070939E-07 -9.5123952313E-06  1.7433362724E-07

 Tensor_qq(ke,je,2,3), prototypical atom
 -6.5305861494E-07 -1.1263036998E-08  1.0287279427E-06  4.3253224114E-08 -1.1020126962E-06 -3.2636070939E-07
  1.0287279427E-06  4.3253224114E-08  1.9869652118E-06 -3.4035720516E-07  5.8661589295E-05  8.0132285321E-25
 -1.1020126962E-06 -3.2636070939E-07  5.8661589295E-05 -2.6110011322E-24 -6.4689821693E-06  3.5743631738E-07

 Tensor_qq(ke,je,3,3), prototypical atom
 -2.9534532537E-05  3.5598784026E-08 -5.2542711342E-06  1.5390454235E-07 -9.5123952313E-06 -1.7433362724E-07
 -5.2542711342E-06  1.5390454235E-07 -2.5884937225E-05  6.6107762255E-08 -6.4689821693E-06 -3.5743631738E-07
 -9.5123952313E-06 -1.7433362724E-07 -6.4689821693E-06 -3.5743631738E-07  6.0828239628E-05 -1.0444004529E-23

 Crystal Tensor_dd(ke,ks) (Mbarn)
  1.8434311879E-01  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21 -1.3834094775E-02  0.0000000000E+00
  0.0000000000E+00 -6.7762635780E-21  1.5132519301E-01  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21
 -1.3834094775E-02  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21  1.4534592168E-01  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  6.8971389391E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  9.9922314682E-05  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22 -7.2593502429E-05  0.0000000000E+00  0.0000000000E+00 -3.3087224502E-24
  9.9922314682E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -2.3627626029E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  0.0000000000E+00  3.0916210680E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.0916210680E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  8.2298235418E-06  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  8.2298235418E-06  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23

 Crystal Tensor_qq(ke,je,3,1)
  9.9922314682E-05  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  5.3576240848E-04  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22  2.9006659677E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  5.3576240848E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22 -7.6099161850E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  0.0000000000E+00  3.0916210680E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.0916210680E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22  8.2298235418E-06  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22  8.2298235418E-06  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23

 Crystal Tensor_qq(ke,je,2,2)
 -7.2593502429E-05  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22  2.9006659677E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  9.2150900163E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  2.9006659677E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -2.0707949780E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  3.3087224502E-24  8.2298235418E-06  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22
  8.2298235418E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.6929271436E-04  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22  4.6929271436E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22

 Crystal Tensor_qq(ke,je,1,3)
  9.9922314682E-05  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  5.3576240848E-04  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22  2.9006659677E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  5.3576240848E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22 -7.6099161850E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  3.3087224502E-24  8.2298235418E-06  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22
  8.2298235418E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.6929271436E-04  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22  4.6929271436E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22

 Crystal Tensor_qq(ke,je,3,3)
 -2.3627626029E-04  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23 -7.6099161850E-05  0.0000000000E+00
  0.0000000000E+00 -5.2939559203E-23 -2.0707949780E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22
 -7.6099161850E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.8662591702E-04  0.0000000000E+00

 Convertion factor =  78.01385 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -13.700  1.82062E-01  1.67116E-01  1.51736E-01  1.49994E-01  1.48439E-01  1.48388E-01  1.60775E-01
   dip-dip  1.81694E-01  1.66510E-01  1.51325E-01  1.49660E-01  1.47995E-01  1.47884E-01  1.60338E-01
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  3.67955E-04  6.06092E-04  4.10500E-04  3.34423E-04  4.44084E-04  5.03902E-04  4.37097E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -2.81984E-16 -1.51823E-05 -4.15625E-16 -1.46784E-06 -2.02990E-17  7.51741E-05 -4.99521E-17  2.94677E-04
   dip-dip -2.81541E-16  5.11016E-16 -4.15934E-16  6.11543E-16 -2.00289E-17  5.97500E-05 -5.08112E-17  3.12701E-04
   dip-qua  5.12892E-19  2.59242E-18  1.25849E-18  4.52140E-18 -7.07733E-19 -2.43034E-18  8.93995E-19 -2.86145E-18
   qua-qua -9.55959E-19 -1.51823E-05 -9.49058E-19 -1.46784E-06  4.37573E-19  1.54242E-05 -3.49339E-20 -1.80243E-05

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -13.60000 eV

 Vmoy = -20.17499 eV, Vmftabs(up) = -25.36575 eV, Vmftabs(dn) = -25.06113 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -2.217E-05   1.174E-02   1.811E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.634E-05   8.651E-03   1.335E-03
  1 -1    1  1    -1.295E-02   3.917E-01   3.735E-02
  1 -1    1  2     1.514E-03  -4.528E-02  -4.263E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -4.039E-03   1.229E-01   1.179E-02
  1  0    1  1    -1.043E-02   3.164E-01   3.025E-02
  1  0    1  2     1.328E-03  -3.972E-02  -3.740E-03
  1  0    2  1     1.499E-03  -4.396E-02  -4.046E-03
  1  0    2  2    -4.544E-03   1.377E-01   1.316E-02
  1  1    1  1    -8.464E-03   2.575E-01   2.471E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     1.315E-03  -3.857E-02  -3.550E-03
  1  1    2  2    -4.926E-03   1.489E-01   1.419E-02
  2 -2    1  1     7.270E-04  -3.609E-02  -5.815E-03
  2 -2    1  2    -4.192E-06   1.857E-04   2.730E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     6.780E-04  -3.371E-02  -5.437E-03
  2 -1    1  1     7.247E-04  -3.600E-02  -5.801E-03
  2 -1    1  2    -5.133E-06   2.274E-04   3.343E-05
  2 -1    2  1    -4.251E-06   1.873E-04   2.740E-05
  2 -1    2  2     6.800E-04  -3.380E-02  -5.450E-03
  2  0    1  1     7.225E-04  -3.590E-02  -5.786E-03
  2  0    1  2    -5.133E-06   2.274E-04   3.343E-05
  2  0    2  1    -5.206E-06   2.294E-04   3.356E-05
  2  0    2  2     6.820E-04  -3.389E-02  -5.463E-03
  2  1    1  1     7.203E-04  -3.580E-02  -5.772E-03
  2  1    1  2    -4.190E-06   1.857E-04   2.729E-05
  2  1    2  1    -5.205E-06   2.294E-04   3.355E-05
  2  1    2  2     6.840E-04  -3.398E-02  -5.476E-03
  2  2    1  1     7.181E-04  -3.570E-02  -5.757E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -4.249E-06   1.873E-04   2.739E-05
  2  2    2  2     6.860E-04  -3.406E-02  -5.489E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  1.9712051511E-02  0.0000000000E+00  1.5557687617E-03 -1.4042543716E-05 -1.0256268920E-03  6.2570624072E-06
  1.5557687617E-03  1.4042543716E-05  1.6548123630E-02  1.4842095362E-37  1.1480301791E-04 -2.0950381395E-05
 -1.0256268920E-03 -6.2570624072E-06  1.1480301791E-04  2.0950381395E-05  1.5250168262E-02  6.6842855144E-22

 Tensor_dq(1,ks,j2), prototypical atom
  6.4010314421E-05 -1.5562554142E-06  1.9916615596E-05  5.8196815480E-07  4.8754841997E-04  5.5137817231E-07
  1.9916615596E-05  5.8196815480E-07  3.6746200384E-04  1.1065355470E-06  3.8756080381E-04 -2.9505305360E-07
  4.8754841997E-04  5.5137817231E-07  3.8756080381E-04 -2.9505305360E-07 -7.9142761864E-05 -4.9361703876E-07

 Tensor_dq(2,ks,j2), prototypical atom
  4.0759849745E-04  6.9487794738E-07 -5.3760399802E-06  2.0036443857E-07  6.7481141265E-05 -1.9252339598E-06
 -5.3760399802E-06  2.0036443857E-07 -2.0464395574E-04 -8.6475821780E-07  1.7825391853E-04 -6.3829202635E-07
  6.7481141265E-05 -1.9252339598E-06  1.7825391853E-04 -6.3829202635E-07 -1.4111752341E-04  9.9746367008E-07

 Tensor_dq(3,ks,j2), prototypical atom
 -2.7829780491E-04  1.1711290815E-06  1.4621267968E-05 -2.5403394235E-08 -3.6486288504E-04  3.3566122873E-07
  1.4621267968E-05 -2.5403394235E-08 -5.0915807597E-04 -6.0387541852E-07  1.9212528279E-04  9.0104502260E-08
 -3.6486288504E-04  3.3566122873E-07  1.9212528279E-04  9.0104502260E-08  2.1264395956E-04 -5.2805749294E-07

 Tensor_qq(ke,je,1,1), prototypical atom
  8.4967678451E-05 -1.3055245145E-24  8.8985567248E-06  2.7909244081E-07  1.2016267490E-05  5.7688517889E-09
  8.8985567248E-06  2.7909244081E-07 -1.1568638885E-05 -7.7452266730E-08 -1.3213803268E-07  4.5383972035E-08
  1.2016267490E-05  5.7688517889E-09 -1.3213803268E-07  4.5383972035E-08 -2.9518027023E-05  4.1584316278E-08

 Tensor_qq(ke,je,2,1), prototypical atom
  8.8985567248E-06 -2.7909244081E-07  3.8905952289E-05 -2.6110490291E-24  6.5158757385E-08  2.5277166066E-07
  3.8905952289E-05 -2.3768487753E-24 -2.2226989252E-06  4.4785411423E-07  1.1345664176E-06 -3.4043356745E-08
  6.5158757385E-08  2.5277166066E-07  1.1345664176E-06 -3.4043356745E-08 -4.0290875334E-06 -1.1587016138E-07

 Tensor_qq(ke,je,3,1), prototypical atom
  1.2016267490E-05 -5.7688517889E-09  6.5158757385E-08 -2.5277166066E-07  6.2525274768E-05  0.0000000000E+00
  6.5158757385E-08 -2.5277166066E-07  2.6807548957E-05 -2.6162961396E-07  5.8666289812E-07  3.4516506763E-07
  6.2525274768E-05 -6.2012414440E-24  5.8666289812E-07  3.4516506763E-07 -8.4056713834E-06  1.4845068524E-07

 Tensor_qq(ke,je,1,2), prototypical atom
  8.8985567248E-06 -2.7909244081E-07  3.8905952289E-05 -2.6110490291E-24  6.5158757385E-08  2.5277166066E-07
  3.8905952289E-05 -2.3768487753E-24 -2.2226989252E-06  4.4785411423E-07  1.1345664176E-06 -3.4043356745E-08
  6.5158757385E-08  2.5277166066E-07  1.1345664176E-06 -3.4043356745E-08 -4.0290875334E-06 -1.1587016138E-07

 Tensor_qq(ke,je,2,2), prototypical atom
 -1.1568638885E-05  7.7452266730E-08 -2.2226989252E-06 -4.4785411423E-07  2.6807548957E-05  2.6162961396E-07
 -2.2226989252E-06 -4.4785411423E-07  9.9979029194E-05 -1.7538022840E-38  2.8746605196E-06  3.9123263393E-07
  2.6807548957E-05  2.6162961396E-07  2.8746605196E-06  3.9123263393E-07 -2.4645184189E-05 -9.0799864664E-08

 Tensor_qq(ke,je,3,2), prototypical atom
 -1.3213803268E-07 -4.5383972035E-08  1.1345664176E-06  3.4043356745E-08  5.8666289812E-07 -3.4516506763E-07
  1.1345664176E-06  3.4043356745E-08  2.8746605196E-06 -3.9123263393E-07  5.7590736610E-05  3.1033980576E-24
  5.8666289812E-07 -3.4516506763E-07  5.7590736610E-05  5.2220980581E-24 -5.9361151193E-06  4.0716558076E-07

 Tensor_qq(ke,je,1,3), prototypical atom
  1.2016267490E-05 -5.7688517889E-09  6.5158757385E-08 -2.5277166066E-07  6.2525274768E-05 -1.0444196116E-23
  6.5158757385E-08 -2.5277166066E-07  2.6807548957E-05 -2.6162961396E-07  5.8666289812E-07  3.4516506763E-07
  6.2525274768E-05 -1.3055245145E-23  5.8666289812E-07  3.4516506763E-07 -8.4056713834E-06  1.4845068524E-07

 Tensor_qq(ke,je,2,3), prototypical atom
 -1.3213803268E-07 -4.5383972035E-08  1.1345664176E-06  3.4043356745E-08  5.8666289812E-07 -3.4516506763E-07
  1.1345664176E-06  3.4043356745E-08  2.8746605196E-06 -3.9123263393E-07  5.7590736610E-05 -2.1187000005E-24
  5.8666289812E-07 -3.4516506763E-07  5.7590736610E-05  0.0000000000E+00 -5.9361151193E-06  4.0716558076E-07

 Tensor_qq(ke,je,3,3), prototypical atom
 -2.9518027023E-05 -4.1584316278E-08 -4.0290875334E-06  1.1587016138E-07 -8.4056713834E-06 -1.4845068524E-07
 -4.0290875334E-06  1.1587016138E-07 -2.4645184189E-05  9.0799864664E-08 -5.9361151193E-06 -4.0716558076E-07
 -8.4056713834E-06 -1.4845068524E-07 -5.9361151193E-06 -4.0716558076E-07  6.1066922563E-05  0.0000000000E+00

 Crystal Tensor_dd(ke,ks) (Mbarn)
  1.5769641209E-01  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21 -8.2050151360E-03  0.0000000000E+00
  0.0000000000E+00  3.3881317890E-21  1.3238498904E-01  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21
 -8.2050151360E-03  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21  1.2200134610E-01  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  6.7974142761E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  9.6130139916E-05  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22 -9.2549111083E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  9.6130139916E-05  0.0000000000E+00  0.0000000000E+00  1.3234889801E-23 -2.3614421619E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  1.0587911841E-22  3.1124761831E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.1124761831E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22  9.0765313411E-06  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22  9.0765313411E-06  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23

 Crystal Tensor_qq(ke,je,3,1)
  9.6130139916E-05  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  5.0020219814E-04  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22  2.1446039165E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  5.0020219814E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22 -6.7245371067E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  1.0587911841E-22  3.1124761831E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.1124761831E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22  9.0765313411E-06  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  9.0765313411E-06  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23

 Crystal Tensor_qq(ke,je,2,2)
 -9.2549111083E-05  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  2.1446039165E-04  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22  7.9983223355E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  2.1446039165E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22 -1.9716147351E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00 -1.3234889801E-23  9.0765313411E-06  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  9.0765313411E-06  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22  4.6072589288E-04  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22  4.6072589288E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22

 Crystal Tensor_qq(ke,je,1,3)
  9.6130139916E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  5.0020219814E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.1446039165E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22
  5.0020219814E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22 -6.7245371067E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00 -1.3234889801E-23  9.0765313411E-06  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  9.0765313411E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.6072589288E-04  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22  4.6072589288E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22

 Crystal Tensor_qq(ke,je,3,3)
 -2.3614421619E-04  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23 -6.7245371067E-05  0.0000000000E+00
  0.0000000000E+00  2.6469779602E-23 -1.9716147351E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22
 -6.7245371067E-05  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  4.8853538050E-04  0.0000000000E+00

 Convertion factor =  78.01528 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -13.600  1.51239E-01  1.42162E-01  1.32792E-01  1.30939E-01  1.29262E-01  1.24063E-01  1.37782E-01
   dip-dip  1.50875E-01  1.41630E-01  1.32385E-01  1.30604E-01  1.28823E-01  1.23592E-01  1.37361E-01
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  3.64754E-04  5.31989E-04  4.07219E-04  3.35429E-04  4.39049E-04  4.71295E-04  4.20699E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -2.15574E-16 -1.23457E-05 -3.04396E-16 -4.33203E-06 -1.96252E-18  7.88089E-05 -1.52235E-17  3.33007E-04
   dip-dip -2.16160E-16  4.28345E-16 -3.04362E-16  5.44581E-16 -1.42671E-18  6.49141E-05 -1.64202E-17  3.47410E-04
   dip-qua  1.42511E-18  2.48619E-18  8.53661E-19  3.51652E-18 -7.80643E-19 -2.63981E-18  1.19211E-18 -2.65396E-18
   qua-qua -8.38972E-19 -1.23457E-05 -8.88241E-19 -4.33203E-06  2.44834E-19  1.38948E-05  4.67062E-21 -1.44024E-05

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -13.50000 eV

 Vmoy = -20.17659 eV, Vmftabs(up) = -25.36597 eV, Vmftabs(dn) = -25.06136 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -2.174E-05   1.151E-02   1.776E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.610E-05   8.519E-03   1.314E-03
  1 -1    1  1    -1.259E-02   3.807E-01   3.630E-02
  1 -1    1  2     1.469E-03  -4.391E-02  -4.134E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -3.939E-03   1.198E-01   1.150E-02
  1  0    1  1    -1.015E-02   3.078E-01   2.943E-02
  1  0    1  2     1.289E-03  -3.856E-02  -3.630E-03
  1  0    2  1     1.454E-03  -4.264E-02  -3.924E-03
  1  0    2  2    -4.430E-03   1.342E-01   1.283E-02
  1  1    1  1    -8.242E-03   2.507E-01   2.406E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     1.277E-03  -3.744E-02  -3.445E-03
  1  1    2  2    -4.802E-03   1.451E-01   1.383E-02
  2 -2    1  1     6.995E-04  -3.473E-02  -5.595E-03
  2 -2    1  2    -4.038E-06   1.789E-04   2.630E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     6.522E-04  -3.243E-02  -5.230E-03
  2 -1    1  1     6.973E-04  -3.463E-02  -5.581E-03
  2 -1    1  2    -4.944E-06   2.191E-04   3.221E-05
  2 -1    2  1    -4.095E-06   1.805E-04   2.640E-05
  2 -1    2  2     6.541E-04  -3.251E-02  -5.242E-03
  2  0    1  1     6.952E-04  -3.454E-02  -5.567E-03
  2  0    1  2    -4.944E-06   2.191E-04   3.220E-05
  2  0    2  1    -5.014E-06   2.210E-04   3.233E-05
  2  0    2  2     6.561E-04  -3.260E-02  -5.255E-03
  2  1    1  1     6.930E-04  -3.444E-02  -5.553E-03
  2  1    1  2    -4.036E-06   1.788E-04   2.629E-05
  2  1    2  1    -5.014E-06   2.210E-04   3.233E-05
  2  1    2  2     6.580E-04  -3.268E-02  -5.267E-03
  2  2    1  1     6.909E-04  -3.435E-02  -5.539E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -4.093E-06   1.804E-04   2.639E-05
  2  2    2  2     6.599E-04  -3.277E-02  -5.280E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  1.7008707358E-02  0.0000000000E+00  1.3430454936E-03 -1.2180453057E-05 -6.7085109287E-04  6.5714448575E-06
  1.3430454936E-03  1.2180453057E-05  1.4496498325E-02 -1.4842367625E-37  9.4270549535E-05 -1.7383514650E-05
 -6.7085109287E-04 -6.5714448575E-06  9.4270549535E-05  1.7383514650E-05  1.3070046128E-02  6.6844081303E-22

 Tensor_dq(1,ks,j2), prototypical atom
  5.9118093212E-05 -1.4194241959E-06  1.0176887543E-05  3.7803359571E-07  4.2018842703E-04  5.0114687066E-07
  1.0176887543E-05  3.7803359571E-07  2.8604076959E-04  8.9428410720E-07  3.5014822762E-04 -1.9521068878E-07
  4.2018842703E-04  5.0114687066E-07  3.5014822762E-04 -1.9521068878E-07 -7.0368820312E-05 -3.7643815272E-07

 Tensor_dq(2,ks,j2), prototypical atom
  3.6706838862E-04  5.5819602194E-07 -1.2577859693E-05  1.0186461263E-07  6.0677414247E-05 -1.6442224340E-06
 -1.2577859693E-05  1.0186461263E-07 -1.8297201597E-04 -5.6689210027E-07  1.5257279924E-04 -6.4775239188E-07
  6.0677414247E-05 -1.6442224340E-06  1.5257279924E-04 -6.4775239188E-07 -1.2817694389E-04  6.9086671956E-07

 Tensor_dq(3,ks,j2), prototypical atom
 -2.2893528067E-04  1.0689636906E-06  1.9089916696E-05  2.6980384444E-08 -3.0616307953E-04  1.0686458168E-07
  1.9089916696E-05  2.6980384444E-08 -4.1768230741E-04 -6.2833177488E-07  1.6984433460E-04 -1.2658312082E-08
 -3.0616307953E-04  1.0686458168E-07  1.6984433460E-04 -1.2658312082E-08  1.8975902063E-04 -4.3831031559E-07

 Tensor_qq(ke,je,1,1), prototypical atom
  8.3460422973E-05 -2.6110969259E-24  7.0973671658E-06  3.2260753019E-07  1.0992464864E-05 -3.1720770366E-08
  7.0973671658E-06  3.2260753019E-07 -1.4351702098E-05 -1.2261493072E-07  2.0745468192E-07  5.6356404228E-08
  1.0992464864E-05 -3.1720770366E-08  2.0745468192E-07  5.6356404228E-08 -2.9446090739E-05  8.2761293793E-08

 Tensor_qq(ke,je,2,1), prototypical atom
  7.0973671658E-06 -3.2260753019E-07  3.9700781537E-05  2.6110969259E-24 -4.5580977189E-07  2.4588494513E-07
  3.9700781537E-05  2.9513661640E-24 -2.2898941164E-06  4.7067779193E-07  1.0884604348E-06 -3.9496913428E-08
 -4.5580977189E-07  2.4588494513E-07  1.0884604348E-06 -3.9496913428E-08 -3.0903970289E-06 -1.1285935484E-07

 Tensor_qq(ke,je,3,1), prototypical atom
  1.0992464864E-05  3.1720770366E-08 -4.5580977189E-07 -2.4588494513E-07  6.0945452963E-05  0.0000000000E+00
 -4.5580977189E-07 -2.4588494513E-07  2.2311816301E-05 -2.4909050053E-07  1.3682181413E-06  3.6734134566E-07
  6.0945452963E-05  5.2221938518E-24  1.3682181413E-06  3.6734134566E-07 -8.2927830049E-06  1.4640778576E-07

 Tensor_qq(ke,je,1,2), prototypical atom
  7.0973671658E-06 -3.2260753019E-07  3.9700781537E-05  2.6110969259E-24 -4.5580977189E-07  2.4588494513E-07
  3.9700781537E-05  2.9513661640E-24 -2.2898941164E-06  4.7067779193E-07  1.0884604348E-06 -3.9496913428E-08
 -4.5580977189E-07  2.4588494513E-07  1.0884604348E-06 -3.9496913428E-08 -3.0903970289E-06 -1.1285935484E-07

 Tensor_qq(ke,je,2,2), prototypical atom
 -1.4351702098E-05  1.2261493072E-07 -2.2898941164E-06 -4.7067779193E-07  2.2311816301E-05  2.4909050053E-07
 -2.2898941164E-06 -4.7067779193E-07  9.3733712382E-05  6.3775798387E-39  2.3778974891E-06  4.2708884635E-07
  2.2311816301E-05  2.4909050053E-07  2.3778974891E-06  4.2708884635E-07 -2.5147964358E-05 -1.1502719194E-07

 Tensor_qq(ke,je,3,2), prototypical atom
  2.0745468192E-07 -5.6356404228E-08  1.0884604348E-06  3.9496913428E-08  1.3682181413E-06 -3.6734134566E-07
  1.0884604348E-06  3.9496913428E-08  2.3778974891E-06 -4.2708884635E-07  5.7038497658E-05 -7.2370839267E-24
  1.3682181413E-06 -3.6734134566E-07  5.7038497658E-05 -5.2221938518E-24 -5.1085282546E-06  4.5353096879E-07

 Tensor_qq(ke,je,1,3), prototypical atom
  1.0992464864E-05  3.1720770366E-08 -4.5580977189E-07 -2.4588494513E-07  6.0945452963E-05 -1.0444387704E-23
 -4.5580977189E-07 -2.4588494513E-07  2.2311816301E-05 -2.4909050053E-07  1.3682181413E-06  3.6734134566E-07
  6.0945452963E-05  2.6110969259E-24  1.3682181413E-06  3.6734134566E-07 -8.2927830049E-06  1.4640778576E-07

 Tensor_qq(ke,je,2,3), prototypical atom
  2.0745468192E-07 -5.6356404228E-08  1.0884604348E-06  3.9496913428E-08  1.3682181413E-06 -3.6734134566E-07
  1.0884604348E-06  3.9496913428E-08  2.3778974891E-06 -4.2708884635E-07  5.7038497658E-05  5.9620685102E-25
  1.3682181413E-06 -3.6734134566E-07  5.7038497658E-05  0.0000000000E+00 -5.1085282546E-06  4.5353096879E-07

 Tensor_qq(ke,je,3,3), prototypical atom
 -2.9446090739E-05 -8.2761293793E-08 -3.0903970289E-06  1.1285935484E-07 -8.2927830049E-06 -1.4640778576E-07
 -3.0903970289E-06  1.1285935484E-07 -2.5147964358E-05  1.1502719194E-07 -5.1085282546E-06 -4.5353096879E-07
 -8.2927830049E-06 -1.4640778576E-07 -5.1085282546E-06 -4.5353096879E-07  6.2016838660E-05 -2.0888775407E-23

 Crystal Tensor_dd(ke,ks) (Mbarn)
  1.3606965887E-01  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21 -5.3668087430E-03  0.0000000000E+00
  0.0000000000E+00  3.3881317890E-21  1.1597198660E-01  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -5.3668087430E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.0456036902E-01  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  6.6768338378E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  8.7939718914E-05  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22 -1.1481361679E-04  0.0000000000E+00  0.0000000000E+00 -1.3234889801E-23
  8.7939718914E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -2.3556872591E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  1.0587911841E-22  3.1760625230E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22
  3.1760625230E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22  8.7076834785E-06  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  8.7076834785E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,1)
  8.7939718914E-05  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22  4.8756362371E-04  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22  1.7849453041E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  4.8756362371E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22 -6.6342264039E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  1.0587911841E-22  3.1760625230E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.1760625230E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22  8.7076834785E-06  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  8.7076834785E-06  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23

 Crystal Tensor_qq(ke,je,2,2)
 -1.1481361679E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  1.7849453041E-04  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22  7.4986969906E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  1.7849453041E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22 -2.0118371487E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  1.3234889801E-23  8.7076834785E-06  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22
  8.7076834785E-06  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  4.5630798126E-04  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22  4.5630798126E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22

 Crystal Tensor_qq(ke,je,1,3)
  8.7939718914E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.8756362371E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.7849453041E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  4.8756362371E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22 -6.6342264039E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  1.3234889801E-23  8.7076834785E-06  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22
  8.7076834785E-06  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  4.5630798126E-04  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22  4.5630798126E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22

 Crystal Tensor_qq(ke,je,3,3)
 -2.3556872591E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -6.6342264039E-05  0.0000000000E+00
  0.0000000000E+00 -2.6469779602E-23 -2.0118371487E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22
 -6.6342264039E-05  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  4.9613470928E-04  0.0000000000E+00

 Convertion factor =  78.01671 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -13.500  1.28564E-01  1.22592E-01  1.16379E-01  1.14545E-01  1.12869E-01  1.06117E-01  1.19284E-01
   dip-dip  1.28197E-01  1.22085E-01  1.15972E-01  1.14202E-01  1.12433E-01  1.05656E-01  1.18867E-01
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  3.66974E-04  5.07552E-04  4.06940E-04  3.42183E-04  4.35870E-04  4.60433E-04  4.16646E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -2.39631E-16 -1.22903E-05 -2.62674E-16 -5.75708E-06 -2.15679E-17  7.94590E-05  4.48544E-18  3.47592E-04
   dip-dip -2.38966E-16  3.44113E-16 -2.64456E-16  4.50355E-16 -2.06060E-17  6.50013E-05  7.39389E-18  3.62202E-04
   dip-qua -4.76525E-21  1.54770E-18  2.42037E-18  3.49417E-18 -1.19661E-18 -1.12572E-18 -2.91964E-18 -1.48891E-18
   qua-qua -6.59873E-19 -1.22903E-05 -6.38396E-19 -5.75708E-06  2.34663E-19  1.44577E-05  1.11968E-20 -1.46100E-05

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -13.40000 eV

 Vmoy = -20.17822 eV, Vmftabs(up) = -25.36620 eV, Vmftabs(dn) = -25.06159 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -2.133E-05   1.130E-02   1.743E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.586E-05   8.392E-03   1.295E-03
  1 -1    1  1    -1.224E-02   3.702E-01   3.530E-02
  1 -1    1  2     1.425E-03  -4.261E-02  -4.011E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -3.845E-03   1.170E-01   1.122E-02
  1  0    1  1    -9.882E-03   2.997E-01   2.866E-02
  1  0    1  2     1.252E-03  -3.745E-02  -3.525E-03
  1  0    2  1     1.411E-03  -4.137E-02  -3.807E-03
  1  0    2  2    -4.322E-03   1.310E-01   1.251E-02
  1  1    1  1    -8.032E-03   2.443E-01   2.345E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     1.240E-03  -3.636E-02  -3.346E-03
  1  1    2  2    -4.684E-03   1.416E-01   1.349E-02
  2 -2    1  1     6.740E-04  -3.346E-02  -5.391E-03
  2 -2    1  2    -3.895E-06   1.726E-04   2.538E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     6.283E-04  -3.124E-02  -5.038E-03
  2 -1    1  1     6.720E-04  -3.337E-02  -5.378E-03
  2 -1    1  2    -4.769E-06   2.114E-04   3.108E-05
  2 -1    2  1    -3.950E-06   1.741E-04   2.548E-05
  2 -1    2  2     6.302E-04  -3.132E-02  -5.050E-03
  2  0    1  1     6.699E-04  -3.328E-02  -5.364E-03
  2  0    1  2    -4.769E-06   2.114E-04   3.107E-05
  2  0    2  1    -4.837E-06   2.132E-04   3.120E-05
  2  0    2  2     6.320E-04  -3.140E-02  -5.062E-03
  2  1    1  1     6.678E-04  -3.319E-02  -5.351E-03
  2  1    1  2    -3.893E-06   1.725E-04   2.537E-05
  2  1    2  1    -4.837E-06   2.132E-04   3.120E-05
  2  1    2  2     6.339E-04  -3.148E-02  -5.074E-03
  2  2    1  1     6.658E-04  -3.310E-02  -5.338E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -3.949E-06   1.741E-04   2.547E-05
  2  2    2  2     6.358E-04  -3.157E-02  -5.086E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  1.4806866552E-02  0.0000000000E+00  1.1628470817E-03 -1.0451072169E-05 -4.7606489960E-04  6.4122662310E-06
  1.1628470817E-03  1.0451072169E-05  1.2763610879E-02  0.0000000000E+00  8.6812382054E-05 -1.4116200180E-05
 -4.7606489960E-04 -6.4122662310E-06  8.6812382054E-05  1.4116200180E-05  1.1367719822E-02 -6.6845307463E-22

 Tensor_dq(1,ks,j2), prototypical atom
  5.4132032325E-05 -1.2802151001E-06  3.9090117839E-06  2.8275597048E-07  3.6798928554E-04  4.1503999764E-07
  3.9090117839E-06  2.8275597048E-07  2.2935441137E-04  7.7218865530E-07  3.1512454825E-04 -1.0371421855E-07
  3.6798928554E-04  4.1503999764E-07  3.1512454825E-04 -1.0371421855E-07 -6.3724453984E-05 -3.0777473136E-07

 Tensor_dq(2,ks,j2), prototypical atom
  3.3062748744E-04  4.5298052049E-07 -1.8372827381E-05  4.2659499075E-08  5.3768177943E-05 -1.4428587584E-06
 -1.8372827381E-05  4.2659499075E-08 -1.6405236913E-04 -3.9062830174E-07  1.3087495698E-04 -6.2630498484E-07
  5.3768177943E-05 -1.4428587584E-06  1.3087495698E-04 -6.2630498484E-07 -1.1689175623E-04  4.9356090284E-07

 Tensor_dq(3,ks,j2), prototypical atom
 -1.8861978082E-04  9.2862786445E-07  2.0004806172E-05  4.9492795423E-08 -2.6350461544E-04  2.5182278419E-08
  2.0004806172E-05  4.9492795423E-08 -3.5371343410E-04 -6.1166444161E-07  1.5229977294E-04 -1.0872761008E-07
 -2.6350461544E-04  2.5182278419E-08  1.5229977294E-04 -1.0872761008E-07  1.7087746139E-04 -3.3722000195E-07

 Tensor_qq(ke,je,1,1), prototypical atom
  8.2464306797E-05  1.5666868937E-23  5.3105218031E-06  3.6883986425E-07  1.0139591035E-05 -5.5731336554E-08
  5.3105218031E-06  3.6883986425E-07 -1.6855536801E-05 -1.5339202107E-07  4.6527523117E-07  6.3889872921E-08
  1.0139591035E-05 -5.5731336554E-08  4.6527523117E-07  6.3889872921E-08 -2.9562722476E-05  1.1756385787E-07

 Tensor_qq(ke,je,2,1), prototypical atom
  5.3105218031E-06 -3.6883986425E-07  4.0841196250E-05  0.0000000000E+00 -6.7929658135E-07  2.5941158866E-07
  4.0841196250E-05  3.3900469664E-24 -1.9206536625E-06  5.1691678708E-07  1.0462018101E-06 -4.7118944518E-08
 -6.7929658135E-07  2.5941158866E-07  1.0462018101E-06 -4.7118944518E-08 -2.1847166478E-06 -1.2090413816E-07

 Tensor_qq(ke,je,3,1), prototypical atom
  1.0139591035E-05  5.5731336554E-08 -6.7929658135E-07 -2.5941158866E-07  6.0662247664E-05  1.0444579291E-23
 -6.7929658135E-07 -2.5941158866E-07  1.9585392135E-05 -2.6340791645E-07  1.9730551202E-06  3.9753550002E-07
  6.0662247664E-05  1.0444579291E-23  1.9730551202E-06  3.9753550002E-07 -8.5153751045E-06  1.5599200619E-07

 Tensor_qq(ke,je,1,2), prototypical atom
  5.3105218031E-06 -3.6883986425E-07  4.0841196250E-05  2.6111448228E-24 -6.7929658135E-07  2.5941158866E-07
  4.0841196250E-05  7.7890214360E-25 -1.9206536625E-06  5.1691678708E-07  1.0462018101E-06 -4.7118944518E-08
 -6.7929658135E-07  2.5941158866E-07  1.0462018101E-06 -4.7118944518E-08 -2.1847166478E-06 -1.2090413816E-07

 Tensor_qq(ke,je,2,2), prototypical atom
 -1.6855536801E-05  1.5339202107E-07 -1.9206536625E-06 -5.1691678708E-07  1.9585392135E-05  2.6340791645E-07
 -1.9206536625E-06 -5.1691678708E-07  9.0731524948E-05  1.1595812411E-39  1.5171919194E-06  4.6854285521E-07
  1.9585392135E-05  2.6340791645E-07  1.5171919194E-06  4.6854285521E-07 -2.6258543260E-05 -1.4058241735E-07

 Tensor_qq(ke,je,3,2), prototypical atom
  4.6527523117E-07 -6.3889872921E-08  1.0462018101E-06  4.7118944518E-08  1.9730551202E-06 -3.9753550002E-07
  1.0462018101E-06  4.7118944518E-08  1.5171919194E-06 -4.6854285521E-07  5.6882311282E-05 -9.2930171271E-25
  1.9730551202E-06 -3.9753550002E-07  5.6882311282E-05  0.0000000000E+00 -4.1909710723E-06  5.0563859738E-07

 Tensor_qq(ke,je,1,3), prototypical atom
  1.0139591035E-05  5.5731336554E-08 -6.7929658135E-07 -2.5941158866E-07  6.0662247664E-05  0.0000000000E+00
 -6.7929658135E-07 -2.5941158866E-07  1.9585392135E-05 -2.6340791645E-07  1.9730551202E-06  3.9753550002E-07
  6.0662247664E-05  5.2222896455E-24  1.9730551202E-06  3.9753550002E-07 -8.5153751045E-06  1.5599200619E-07

 Tensor_qq(ke,je,2,3), prototypical atom
  4.6527523117E-07 -6.3889872921E-08  1.0462018101E-06  4.7118944518E-08  1.9730551202E-06 -3.9753550002E-07
  1.0462018101E-06  4.7118944518E-08  1.5171919194E-06 -4.6854285521E-07  5.6882311282E-05 -9.2930171271E-25
  1.9730551202E-06 -3.9753550002E-07  5.6882311282E-05  0.0000000000E+00 -4.1909710723E-06  5.0563859738E-07

 Tensor_qq(ke,je,3,3), prototypical atom
 -2.9562722476E-05 -1.1756385787E-07 -2.1847166478E-06  1.2090413816E-07 -8.5153751045E-06 -1.5599200619E-07
 -2.1847166478E-06  1.2090413816E-07 -2.6258543260E-05  1.4058241735E-07 -4.1909710723E-06 -5.0563859738E-07
 -8.5153751045E-06 -1.5599200619E-07 -4.1909710723E-06 -5.0563859738E-07  6.3458179580E-05  2.0889158582E-23

 Crystal Tensor_dd(ke,ks) (Mbarn)
  1.1845493242E-01  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21 -3.8085191968E-03  0.0000000000E+00
  0.0000000000E+00  3.3881317890E-21  1.0210888704E-01  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
 -3.8085191968E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21  9.0941758572E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  6.5971445438E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22  8.1116728280E-05  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22 -1.3484429441E-04  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23
  8.1116728280E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -2.3650177981E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00 -1.0587911841E-22  3.2672957000E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.2672957000E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22  8.3696144809E-06  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  8.3696144809E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,1)
  8.1116728280E-05  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  4.8529798131E-04  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22  1.5668313708E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22
  4.8529798131E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22 -6.8123000836E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00 -1.0587911841E-22  3.2672957000E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.2672957000E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22  8.3696144809E-06  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  8.3696144809E-06  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23

 Crystal Tensor_qq(ke,je,2,2)
 -1.3484429441E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22  1.5668313708E-04  0.0000000000E+00
  0.0000000000E+00 -2.1175823681E-22  7.2585219958E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.5668313708E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -2.1006834608E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  0.0000000000E+00  8.3696144809E-06  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  8.3696144809E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.5505849026E-04  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22  4.5505849026E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22

 Crystal Tensor_qq(ke,je,1,3)
  8.1116728280E-05  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  4.8529798131E-04  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22  1.5668313708E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22
  4.8529798131E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22 -6.8123000836E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  0.0000000000E+00  8.3696144809E-06  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  8.3696144809E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.5505849026E-04  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22  4.5505849026E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22

 Crystal Tensor_qq(ke,je,3,3)
 -2.3650177981E-04  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23 -6.8123000836E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -2.1006834608E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -6.8123000836E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  5.0766543664E-04  0.0000000000E+00

 Convertion factor =  78.01814 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -13.400  1.11087E-01  1.06912E-01  1.02519E-01  1.00747E-01  9.91178E-02  9.22135E-02  1.04254E-01
   dip-dip  1.10715E-01  1.06412E-01  1.02109E-01  1.00395E-01  9.86815E-02  9.17544E-02  1.03835E-01
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  3.72096E-04  4.99966E-04  4.09692E-04  3.51755E-04  4.36312E-04  4.59082E-04  4.18394E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -1.96269E-16 -1.32683E-05 -2.50814E-16 -7.05017E-06  2.31675E-17  7.74160E-05 -2.73204E-17  3.35879E-04
   dip-dip -1.96444E-16  3.43105E-16 -2.52355E-16  3.83303E-16  2.37255E-17  6.14504E-05 -2.65737E-17  3.51889E-04
   dip-qua  9.02155E-19  1.43541E-18  2.23459E-18  2.63149E-18 -7.82135E-19 -1.01692E-18 -7.44991E-19 -1.08156E-18
   qua-qua -7.26910E-19 -1.32683E-05 -6.94365E-19 -7.05017E-06  2.24140E-19  1.59657E-05 -1.74771E-21 -1.60101E-05

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -13.30000 eV

 Vmoy = -20.17981 eV, Vmftabs(up) = -25.36642 eV, Vmftabs(dn) = -25.06181 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -2.094E-05   1.109E-02   1.711E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.562E-05   8.270E-03   1.276E-03
  1 -1    1  1    -1.192E-02   3.603E-01   3.436E-02
  1 -1    1  2     1.384E-03  -4.138E-02  -3.895E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -3.756E-03   1.143E-01   1.097E-02
  1  0    1  1    -9.629E-03   2.920E-01   2.792E-02
  1  0    1  2     1.217E-03  -3.640E-02  -3.426E-03
  1  0    2  1     1.370E-03  -4.018E-02  -3.697E-03
  1  0    2  2    -4.221E-03   1.279E-01   1.222E-02
  1  1    1  1    -7.834E-03   2.383E-01   2.287E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     1.205E-03  -3.534E-02  -3.252E-03
  1  1    2  2    -4.573E-03   1.382E-01   1.317E-02
  2 -2    1  1     6.504E-04  -3.229E-02  -5.203E-03
  2 -2    1  2    -3.762E-06   1.668E-04   2.452E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     6.062E-04  -3.014E-02  -4.861E-03
  2 -1    1  1     6.485E-04  -3.220E-02  -5.190E-03
  2 -1    1  2    -4.607E-06   2.042E-04   3.003E-05
  2 -1    2  1    -3.816E-06   1.682E-04   2.462E-05
  2 -1    2  2     6.080E-04  -3.022E-02  -4.872E-03
  2  0    1  1     6.465E-04  -3.212E-02  -5.177E-03
  2  0    1  2    -4.607E-06   2.042E-04   3.003E-05
  2  0    2  1    -4.674E-06   2.060E-04   3.015E-05
  2  0    2  2     6.098E-04  -3.030E-02  -4.884E-03
  2  1    1  1     6.445E-04  -3.203E-02  -5.164E-03
  2  1    1  2    -3.761E-06   1.667E-04   2.451E-05
  2  1    2  1    -4.673E-06   2.060E-04   3.015E-05
  2  1    2  2     6.116E-04  -3.038E-02  -4.896E-03
  2  2    1  1     6.425E-04  -3.194E-02  -5.151E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -3.815E-06   1.682E-04   2.461E-05
  2  2    2  2     6.134E-04  -3.045E-02  -4.907E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  1.3004624068E-02 -3.3423266811E-22  1.0113545462E-03 -8.9536624709E-06 -3.5908345579E-04  6.0630133653E-06
  1.0113545462E-03  8.9536624709E-06  1.1314582063E-02 -7.4214560744E-38  8.5332148626E-05 -1.1476033897E-05
 -3.5908345579E-04 -6.0630133653E-06  8.5332148626E-05  1.1476033897E-05  1.0007407410E-02  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
  4.9660600683E-05 -1.1617745437E-06 -7.0382540465E-07  2.2444414118E-07  3.2568932798E-04  3.3425019533E-07
 -7.0382540465E-07  2.2444414118E-07  1.8683798235E-04  6.9073545442E-07  2.8384114147E-04 -1.8840989126E-08
  3.2568932798E-04  3.3425019533E-07  2.8384114147E-04 -1.8840989126E-08 -5.7788847205E-05 -2.5617556697E-07

 Tensor_dq(2,ks,j2), prototypical atom
  2.9853592004E-04  3.6623842381E-07 -2.3093416399E-05  1.2338595278E-08  4.7288800933E-05 -1.2754943198E-06
 -2.3093416399E-05  1.2338595278E-08 -1.4751944147E-04 -2.5334421050E-07  1.1284655232E-04 -6.0090474115E-07
  4.7288800933E-05 -1.2754943198E-06  1.1284655232E-04 -6.0090474115E-07 -1.0721220862E-04  3.4825645402E-07

 Tensor_dq(3,ks,j2), prototypical atom
 -1.5630753366E-04  7.9915927492E-07  1.9557731440E-05  7.8907741340E-08 -2.3016990238E-04 -1.1990649590E-08
  1.9557731440E-05  7.8907741340E-08 -3.0515899033E-04 -5.8499542723E-07  1.3760699257E-04 -1.9630857094E-07
 -2.3016990238E-04 -1.1990649590E-08  1.3760699257E-04 -1.9630857094E-07  1.5455155592E-04 -2.4094294609E-07

 Tensor_qq(ke,je,1,1), prototypical atom
  8.2115402556E-05  1.5667156318E-23  3.4482319272E-06  4.1948978390E-07  9.4826754608E-06 -7.7890255693E-08
  3.4482319272E-06  4.1948978390E-07 -1.9197377833E-05 -1.8461221167E-07  6.9811295886E-07  7.1625960854E-08
  9.4826754608E-06 -7.7890255693E-08  6.9811295886E-07  7.1625960854E-08 -2.9898768938E-05  1.5386406195E-07

 Tensor_qq(ke,je,2,1), prototypical atom
  3.4482319272E-06 -4.1948978390E-07  4.2313295537E-05  5.2223854392E-24 -7.6644684045E-07  2.8343146495E-07
  4.2313295537E-05 -8.5286892012E-25 -1.3386496127E-06  5.7768624051E-07  1.0284917855E-06 -5.6189957917E-08
 -7.6644684045E-07  2.8343146495E-07  1.0284917855E-06 -5.6189957917E-08 -1.2403539782E-06 -1.3608334623E-07

 Tensor_qq(ke,je,3,1), prototypical atom
  9.4826754608E-06  7.7890255693E-08 -7.6644684045E-07 -2.8343146495E-07  6.1245379384E-05  0.0000000000E+00
 -7.6644684045E-07 -2.8343146495E-07  1.7768678146E-05 -2.9328918720E-07  2.5814175627E-06  4.3666752564E-07
  6.1245379384E-05 -1.0444770878E-23  2.5814175627E-06  4.3666752564E-07 -8.9296797177E-06  1.7347552451E-07

 Tensor_qq(ke,je,1,2), prototypical atom
  3.4482319272E-06 -4.1948978390E-07  4.2313295537E-05  5.2223854392E-24 -7.6644684045E-07  2.8343146495E-07
  4.2313295537E-05 -8.5286892012E-25 -1.3386496127E-06  5.7768624051E-07  1.0284917855E-06 -5.6189957917E-08
 -7.6644684045E-07  2.8343146495E-07  1.0284917855E-06 -5.6189957917E-08 -1.2403539782E-06 -1.3608334623E-07

 Tensor_qq(ke,je,2,2), prototypical atom
 -1.9197377833E-05  1.8461221167E-07 -1.3386496127E-06 -5.7768624051E-07  1.7768678146E-05  2.9328918720E-07
 -1.3386496127E-06 -5.7768624051E-07  8.9571971935E-05  4.0586087907E-39  4.6070937231E-07  5.1850675096E-07
  1.7768678146E-05  2.9328918720E-07  4.6070937231E-07  5.1850675096E-07 -2.7762518080E-05 -1.7086785689E-07

 Tensor_qq(ke,je,3,2), prototypical atom
  6.9811295886E-07 -7.1625960854E-08  1.0284917855E-06  5.6189957917E-08  2.5814175627E-06 -4.3666752564E-07
  1.0284917855E-06  5.6189957917E-08  4.6070937231E-07 -5.1850675096E-07  5.7119103277E-05 -3.9716571906E-24
  2.5814175627E-06 -4.3666752564E-07  5.7119103277E-05 -5.2223854392E-24 -3.1946602569E-06  5.6681709773E-07

 Tensor_qq(ke,je,1,3), prototypical atom
  9.4826754608E-06  7.7890255693E-08 -7.6644684045E-07 -2.8343146495E-07  6.1245379384E-05  1.0444770878E-23
 -7.6644684045E-07 -2.8343146495E-07  1.7768678146E-05 -2.9328918720E-07  2.5814175627E-06  4.3666752564E-07
  6.1245379384E-05  1.5667156318E-23  2.5814175627E-06  4.3666752564E-07 -8.9296797177E-06  1.7347552451E-07

 Tensor_qq(ke,je,2,3), prototypical atom
  6.9811295886E-07 -7.1625960854E-08  1.0284917855E-06  5.6189957917E-08  2.5814175627E-06 -4.3666752564E-07
  1.0284917855E-06  5.6189957917E-08  4.6070937231E-07 -5.1850675096E-07  5.7119103277E-05  6.4731136879E-24
  2.5814175627E-06 -4.3666752564E-07  5.7119103277E-05  5.2223854392E-24 -3.1946602569E-06  5.6681709773E-07

 Tensor_qq(ke,je,3,3), prototypical atom
 -2.9898768938E-05 -1.5386406195E-07 -1.2403539782E-06  1.3608334623E-07 -8.9296797177E-06 -1.7347552451E-07
 -1.2403539782E-06  1.3608334623E-07 -2.7762518080E-05  1.7086785689E-07 -3.1946602569E-06 -5.6681709773E-07
 -8.9296797177E-06 -1.7347552451E-07 -3.1946602569E-06 -5.6681709773E-07  6.5388377702E-05 -1.0444770878E-23

 Crystal Tensor_dd(ke,ks) (Mbarn)
  1.0403699255E-01  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21 -2.8726676463E-03  0.0000000000E+00
  0.0000000000E+00 -3.3881317890E-21  9.0516656506E-02  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
 -2.8726676463E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21  8.0059259279E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  6.5692322045E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  7.5861403687E-05  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22 -1.5357902266E-04  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23
  7.5861403687E-05  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23 -2.3919015150E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  0.0000000000E+00  3.3850636430E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.3850636430E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  8.2279342839E-06  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22  8.2279342839E-06  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23

 Crystal Tensor_qq(ke,je,3,1)
  7.5861403687E-05  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22  4.8996303507E-04  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22  1.4214942517E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  4.8996303507E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22 -7.1437437742E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  0.0000000000E+00  3.3850636430E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.3850636430E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  8.2279342839E-06  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22  8.2279342839E-06  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23

 Crystal Tensor_qq(ke,je,2,2)
 -1.5357902266E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.4214942517E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  7.1657577548E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22
  1.4214942517E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22 -2.2210014464E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  0.0000000000E+00  8.2279342839E-06  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22
  8.2279342839E-06  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22  4.5695282622E-04  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22  4.5695282622E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,3)
  7.5861403687E-05  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22  4.8996303507E-04  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22  1.4214942517E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  4.8996303507E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22 -7.1437437742E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  0.0000000000E+00  8.2279342839E-06  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22
  8.2279342839E-06  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22  4.5695282622E-04  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22  4.5695282622E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,3)
 -2.3919015150E-04  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23 -7.1437437742E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -2.2210014464E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -7.1437437742E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  5.2310702162E-04  0.0000000000E+00

 Convertion factor =  78.01958 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -13.300  9.72313E-02  9.41859E-02  9.09322E-02  8.92447E-02  8.76853E-02  8.11582E-02  9.19622E-02
   dip-dip  9.68514E-02  9.36841E-02  9.05167E-02  8.88807E-02  8.72448E-02  8.06941E-02  9.15376E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  3.79884E-04  5.01883E-04  4.15576E-04  3.63980E-04  4.40508E-04  4.64058E-04  4.24516E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -1.84223E-16 -1.49370E-05 -2.78811E-16 -8.53359E-06  1.15774E-17  7.50225E-05 -4.12127E-17  3.13519E-04
   dip-dip -1.84783E-16  3.00603E-16 -2.79458E-16  3.11326E-16  1.25671E-17  5.68022E-05 -4.19060E-17  3.31723E-04
   dip-qua  1.24100E-18  1.14144E-18  1.39671E-18  2.89372E-18 -1.17313E-18 -1.22159E-18  7.97295E-19 -8.94348E-19
   qua-qua -6.80585E-19 -1.49370E-05 -7.50074E-19 -8.53359E-06  1.83449E-19  1.82203E-05 -1.03993E-19 -1.82040E-05

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -13.20000 eV

 Vmoy = -20.18142 eV, Vmftabs(up) = -25.36665 eV, Vmftabs(dn) = -25.06203 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -2.057E-05   1.089E-02   1.680E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.540E-05   8.152E-03   1.258E-03
  1 -1    1  1    -1.161E-02   3.509E-01   3.346E-02
  1 -1    1  2     1.345E-03  -4.021E-02  -3.784E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -3.672E-03   1.117E-01   1.072E-02
  1  0    1  1    -9.388E-03   2.847E-01   2.722E-02
  1  0    1  2     1.184E-03  -3.540E-02  -3.332E-03
  1  0    2  1     1.332E-03  -3.904E-02  -3.592E-03
  1  0    2  2    -4.124E-03   1.250E-01   1.194E-02
  1  1    1  1    -7.645E-03   2.326E-01   2.232E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     1.172E-03  -3.437E-02  -3.162E-03
  1  1    2  2    -4.469E-03   1.351E-01   1.287E-02
  2 -2    1  1     6.285E-04  -3.120E-02  -5.027E-03
  2 -2    1  2    -3.639E-06   1.613E-04   2.373E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     5.856E-04  -2.911E-02  -4.696E-03
  2 -1    1  1     6.266E-04  -3.112E-02  -5.015E-03
  2 -1    1  2    -4.457E-06   1.976E-04   2.906E-05
  2 -1    2  1    -3.692E-06   1.628E-04   2.382E-05
  2 -1    2  2     5.873E-04  -2.919E-02  -4.707E-03
  2  0    1  1     6.247E-04  -3.103E-02  -5.002E-03
  2  0    1  2    -4.456E-06   1.976E-04   2.905E-05
  2  0    2  1    -4.521E-06   1.993E-04   2.917E-05
  2  0    2  2     5.891E-04  -2.927E-02  -4.718E-03
  2  1    1  1     6.227E-04  -3.095E-02  -4.990E-03
  2  1    1  2    -3.638E-06   1.613E-04   2.372E-05
  2  1    2  1    -4.521E-06   1.993E-04   2.917E-05
  2  1    2  2     5.908E-04  -2.934E-02  -4.729E-03
  2  2    1  1     6.208E-04  -3.086E-02  -4.977E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -3.691E-06   1.627E-04   2.381E-05
  2  2    2  2     5.926E-04  -2.942E-02  -4.741E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  1.1522739022E-02  0.0000000000E+00  8.8387820951E-04 -7.6960076854E-06 -2.8341137704E-04  5.6581952076E-06
  8.8387820951E-04  7.6960076854E-06  1.0106040511E-02  0.0000000000E+00  8.6069910541E-05 -9.3852738536E-06
 -2.8341137704E-04 -5.6581952076E-06  8.6069910541E-05  9.3852738536E-06  8.9047702085E-03  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
  4.5621067859E-05 -1.0647842066E-06 -4.3316198036E-06  1.8103496954E-07  2.9059364744E-04  2.6401063051E-07
 -4.3316198036E-06  1.8103496954E-07  1.5363364296E-04  6.2429338114E-07  2.5631343511E-04  6.6642760948E-08
  2.9059364744E-04  2.6401063051E-07  2.5631343511E-04  6.6642760948E-08 -5.2092236705E-05 -2.0601721384E-07

 Tensor_dq(2,ks,j2), prototypical atom
  2.7052801896E-04  2.9199765620E-07 -2.7018696855E-05  1.6604637688E-09  4.1389989669E-05 -1.1287224420E-06
 -2.7018696855E-05  1.6604637688E-09 -1.3307300856E-04 -1.3143944133E-07  9.7991579437E-05 -5.7924419440E-07
  4.1389989669E-05 -1.1287224420E-06  9.7991579437E-05 -5.7924419440E-07 -9.8953461322E-05  2.3161458516E-07

 Tensor_dq(3,ks,j2), prototypical atom
 -1.3045128155E-04  6.8198138780E-07  1.8523922419E-05  1.2238625032E-07 -2.0302382375E-04 -3.7304149148E-08
  1.8523922419E-05  1.2238625032E-07 -2.6665361226E-04 -5.5570946213E-07  1.2499308344E-04 -2.8365183904E-07
 -2.0302382375E-04 -3.7304149148E-08  1.2499308344E-04 -2.8365183904E-07  1.4019129443E-04 -1.5099245476E-07

 Tensor_qq(ke,je,1,1), prototypical atom
  8.2453335169E-05  0.0000000000E+00  1.4347551013E-06  4.7666018018E-07  9.0001798267E-06 -1.0243053709E-07
  1.4347551013E-06  4.7666018018E-07 -2.1492982215E-05 -2.2152928251E-07  9.3391410950E-07  8.0891348580E-08
  9.0001798267E-06 -1.0243053709E-07  9.3391410950E-07  8.0891348580E-08 -3.0473158234E-05  1.9565741071E-07

 Tensor_qq(ke,je,2,1), prototypical atom
  1.4347551013E-06 -4.7666018018E-07  4.4145536638E-05 -5.2224812329E-24 -7.7013481981E-07  3.1616760362E-07
  4.4145536638E-05 -4.2976662695E-24 -6.0020346882E-07  6.5292192956E-07  1.0394502699E-06 -6.7139898187E-08
 -7.7013481981E-07  3.1616760362E-07  1.0394502699E-06 -6.7139898187E-08 -2.1214530186E-07 -1.5814265061E-07

 Tensor_qq(ke,je,3,1), prototypical atom
  9.0001798267E-06  1.0243053709E-07 -7.7013481981E-07 -3.1616760362E-07  6.2571905523E-05  2.0889924932E-23
 -7.7013481981E-07 -3.1616760362E-07  1.6542105301E-05 -3.3696568413E-07  3.2695238092E-06  4.8612505756E-07
  6.2571905523E-05  1.0444962466E-23  3.2695238092E-06  4.8612505756E-07 -9.5084170301E-06  1.9846303687E-07

 Tensor_qq(ke,je,1,2), prototypical atom
  1.4347551013E-06 -4.7666018018E-07  4.4145536638E-05  0.0000000000E+00 -7.7013481981E-07  3.1616760362E-07
  4.4145536638E-05  9.2481496346E-25 -6.0020346882E-07  6.5292192956E-07  1.0394502699E-06 -6.7139898187E-08
 -7.7013481981E-07  3.1616760362E-07  1.0394502699E-06 -6.7139898187E-08 -2.1214530186E-07 -1.5814265061E-07

 Tensor_qq(ke,je,2,2), prototypical atom
 -2.1492982215E-05  2.2152928251E-07 -6.0020346882E-07 -6.5292192956E-07  1.6542105301E-05  3.3696568413E-07
 -6.0020346882E-07 -6.5292192956E-07  8.9781420182E-05  3.1889654008E-39 -7.7095823762E-07  5.7887422289E-07
  1.6542105301E-05  3.3696568413E-07 -7.7095823762E-07  5.7887422289E-07 -2.9634820879E-05 -2.0851027534E-07

 Tensor_qq(ke,je,3,2), prototypical atom
  9.3391410950E-07 -8.0891348580E-08  1.0394502699E-06  6.7139898187E-08  3.2695238092E-06 -4.8612505756E-07
  1.0394502699E-06  6.7139898187E-08 -7.7095823762E-07 -5.7887422289E-07  5.7764855800E-05 -1.3583553837E-23
  3.2695238092E-06 -4.8612505756E-07  5.7764855800E-05 -1.0444962466E-23 -2.0966000003E-06  6.4000528595E-07

 Tensor_qq(ke,je,1,3), prototypical atom
  9.0001798267E-06  1.0243053709E-07 -7.7013481981E-07 -3.1616760362E-07  6.2571905523E-05  4.1779849863E-23
 -7.7013481981E-07 -3.1616760362E-07  1.6542105301E-05 -3.3696568413E-07  3.2695238092E-06  4.8612505756E-07
  6.2571905523E-05  1.0444962466E-23  3.2695238092E-06  4.8612505756E-07 -9.5084170301E-06  1.9846303687E-07

 Tensor_qq(ke,je,2,3), prototypical atom
  9.3391410950E-07 -8.0891348580E-08  1.0394502699E-06  6.7139898187E-08  3.2695238092E-06 -4.8612505756E-07
  1.0394502699E-06  6.7139898187E-08 -7.7095823762E-07 -5.7887422289E-07  5.7764855800E-05  2.0838898621E-24
  3.2695238092E-06 -4.8612505756E-07  5.7764855800E-05  0.0000000000E+00 -2.0966000003E-06  6.4000528595E-07

 Tensor_qq(ke,je,3,3), prototypical atom
 -3.0473158234E-05 -1.9565741071E-07 -2.1214530186E-07  1.5814265061E-07 -9.5084170301E-06 -1.9846303687E-07
 -2.1214530186E-07  1.5814265061E-07 -2.9634820879E-05  2.0851027534E-07 -2.0966000003E-06 -6.4000528595E-07
 -9.5084170301E-06 -1.9846303687E-07 -2.0966000003E-06 -6.4000528595E-07  6.7864773279E-05  4.1779849863E-23

 Crystal Tensor_dd(ke,ks) (Mbarn)
  9.2181912175E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -2.2672910163E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  8.0848324086E-02  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21
 -2.2672910163E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21  7.1238161668E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  6.5962668135E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22  7.2001438614E-05  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22 -1.7194385772E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  7.2001438614E-05  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23 -2.4378526587E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00 -1.0587911841E-22  3.5316429310E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  3.5316429310E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22  8.3156021592E-06  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  8.3156021592E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,1)
  7.2001438614E-05  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  5.0057524419E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.3233684241E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  5.0057524419E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -7.6067336240E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00 -1.0587911841E-22  3.5316429310E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  3.5316429310E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22  8.3156021592E-06  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  8.3156021592E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,2)
 -1.7194385772E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22  1.3233684241E-04  0.0000000000E+00
  0.0000000000E+00  2.1175823681E-22  7.1825136145E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.3233684241E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22 -2.3707856703E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  2.6469779602E-23  8.3156021592E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  8.3156021592E-06  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22  4.6211884640E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  4.6211884640E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22

 Crystal Tensor_qq(ke,je,1,3)
  7.2001438614E-05  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22  5.0057524419E-04  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22  1.3233684241E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  5.0057524419E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -7.6067336240E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  0.0000000000E+00  8.3156021592E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  8.3156021592E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.6211884640E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  4.6211884640E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22

 Crystal Tensor_qq(ke,je,3,3)
 -2.4378526587E-04  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23 -7.6067336240E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -2.3707856703E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22
 -7.6067336240E-05  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22  5.4291818623E-04  0.0000000000E+00

 Convertion factor =  78.02101 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -13.200  8.60575E-02  8.37688E-02  8.12731E-02  7.96798E-02  7.82017E-02  7.22274E-02  8.18575E-02
   dip-dip  8.56670E-02  8.32576E-02  8.08483E-02  7.93007E-02  7.77531E-02  7.17530E-02  8.14228E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  3.90489E-04  5.11116E-04  4.24794E-04  3.79129E-04  4.48632E-04  4.74473E-04  4.34745E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -1.74318E-16 -1.72737E-05 -2.26093E-16 -1.03621E-05 -1.10541E-18  7.33542E-05 -1.90380E-17  2.87676E-04
   dip-dip -1.74051E-16  2.79031E-16 -2.27256E-16  2.98963E-16  5.91871E-19  5.20891E-05 -1.78250E-17  3.08866E-04
   dip-qua  5.21986E-19  9.79811E-19  1.97830E-18  2.48114E-18 -1.99601E-18 -9.30776E-19 -1.26372E-18 -3.22189E-19
   qua-qua -7.88984E-19 -1.72737E-05 -8.14791E-19 -1.03621E-05  2.98729E-19  2.12650E-05  5.07055E-20 -2.11897E-05

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -13.10000 eV

 Vmoy = -20.18304 eV, Vmftabs(up) = -25.36687 eV, Vmftabs(dn) = -25.06225 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -2.021E-05   1.070E-02   1.650E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.519E-05   8.038E-03   1.240E-03
  1 -1    1  1    -1.131E-02   3.420E-01   3.261E-02
  1 -1    1  2     1.308E-03  -3.909E-02  -3.679E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -3.593E-03   1.093E-01   1.049E-02
  1  0    1  1    -9.160E-03   2.777E-01   2.656E-02
  1  0    1  2     1.152E-03  -3.445E-02  -3.242E-03
  1  0    2  1     1.295E-03  -3.796E-02  -3.492E-03
  1  0    2  2    -4.033E-03   1.222E-01   1.168E-02
  1  1    1  1    -7.466E-03   2.271E-01   2.180E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     1.141E-03  -3.345E-02  -3.077E-03
  1  1    2  2    -4.369E-03   1.320E-01   1.258E-02
  2 -2    1  1     6.081E-04  -3.019E-02  -4.864E-03
  2 -2    1  2    -3.525E-06   1.563E-04   2.299E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     5.664E-04  -2.816E-02  -4.542E-03
  2 -1    1  1     6.062E-04  -3.011E-02  -4.852E-03
  2 -1    1  2    -4.317E-06   1.914E-04   2.815E-05
  2 -1    2  1    -3.576E-06   1.577E-04   2.308E-05
  2 -1    2  2     5.681E-04  -2.823E-02  -4.553E-03
  2  0    1  1     6.044E-04  -3.002E-02  -4.840E-03
  2  0    1  2    -4.316E-06   1.914E-04   2.815E-05
  2  0    2  1    -4.379E-06   1.931E-04   2.827E-05
  2  0    2  2     5.698E-04  -2.831E-02  -4.564E-03
  2  1    1  1     6.025E-04  -2.994E-02  -4.827E-03
  2  1    1  2    -3.524E-06   1.562E-04   2.298E-05
  2  1    2  1    -4.379E-06   1.931E-04   2.826E-05
  2  1    2  2     5.715E-04  -2.838E-02  -4.575E-03
  2  2    1  1     6.006E-04  -2.986E-02  -4.815E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -3.575E-06   1.576E-04   2.307E-05
  2  2    2  2     5.732E-04  -2.846E-02  -4.585E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  1.0297651440E-02 -6.6848985941E-22  7.7617625828E-04 -6.6533093285E-06 -2.3112557980E-04  5.2556184708E-06
  7.7617625828E-04  6.6533093285E-06  9.0965712310E-03 -7.4217283364E-38  8.7199566627E-05 -7.7212189766E-06
 -2.3112557980E-04 -5.2556184708E-06  8.7199566627E-05  7.7212189766E-06  8.0008587975E-03 -3.3424492970E-22

 Tensor_dq(1,ks,j2), prototypical atom
  4.1882899869E-05 -9.8553121522E-07 -7.2916786300E-06  1.4302818928E-07  2.6096412739E-04  2.0277408502E-07
 -7.2916786300E-06  1.4302818928E-07  1.2697432449E-04  5.5737502555E-07  2.3216573724E-04  1.5988504643E-07
  2.6096412739E-04  2.0277408502E-07  2.3216573724E-04  1.5988504643E-07 -4.6430196666E-05 -1.4781504515E-07

 Tensor_dq(2,ks,j2), prototypical atom
  2.4615101470E-04  2.2616645533E-07 -3.0363954978E-05  5.3840456749E-09  3.6080535947E-05 -9.9690893250E-07
 -3.0363954978E-05  5.3840456749E-09 -1.2042204666E-04 -1.5395679131E-08  8.5802003897E-05 -5.6385736416E-07
  3.6080535947E-05 -9.9690893250E-07  8.5802003897E-05 -5.6385736416E-07 -9.1914910524E-05  1.3172206072E-07

 Tensor_dq(3,ks,j2), prototypical atom
 -1.0970696382E-04  5.7065285216E-07  1.7238758362E-05  1.8364163865E-07 -1.8024958238E-04 -6.4571165819E-08
  1.7238758362E-05  1.8364163865E-07 -2.3518398988E-04 -5.2426628056E-07  1.1399767464E-04 -3.7904546365E-07
 -1.8024958238E-04 -6.4571165819E-08  1.1399767464E-04 -3.7904546365E-07  1.2739206093E-04 -6.4992016400E-08

 Tensor_qq(ke,je,1,1), prototypical atom
  8.3509670967E-05 -3.1335462160E-23 -8.0918976137E-07  5.4264799909E-07  8.6713886886E-06 -1.3195988484E-07
 -8.0918976137E-07  5.4264799909E-07 -2.3841039228E-05 -2.6773650159E-07  1.1903408535E-06  9.2635986994E-08
  8.6713886886E-06 -1.3195988484E-07  1.1903408535E-06  9.2635986994E-08 -3.1307847226E-05  2.4641354444E-07

 Tensor_qq(ke,je,2,1), prototypical atom
 -8.0918976137E-07 -5.4264799909E-07  4.6390434718E-05 -1.0445154053E-23 -7.0962981383E-07  3.5823795891E-07
  4.6390434718E-05 -1.7108213669E-23  2.9096230065E-07  7.4531386789E-07  1.0812914534E-06 -8.0713688947E-08
 -7.0962981383E-07  3.5823795891E-07  1.0812914534E-06 -8.0713688947E-08  9.4379548339E-07 -1.8824789456E-07

 Tensor_qq(ke,je,3,1), prototypical atom
  8.6713886886E-06  1.3195988484E-07 -7.0962981383E-07 -3.5823795891E-07  6.4631605366E-05 -2.0890308107E-23
 -7.0962981383E-07 -3.5823795891E-07  1.5762361746E-05 -3.9601774089E-07  4.0865453018E-06  5.4815140567E-07
  6.4631605366E-05  0.0000000000E+00  4.0865453018E-06  5.4815140567E-07 -1.0262914904E-05  2.3206394036E-07

 Tensor_qq(ke,je,1,2), prototypical atom
 -8.0918976137E-07 -5.4264799909E-07  4.6390434718E-05 -5.2225770266E-24 -7.0962981383E-07  3.5823795891E-07
  4.6390434718E-05 -6.6630596154E-24  2.9096230065E-07  7.4531386789E-07  1.0812914534E-06 -8.0713688947E-08
 -7.0962981383E-07  3.5823795891E-07  1.0812914534E-06 -8.0713688947E-08  9.4379548339E-07 -1.8824789456E-07

 Tensor_qq(ke,je,2,2), prototypical atom
 -2.3841039228E-05  2.6773650159E-07  2.9096230065E-07 -7.4531386789E-07  1.5762361746E-05  3.9601774089E-07
  2.9096230065E-07 -7.4531386789E-07  9.1191813941E-05 -3.3484750893E-38 -2.2034347504E-06  6.5207683570E-07
  1.5762361746E-05  3.9601774089E-07 -2.2034347504E-06  6.5207683570E-07 -3.1913850169E-05 -2.5638929887E-07

 Tensor_qq(ke,je,3,2), prototypical atom
  1.1903408535E-06 -9.2635986994E-08  1.0812914534E-06  8.0713688947E-08  4.0865453018E-06 -5.4815140567E-07
  1.0812914534E-06  8.0713688947E-08 -2.2034347504E-06 -6.5207683570E-07  5.8846658878E-05 -7.6653192177E-25
  4.0865453018E-06 -5.4815140567E-07  5.8846658878E-05 -1.0445154053E-23 -8.5936389560E-07  7.2877567284E-07

 Tensor_qq(ke,je,1,3), prototypical atom
  8.6713886886E-06  1.3195988484E-07 -7.0962981383E-07 -3.5823795891E-07  6.4631605366E-05  0.0000000000E+00
 -7.0962981383E-07 -3.5823795891E-07  1.5762361746E-05 -3.9601774089E-07  4.0865453018E-06  5.4815140567E-07
  6.4631605366E-05  2.0890308107E-23  4.0865453018E-06  5.4815140567E-07 -1.0262914904E-05  2.3206394036E-07

 Tensor_qq(ke,je,2,3), prototypical atom
  1.1903408535E-06 -9.2635986994E-08  1.0812914534E-06  8.0713688947E-08  4.0865453018E-06 -5.4815140567E-07
  1.0812914534E-06  8.0713688947E-08 -2.2034347504E-06 -6.5207683570E-07  5.8846658878E-05 -5.9891089484E-24
  4.0865453018E-06 -5.4815140567E-07  5.8846658878E-05 -2.0890308107E-23 -8.5936389560E-07  7.2877567284E-07

 Tensor_qq(ke,je,3,3), prototypical atom
 -3.1307847226E-05 -2.4641354444E-07  9.4379548339E-07  1.8824789456E-07 -1.0262914904E-05 -2.3206394036E-07
  9.4379548339E-07  1.8824789456E-07 -3.1913850169E-05  2.5638929887E-07 -8.5936389560E-07 -7.2877567284E-07
 -1.0262914904E-05 -2.3206394036E-07 -8.5936389560E-07 -7.2877567284E-07  7.0978113120E-05  0.0000000000E+00

 Crystal Tensor_dd(ke,ks) (Mbarn)
  8.2381211518E-02  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21 -1.8490046384E-03  0.0000000000E+00
  0.0000000000E+00 -1.6940658945E-21  7.2772569848E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -1.8490046384E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  6.4006870380E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  6.6807736774E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22  6.9371109508E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -1.9072831382E-04  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23
  6.9371109508E-05  0.0000000000E+00  0.0000000000E+00 -2.6469779602E-23 -2.5046277781E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  0.0000000000E+00  3.7112347775E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22
  3.7112347775E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22  8.6503316268E-06  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22  8.6503316268E-06  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23

 Crystal Tensor_qq(ke,je,3,1)
  6.9371109508E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  5.1705284293E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.2609889397E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22
  5.1705284293E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22 -8.2103319230E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00 -2.1175823681E-22  3.7112347775E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.7112347775E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22  8.6503316268E-06  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22  8.6503316268E-06  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23

 Crystal Tensor_qq(ke,je,2,2)
 -1.9072831382E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22  1.2609889397E-04  0.0000000000E+00
  0.0000000000E+00  2.1175823681E-22  7.2953451153E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22
  1.2609889397E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22 -2.5531080135E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00 -2.6469779602E-23  8.6503316268E-06  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22
  8.6503316268E-06  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22  4.7077327102E-04  0.0000000000E+00
  0.0000000000E+00 -2.1175823681E-22  4.7077327102E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22

 Crystal Tensor_qq(ke,je,1,3)
  6.9371109508E-05  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  5.1705284293E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.2609889397E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22
  5.1705284293E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -8.2103319230E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00 -2.6469779602E-23  8.6503316268E-06  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22
  8.6503316268E-06  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22  4.7077327102E-04  0.0000000000E+00
  0.0000000000E+00 -2.1175823681E-22  4.7077327102E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22

 Crystal Tensor_qq(ke,je,3,3)
 -2.5046277781E-04  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23 -8.2103319230E-05  0.0000000000E+00
  0.0000000000E+00 -5.2939559203E-23 -2.5531080135E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -8.2103319230E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  5.6782490496E-04  0.0000000000E+00

 Convertion factor =  78.02244 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -13.100  7.69315E-02  7.51771E-02  7.32102E-02  7.17143E-02  7.03218E-02  6.49258E-02  7.35028E-02
   dip-dip  7.65273E-02  7.46499E-02  7.27726E-02  7.13167E-02  6.98608E-02  6.44355E-02  7.30536E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  4.04230E-04  5.27135E-04  4.37667E-04  3.97658E-04  4.60991E-04  4.90269E-04  4.49252E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -1.20339E-16 -2.03879E-05 -1.64898E-16 -1.26782E-05 -1.10224E-17  7.29570E-05 -1.49140E-17  2.61241E-04
   dip-dip -1.20734E-16  2.36575E-16 -1.64809E-16  2.86473E-16 -9.44740E-18  4.76907E-05 -1.43986E-17  2.86359E-04
   dip-qua  1.10440E-18  1.18836E-18  6.05600E-19  2.37384E-18 -1.75464E-18 -1.05129E-18 -5.62012E-19 -4.20411E-19
   qua-qua -7.09363E-19 -2.03879E-05 -6.94602E-19 -1.26782E-05  1.79589E-19  2.52664E-05  4.65953E-20 -2.51185E-05

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -13.00000 eV

 Vmoy = -20.18464 eV, Vmftabs(up) = -25.36709 eV, Vmftabs(dn) = -25.06247 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -1.986E-05   1.051E-02   1.622E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.498E-05   7.928E-03   1.223E-03
  1 -1    1  1    -1.103E-02   3.335E-01   3.180E-02
  1 -1    1  2     1.272E-03  -3.803E-02  -3.578E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -3.517E-03   1.070E-01   1.027E-02
  1  0    1  1    -8.943E-03   2.712E-01   2.593E-02
  1  0    1  2     1.122E-03  -3.354E-02  -3.156E-03
  1  0    2  1     1.260E-03  -3.693E-02  -3.397E-03
  1  0    2  2    -3.946E-03   1.196E-01   1.142E-02
  1  1    1  1    -7.296E-03   2.219E-01   2.130E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     1.111E-03  -3.257E-02  -2.996E-03
  1  1    2  2    -4.275E-03   1.292E-01   1.231E-02
  2 -2    1  1     5.890E-04  -2.924E-02  -4.711E-03
  2 -2    1  2    -3.418E-06   1.516E-04   2.230E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     5.485E-04  -2.727E-02  -4.398E-03
  2 -1    1  1     5.872E-04  -2.916E-02  -4.700E-03
  2 -1    1  2    -4.186E-06   1.856E-04   2.730E-05
  2 -1    2  1    -3.468E-06   1.529E-04   2.239E-05
  2 -1    2  2     5.502E-04  -2.734E-02  -4.409E-03
  2  0    1  1     5.854E-04  -2.908E-02  -4.688E-03
  2  0    1  2    -4.185E-06   1.856E-04   2.730E-05
  2  0    2  1    -4.247E-06   1.873E-04   2.742E-05
  2  0    2  2     5.518E-04  -2.741E-02  -4.419E-03
  2  1    1  1     5.836E-04  -2.900E-02  -4.676E-03
  2  1    1  2    -3.417E-06   1.515E-04   2.229E-05
  2  1    2  1    -4.246E-06   1.873E-04   2.741E-05
  2  1    2  2     5.534E-04  -2.749E-02  -4.430E-03
  2  2    1  1     5.818E-04  -2.892E-02  -4.664E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -3.467E-06   1.529E-04   2.238E-05
  2  2    2  2     5.551E-04  -2.756E-02  -4.441E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  9.2785269905E-03 -6.6850212100E-22  6.8466500705E-04 -5.7906500891E-06 -1.9279023636E-04  4.8755702998E-06
  6.8466500705E-04  5.7906500891E-06  8.2501547054E-03 -1.1132796701E-37  8.7932460374E-05 -6.3760921263E-06
 -1.9279023636E-04 -4.8755702998E-06  8.7932460374E-05  6.3760921263E-06  7.2523854635E-03 -3.3425106050E-22

 Tensor_dq(1,ks,j2), prototypical atom
  3.8332369457E-05 -9.1931560222E-07 -9.7602396565E-06  1.0490761974E-07  2.3551441905E-04  1.4771945586E-07
 -9.7602396565E-06  1.0490761974E-07  1.0506823362E-04  4.7797482834E-07  2.1091586452E-04  2.6835433878E-07
  2.3551441905E-04  1.4771945586E-07  2.1091586452E-04  2.6835433878E-07 -4.0670150345E-05 -7.3847980640E-08

 Tensor_dq(2,ks,j2), prototypical atom
  2.2490718174E-04  1.6541018923E-07 -3.3288131562E-05  2.1040594822E-08  3.1309223267E-05 -8.7624578139E-07
 -3.3288131562E-05  2.1040594822E-08 -1.0929488839E-04  1.0042613776E-07  7.5821415494E-05 -5.5567018172E-07
  3.1309223267E-05 -8.7624578139E-07  7.5821415494E-05 -5.5567018172E-07 -8.5907347102E-05  4.1154496262E-08

 Tensor_dq(3,ks,j2), prototypical atom
 -9.2996976479E-05  4.5677838351E-07  1.5865639486E-05  2.6733562392E-07 -1.6062917707E-04 -1.0188905433E-07
  1.5865639486E-05  2.6733562392E-07 -2.0878351918E-04 -4.8817028287E-07  1.0428233136E-04 -4.9079496058E-07
 -1.6062917707E-04 -1.0188905433E-07  1.0428233136E-04 -4.9079496058E-07  1.1578791297E-04  2.0675605394E-08

 Tensor_qq(ke,je,1,1), prototypical atom
  8.5336820529E-05  1.0445345641E-23 -3.3774426120E-06  6.2021932549E-07  8.4815928248E-06 -1.6903428383E-07
 -3.3774426120E-06  6.2021932549E-07 -2.6335576645E-05 -3.2714229993E-07  1.4817808991E-06  1.0792425742E-07
  8.4815928248E-06 -1.6903428383E-07  1.4817808991E-06  1.0792425742E-07 -3.2434189780E-05  3.1021474606E-07

 Tensor_qq(ke,je,2,1), prototypical atom
 -3.3774426120E-06 -6.2021932549E-07  4.9126437311E-05 -1.0445345641E-23 -5.8954540511E-07  4.1158362876E-07
  4.9126437311E-05 -7.6103124501E-24  1.3569610628E-06  8.5945988042E-07  1.1576124164E-06 -9.7948111297E-08
 -5.8954540511E-07  4.1158362876E-07  1.1576124164E-06 -9.7948111297E-08  2.2787941228E-06 -2.2867018429E-07

 Tensor_qq(ke,je,3,1), prototypical atom
  8.4815928248E-06  1.6903428383E-07 -5.8954540511E-07 -4.1158362876E-07  6.7480055674E-05  0.0000000000E+00
 -5.8954540511E-07 -4.1158362876E-07  1.5363866285E-05 -4.7425729519E-07  5.0770319174E-06  6.2611697062E-07
  6.7480055674E-05 -1.0445345641E-23  5.0770319174E-06  6.2611697062E-07 -1.1225782641E-05  2.7654669596E-07

 Tensor_qq(ke,je,1,2), prototypical atom
 -3.3774426120E-06 -6.2021932549E-07  4.9126437311E-05  0.0000000000E+00 -5.8954540511E-07  4.1158362876E-07
  4.9126437311E-05  2.8350331906E-24  1.3569610628E-06  8.5945988042E-07  1.1576124164E-06 -9.7948111297E-08
 -5.8954540511E-07  4.1158362876E-07  1.1576124164E-06 -9.7948111297E-08  2.2787941228E-06 -2.2867018429E-07

 Tensor_qq(ke,je,2,2), prototypical atom
 -2.6335576645E-05  3.2714229993E-07  1.3569610628E-06 -8.5945988042E-07  1.5363866285E-05  4.7425729519E-07
  1.3569610628E-06 -8.5945988042E-07  9.3784669098E-05 -1.4495829038E-39 -3.8879588113E-06  7.4152720562E-07
  1.5363866285E-05  4.7425729519E-07 -3.8879588113E-06  7.4152720562E-07 -3.4677250763E-05 -3.1828688808E-07

 Tensor_qq(ke,je,3,2), prototypical atom
  1.4817808991E-06 -1.0792425742E-07  1.1576124164E-06  9.7948111297E-08  5.0770319174E-06 -6.2611697062E-07
  1.1576124164E-06  9.7948111297E-08 -3.8879588113E-06 -7.4152720562E-07  6.0407607707E-05  1.4002608202E-23
  5.0770319174E-06 -6.2611697062E-07  6.0407607707E-05  0.0000000000E+00  5.6760389415E-07  8.3791767130E-07

 Tensor_qq(ke,je,1,3), prototypical atom
  8.4815928248E-06  1.6903428383E-07 -5.8954540511E-07 -4.1158362876E-07  6.7480055674E-05 -2.0890691281E-23
 -5.8954540511E-07 -4.1158362876E-07  1.5363866285E-05 -4.7425729519E-07  5.0770319174E-06  6.2611697062E-07
  6.7480055674E-05 -5.2226728203E-23  5.0770319174E-06  6.2611697062E-07 -1.1225782641E-05  2.7654669596E-07

 Tensor_qq(ke,je,2,3), prototypical atom
  1.4817808991E-06 -1.0792425742E-07  1.1576124164E-06  9.7948111297E-08  5.0770319174E-06 -6.2611697062E-07
  1.1576124164E-06  9.7948111297E-08 -3.8879588113E-06 -7.4152720562E-07  6.0407607707E-05  3.5572625615E-24
  5.0770319174E-06 -6.2611697062E-07  6.0407607707E-05  0.0000000000E+00  5.6760389415E-07  8.3791767130E-07

 Tensor_qq(ke,je,3,3), prototypical atom
 -3.2434189780E-05 -3.1021474606E-07  2.2787941228E-06  2.2867018429E-07 -1.1225782641E-05 -2.7654669596E-07
  2.2787941228E-06  2.2867018429E-07 -3.4677250763E-05  3.1828688808E-07  5.6760389415E-07 -8.3791767130E-07
 -1.1225782641E-05 -2.7654669596E-07  5.6760389415E-07 -8.3791767130E-07  7.4856605510E-05  0.0000000000E+00

 Crystal Tensor_dd(ke,ks) (Mbarn)
  7.4228215924E-02  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21 -1.5423218909E-03  0.0000000000E+00
  0.0000000000E+00  1.6940658945E-21  6.6001237643E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -1.5423218909E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  5.8019083708E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  6.8269456424E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  6.7852742598E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -2.1068461316E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  6.7852742598E-05  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23 -2.5947351824E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  0.0000000000E+00  3.9301149849E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  3.9301149849E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22  9.2608993311E-06  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22  9.2608993311E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,1)
  6.7852742598E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  5.3984044539E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.2291093028E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22
  5.3984044539E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22 -8.9806261128E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  2.1175823681E-22  3.9301149849E-04  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22
  3.9301149849E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22  9.2608993311E-06  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22  9.2608993311E-06  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23

 Crystal Tensor_qq(ke,je,2,2)
 -2.1068461316E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22  1.2291093028E-04  0.0000000000E+00
  0.0000000000E+00  2.1175823681E-22  7.5027735278E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22
  1.2291093028E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22 -2.7741800610E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  2.6469779602E-23  9.2608993311E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  9.2608993311E-06  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22  4.8326086166E-04  0.0000000000E+00
  0.0000000000E+00 -2.1175823681E-22  4.8326086166E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22

 Crystal Tensor_qq(ke,je,1,3)
  6.7852742598E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  5.3984044539E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.2291093028E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22
  5.3984044539E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22 -8.9806261128E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  0.0000000000E+00  9.2608993311E-06  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  9.2608993311E-06  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22  4.8326086166E-04  0.0000000000E+00
  0.0000000000E+00 -2.1175823681E-22  4.8326086166E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22

 Crystal Tensor_qq(ke,je,3,3)
 -2.5947351824E-04  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23 -8.9806261128E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -2.7741800610E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22
 -8.9806261128E-05  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22  5.9885284408E-04  0.0000000000E+00

 Convertion factor =  78.02387 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -13.000  6.93981E-02  6.80391E-02  6.64559E-02  6.50562E-02  6.37489E-02  5.88945E-02  6.65514E-02
   dip-dip  6.89765E-02  6.74889E-02  6.60012E-02  6.46360E-02  6.32708E-02  5.83826E-02  6.60828E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  4.21587E-04  5.50240E-04  4.54685E-04  4.20210E-04  4.78096E-04  5.11868E-04  4.68516E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -1.64105E-16 -2.44918E-05 -1.75449E-16 -1.56620E-05 -1.02594E-17  7.41999E-05 -6.99727E-19  2.34976E-04
   dip-dip -1.63657E-16  2.15626E-16 -1.76378E-16  2.67419E-16 -1.00582E-17  4.36940E-05  6.77145E-19  2.65240E-04
   dip-qua  3.93668E-19  9.88230E-19  1.65154E-18  2.05909E-18 -5.53319E-19 -8.93940E-19 -1.41882E-18 -6.25129E-19
   qua-qua -8.41544E-19 -2.44918E-05 -7.22085E-19 -1.56620E-05  3.52158E-19  3.05059E-05  4.19514E-20 -3.02633E-05

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -12.90000 eV

 Vmoy = -20.18626 eV, Vmftabs(up) = -25.36731 eV, Vmftabs(dn) = -25.06269 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -1.952E-05   1.034E-02   1.595E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.478E-05   7.822E-03   1.207E-03
  1 -1    1  1    -1.076E-02   3.254E-01   3.102E-02
  1 -1    1  2     1.238E-03  -3.701E-02  -3.482E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -3.445E-03   1.048E-01   1.006E-02
  1  0    1  1    -8.734E-03   2.648E-01   2.532E-02
  1  0    1  2     1.093E-03  -3.267E-02  -3.074E-03
  1  0    2  1     1.226E-03  -3.593E-02  -3.305E-03
  1  0    2  2    -3.864E-03   1.171E-01   1.119E-02
  1  1    1  1    -7.134E-03   2.170E-01   2.082E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     1.083E-03  -3.173E-02  -2.918E-03
  1  1    2  2    -4.185E-03   1.265E-01   1.205E-02
  2 -2    1  1     5.712E-04  -2.836E-02  -4.569E-03
  2 -2    1  2    -3.318E-06   1.472E-04   2.165E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     5.318E-04  -2.644E-02  -4.264E-03
  2 -1    1  1     5.695E-04  -2.828E-02  -4.557E-03
  2 -1    1  2    -4.063E-06   1.802E-04   2.651E-05
  2 -1    2  1    -3.367E-06   1.485E-04   2.174E-05
  2 -1    2  2     5.334E-04  -2.651E-02  -4.274E-03
  2  0    1  1     5.677E-04  -2.820E-02  -4.546E-03
  2  0    1  2    -4.063E-06   1.802E-04   2.651E-05
  2  0    2  1    -4.123E-06   1.819E-04   2.662E-05
  2  0    2  2     5.350E-04  -2.658E-02  -4.285E-03
  2  1    1  1     5.659E-04  -2.812E-02  -4.534E-03
  2  1    1  2    -3.317E-06   1.471E-04   2.164E-05
  2  1    2  1    -4.122E-06   1.818E-04   2.662E-05
  2  1    2  2     5.366E-04  -2.665E-02  -4.295E-03
  2  2    1  1     5.642E-04  -2.805E-02  -4.523E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -3.365E-06   1.484E-04   2.173E-05
  2  2    2  2     5.381E-04  -2.672E-02  -4.305E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  8.4251734218E-03  0.0000000000E+00  6.0639540328E-04 -5.0723177484E-06 -1.6320769922E-04  4.5187846399E-06
  6.0639540328E-04  5.0723177484E-06  7.5369217203E-03  0.0000000000E+00  8.7998177048E-05 -5.2639772054E-06
 -1.6320769922E-04 -4.5187846399E-06  8.7998177048E-05  5.2639772054E-06  6.6269853485E-03  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
  3.4867931111E-05 -8.6093906796E-07 -1.1843867373E-05  6.2229372506E-08  2.1320773338E-04  9.5891559020E-08
 -1.1843867373E-05  6.2229372506E-08  8.6658162201E-05  3.7379206903E-07  1.9207697689E-04  4.0099259287E-07
  2.1320773338E-04  9.5891559020E-08  1.9207697689E-04  4.0099259287E-07 -3.4682121264E-05  2.4300663818E-08

 Tensor_dq(2,ks,j2), prototypical atom
  2.0631744493E-04  1.0673162672E-07 -3.5904559468E-05  4.8089401712E-08  2.6999940603E-05 -7.6324122863E-07
 -3.5904559468E-05  4.8089401712E-08 -9.9445724467E-05  2.2066549854E-07  6.7664586728E-05 -5.5513442472E-07
  2.6999940603E-05 -7.6324122863E-07  6.7664586728E-05 -5.5513442472E-07 -8.0760534684E-05 -4.5524188083E-08

 Tensor_dq(3,ks,j2), prototypical atom
 -7.9480868489E-05  3.3030545827E-07  1.4490732375E-05  3.8058454436E-07 -1.4325536940E-04 -1.5630487888E-07
  1.4490732375E-05  3.8058454436E-07 -1.8602775556E-04 -4.4272185438E-07  9.5571163960E-05 -6.2845554462E-07
 -1.4325536940E-04 -1.5630487888E-07  9.5571163960E-05 -6.2845554462E-07  1.0500672891E-04  1.1031209593E-07

 Tensor_qq(ke,je,1,1), prototypical atom
  8.8024947954E-05 -6.2673223369E-23 -6.3896628914E-06  7.1294894915E-07  8.4223794490E-06 -2.1689206475E-07
 -6.3896628914E-06  7.1294894915E-07 -2.9077896997E-05 -4.0496212548E-07  1.8226994052E-06  1.2819953325E-07
  8.4223794490E-06 -2.1689206475E-07  1.8226994052E-06  1.2819953325E-07 -3.3898801672E-05  3.9257111917E-07

 Tensor_qq(ke,je,2,1), prototypical atom
 -6.3896628914E-06 -7.1294894915E-07  5.2466201392E-05  1.0445537228E-23 -4.0542624614E-07  4.7942197558E-07
  5.2466201392E-05  1.4189420711E-23  2.6399966858E-06  1.0021774479E-06  1.2747545748E-06 -1.2031044282E-07
 -4.0542624614E-07  4.7942197558E-07  1.2747545748E-06 -1.2031044282E-07  3.8584270728E-06 -2.8301777492E-07

 Tensor_qq(ke,je,3,1), prototypical atom
  8.4223794490E-06  2.1689206475E-07 -4.0542624614E-07 -4.7942197558E-07  7.1231896444E-05 -2.0891074456E-23
 -4.0542624614E-07 -4.7942197558E-07  1.5327032740E-05 -5.7791813523E-07  6.2913496830E-06  7.2496194329E-07
  7.1231896444E-05  0.0000000000E+00  6.2913496830E-06  7.2496194329E-07 -1.2449441433E-05  3.3552215667E-07

 Tensor_qq(ke,je,1,2), prototypical atom
 -6.3896628914E-06 -7.1294894915E-07  5.2466201392E-05  1.0445537228E-23 -4.0542624614E-07  4.7942197558E-07
  5.2466201392E-05  1.4189420711E-23  2.6399966858E-06  1.0021774479E-06  1.2747545748E-06 -1.2031044282E-07
 -4.0542624614E-07  4.7942197558E-07  1.2747545748E-06 -1.2031044282E-07  3.8584270728E-06 -2.8301777492E-07

 Tensor_qq(ke,je,2,2), prototypical atom
 -2.9077896997E-05  4.0496212548E-07  2.6399966858E-06 -1.0021774479E-06  1.5327032740E-05  5.7791813523E-07
  2.6399966858E-06 -1.0021774479E-06  9.7648995684E-05  3.4790627806E-38 -5.8999917502E-06  8.5205349514E-07
  1.5327032740E-05  5.7791813523E-07 -5.8999917502E-06  8.5205349514E-07 -3.8042918663E-05 -3.9956093959E-07

 Tensor_qq(ke,je,3,2), prototypical atom
  1.8226994052E-06 -1.2819953325E-07  1.2747545748E-06  1.2031044282E-07  6.2913496830E-06 -7.2496194329E-07
  1.2747545748E-06  1.2031044282E-07 -5.8999917502E-06 -8.5205349514E-07  6.2514233424E-05 -1.5676072077E-23
  6.2913496830E-06 -7.2496194329E-07  6.2514233424E-05 -1.0445537228E-23  2.2520966425E-06  9.7411657288E-07

 Tensor_qq(ke,je,1,3), prototypical atom
  8.4223794490E-06  2.1689206475E-07 -4.0542624614E-07 -4.7942197558E-07  7.1231896444E-05 -4.1782148912E-23
 -4.0542624614E-07 -4.7942197558E-07  1.5327032740E-05 -5.7791813523E-07  6.2913496830E-06  7.2496194329E-07
  7.1231896444E-05 -4.1782148912E-23  6.2913496830E-06  7.2496194329E-07 -1.2449441433E-05  3.3552215667E-07

 Tensor_qq(ke,je,2,3), prototypical atom
  1.8226994052E-06 -1.2819953325E-07  1.2747545748E-06  1.2031044282E-07  6.2913496830E-06 -7.2496194329E-07
  1.2747545748E-06  1.2031044282E-07 -5.8999917502E-06 -8.5205349514E-07  6.2514233424E-05 -5.2305348490E-24
  6.2913496830E-06 -7.2496194329E-07  6.2514233424E-05  0.0000000000E+00  2.2520966425E-06  9.7411657288E-07

 Tensor_qq(ke,je,3,3), prototypical atom
 -3.3898801672E-05 -3.9257111917E-07  3.8584270728E-06  2.8301777492E-07 -1.2449441433E-05 -3.3552215667E-07
  3.8584270728E-06  2.8301777492E-07 -3.8042918663E-05  3.9956093959E-07  2.2520966425E-06 -9.7411657288E-07
 -1.2449441433E-05 -3.3552215667E-07  2.2520966425E-06 -9.7411657288E-07  7.9680281976E-05  0.0000000000E+00

 Crystal Tensor_dd(ke,ks) (Mbarn)
  6.7401387374E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -1.3056615937E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  6.0295373763E-02  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21
 -1.3056615937E-03  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21  5.3015882788E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  7.0419958363E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22  6.7379035592E-05  0.0000000000E+00
  0.0000000000E+00 -2.1175823681E-22 -2.3262317597E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  6.7379035592E-05  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23 -2.7119041338E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  2.1175823681E-22  4.1972961114E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22
  4.1972961114E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22  1.0198036599E-05  0.0000000000E+00
  0.0000000000E+00 -2.1175823681E-22  1.0198036599E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,1)
  6.7379035592E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  5.6985517155E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.2261626192E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22
  5.6985517155E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22 -9.9595531467E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  2.1175823681E-22  4.1972961114E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22
  4.1972961114E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22  1.0198036599E-05  0.0000000000E+00
  0.0000000000E+00 -2.1175823681E-22  1.0198036599E-05  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22

 Crystal Tensor_qq(ke,je,2,2)
 -2.3262317597E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22  1.2261626192E-04  0.0000000000E+00
  0.0000000000E+00  4.2351647363E-22  7.8119196547E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22
  1.2261626192E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22 -3.0434334931E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  0.0000000000E+00  1.0198036599E-05  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22
  1.0198036599E-05  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22  5.0011386739E-04  0.0000000000E+00
  0.0000000000E+00 -2.1175823681E-22  5.0011386739E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,3)
  6.7379035592E-05  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22  5.6985517155E-04  0.0000000000E+00
  0.0000000000E+00  2.1175823681E-22  1.2261626192E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22
  5.6985517155E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22 -9.9595531467E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  0.0000000000E+00  1.0198036599E-05  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22
  1.0198036599E-05  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22  5.0011386739E-04  0.0000000000E+00
  0.0000000000E+00 -2.1175823681E-22  5.0011386739E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,3)
 -2.7119041338E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -9.9595531467E-05  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22 -3.0434334931E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -9.9595531467E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  6.3744225581E-04  0.0000000000E+00

 Convertion factor =  78.02530 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -12.900  6.31215E-02  6.20682E-02  6.07720E-02  5.94649E-02  5.82397E-02  5.38683E-02  6.07309E-02
   dip-dip  6.26783E-02  6.14868E-02  6.02954E-02  5.90172E-02  5.77390E-02  5.33281E-02  6.02375E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  4.43259E-04  5.81370E-04  4.76584E-04  4.47680E-04  5.00734E-04  5.40127E-04  4.93339E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -1.20004E-16 -2.99192E-05 -1.30500E-16 -1.95662E-05 -3.05121E-17  7.74578E-05  2.84549E-18  2.08460E-04
   dip-dip -1.20316E-16  2.04354E-16 -1.30677E-16  2.45419E-16 -3.00802E-17  4.00444E-05  3.54962E-18  2.45505E-04
   dip-qua  1.08968E-18  8.79622E-19  9.72629E-19  1.68025E-18 -7.09746E-19 -9.72416E-19 -7.76199E-19 -4.94911E-19
   qua-qua -7.76913E-19 -2.99192E-05 -7.96303E-19 -1.95662E-05  2.77831E-19  3.74134E-05  7.20714E-20 -3.70450E-05

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -12.80000 eV

 Vmoy = -20.18797 eV, Vmftabs(up) = -25.36753 eV, Vmftabs(dn) = -25.06291 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -1.920E-05   1.016E-02   1.568E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.458E-05   7.719E-03   1.191E-03
  1 -1    1  1    -1.050E-02   3.175E-01   3.027E-02
  1 -1    1  2     1.205E-03  -3.602E-02  -3.389E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -3.377E-03   1.027E-01   9.856E-03
  1  0    1  1    -8.534E-03   2.588E-01   2.474E-02
  1  0    1  2     1.065E-03  -3.183E-02  -2.995E-03
  1  0    2  1     1.194E-03  -3.498E-02  -3.216E-03
  1  0    2  2    -3.785E-03   1.147E-01   1.096E-02
  1  1    1  1    -6.977E-03   2.122E-01   2.037E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     1.055E-03  -3.091E-02  -2.843E-03
  1  1    2  2    -4.099E-03   1.239E-01   1.180E-02
  2 -2    1  1     5.545E-04  -2.753E-02  -4.435E-03
  2 -2    1  2    -3.224E-06   1.430E-04   2.104E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     5.161E-04  -2.566E-02  -4.138E-03
  2 -1    1  1     5.528E-04  -2.745E-02  -4.424E-03
  2 -1    1  2    -3.948E-06   1.751E-04   2.577E-05
  2 -1    2  1    -3.272E-06   1.443E-04   2.113E-05
  2 -1    2  2     5.176E-04  -2.572E-02  -4.148E-03
  2  0    1  1     5.511E-04  -2.738E-02  -4.413E-03
  2  0    1  2    -3.948E-06   1.751E-04   2.577E-05
  2  0    2  1    -4.007E-06   1.767E-04   2.588E-05
  2  0    2  2     5.192E-04  -2.579E-02  -4.158E-03
  2  1    1  1     5.494E-04  -2.730E-02  -4.401E-03
  2  1    1  2    -3.223E-06   1.430E-04   2.104E-05
  2  1    2  1    -4.006E-06   1.767E-04   2.588E-05
  2  1    2  2     5.207E-04  -2.586E-02  -4.168E-03
  2  2    1  1     5.476E-04  -2.722E-02  -4.390E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -3.271E-06   1.443E-04   2.113E-05
  2  2    2  2     5.223E-04  -2.593E-02  -4.178E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  7.7060662562E-03  0.0000000000E+00  5.3900629476E-04 -4.4655666131E-06 -1.3946897486E-04  4.1740907942E-06
  5.3900629476E-04  4.4655666131E-06  6.9325942905E-03 -4.1749519104E-38  8.7350380375E-05 -4.3177565426E-06
 -1.3946897486E-04 -4.1740907942E-06  8.7350380375E-05  4.3177565426E-06  6.1001456545E-03  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
  3.1387477714E-05 -8.0432684211E-07 -1.3607458956E-05  1.0138586262E-08  1.9314427638E-04  4.4294767199E-08
 -1.3607458956E-05  1.0138586262E-08  7.0806518716E-05  2.2908749744E-07  1.7518933958E-04  5.6978746297E-07
  1.9314427638E-04  4.4294767199E-08  1.7518933958E-04  5.6978746297E-07 -2.8301009712E-05  1.5788540366E-07

 Tensor_dq(2,ks,j2), prototypical atom
  1.8994155885E-04  4.7183232462E-08 -3.8285039714E-05  8.7609884190E-08  2.3069449364E-05 -6.5435049628E-07
 -3.8285039714E-05  8.7609884190E-08 -9.0654970261E-05  3.4995736759E-07  6.1014856415E-05 -5.6267198741E-07
  2.3069449364E-05 -6.5435049628E-07  6.1014856415E-05 -5.6267198741E-07 -7.6326356670E-05 -1.3278703837E-07

 Tensor_dq(3,ks,j2), prototypical atom
 -6.8511639213E-05  1.7825834930E-07  1.3162819247E-05  5.3443215789E-07 -1.2737672973E-04 -2.3637128361E-07
  1.3162819247E-05  5.3443215789E-07 -1.6578324682E-04 -3.8048095751E-07  8.7614209557E-05 -8.0453164718E-07
 -1.2737672973E-04 -2.3637128361E-07  8.7614209557E-05 -8.0453164718E-07  9.4642925191E-05  2.0905510076E-07

 Tensor_qq(ke,je,1,1), prototypical atom
  9.1717314643E-05 -4.1782915262E-23 -1.0006793763E-05  8.2565501154E-07  8.4913777523E-06 -2.8013102167E-07
 -1.0006793763E-05  8.2565501154E-07 -3.2188382281E-05 -5.0875598199E-07  2.2298903148E-06  1.5558062611E-07
  8.4913777523E-06 -2.8013102167E-07  2.2298903148E-06  1.5558062611E-07 -3.5770115806E-05  5.0144943677E-07

 Tensor_qq(ke,je,2,1), prototypical atom
 -1.0006793763E-05 -8.2565501154E-07  5.6569665052E-05  2.0891457631E-23 -1.4455395101E-07  5.6664020084E-07
  5.6569665052E-05  1.7544406796E-23  4.2049922690E-06  1.1834351783E-06  1.4434561762E-06 -1.4995463122E-07
 -1.4455395101E-07  5.6664020084E-07  1.4434561762E-06 -1.4995463122E-07  5.7713890603E-06 -3.5685890644E-07

 Tensor_qq(ke,je,3,1), prototypical atom
  8.4913777523E-06  2.8013102167E-07 -1.4455395101E-07 -5.6664020084E-07  7.6070229862E-05  0.0000000000E+00
 -1.4455395101E-07 -5.6664020084E-07  1.5669489704E-05 -7.1660335271E-07  7.7943612145E-06  8.5194425256E-07
  7.6070229862E-05  4.1782915262E-23  7.7943612145E-06  8.5194425256E-07 -1.4011885394E-05  4.1451049948E-07

 Tensor_qq(ke,je,1,2), prototypical atom
 -1.0006793763E-05 -8.2565501154E-07  5.6569665052E-05  1.0445728816E-23 -1.4455395101E-07  5.6664020084E-07
  5.6569665052E-05  7.0986779801E-24  4.2049922690E-06  1.1834351783E-06  1.4434561762E-06 -1.4995463122E-07
 -1.4455395101E-07  5.6664020084E-07  1.4434561762E-06 -1.4995463122E-07  5.7713890603E-06 -3.5685890644E-07

 Tensor_qq(ke,je,2,2), prototypical atom
 -3.2188382281E-05  5.0875598199E-07  4.2049922690E-06 -1.1834351783E-06  1.5669489704E-05  7.1660335271E-07
  4.2049922690E-06 -1.1834351783E-06  1.0297979432E-04  1.0147452560E-38 -8.3460347805E-06  9.9054979062E-07
  1.5669489704E-05  7.1660335271E-07 -8.3460347805E-06  9.9054979062E-07 -4.2181459276E-05 -5.0812976930E-07

 Tensor_qq(ke,je,3,2), prototypical atom
  2.2298903148E-06 -1.5558062611E-07  1.4434561762E-06  1.4995463122E-07  7.7943612145E-06 -8.5194425256E-07
  1.4434561762E-06  1.4995463122E-07 -8.3460347805E-06 -9.9054979062E-07  6.5264470798E-05 -2.1019111307E-23
  7.7943612145E-06 -8.5194425256E-07  6.5264470798E-05 -3.1337186447E-23  4.2874979536E-06  1.1469630952E-06

 Tensor_qq(ke,je,1,3), prototypical atom
  8.4913777523E-06  2.8013102167E-07 -1.4455395101E-07 -5.6664020084E-07  7.6070229862E-05  0.0000000000E+00
 -1.4455395101E-07 -5.6664020084E-07  1.5669489704E-05 -7.1660335271E-07  7.7943612145E-06  8.5194425256E-07
  7.6070229862E-05  2.0891457631E-23  7.7943612145E-06  8.5194425256E-07 -1.4011885394E-05  4.1451049948E-07

 Tensor_qq(ke,je,2,3), prototypical atom
  2.2298903148E-06 -1.5558062611E-07  1.4434561762E-06  1.4995463122E-07  7.7943612145E-06 -8.5194425256E-07
  1.4434561762E-06  1.4995463122E-07 -8.3460347805E-06 -9.9054979062E-07  6.5264470798E-05  1.0318075139E-23
  7.7943612145E-06 -8.5194425256E-07  6.5264470798E-05 -1.0445728816E-23  4.2874979536E-06  1.1469630952E-06

 Tensor_qq(ke,je,3,3), prototypical atom
 -3.5770115806E-05 -5.0144943677E-07  5.7713890603E-06  3.5685890644E-07 -1.4011885394E-05 -4.1451049948E-07
  5.7713890603E-06  3.5685890644E-07 -4.2181459276E-05  5.0812976930E-07  4.2874979536E-06 -1.1469630952E-06
 -1.4011885394E-05 -4.1451049948E-07  4.2874979536E-06 -1.1469630952E-06  8.5703522794E-05  4.1782915262E-23

 Crystal Tensor_dd(ke,ks) (Mbarn)
  6.1648530050E-02  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21 -1.1157517989E-03  0.0000000000E+00
  0.0000000000E+00  1.6940658945E-21  5.5460754324E-02  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21
 -1.1157517989E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.8801165236E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  7.3373851714E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22  6.7931022018E-05  0.0000000000E+00
  0.0000000000E+00  2.1175823681E-22 -2.5750705825E-04  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23
  6.7931022018E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -2.8616092645E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00 -2.1175823681E-22  4.5255732042E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22
  4.5255732042E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22  1.1547649409E-05  0.0000000000E+00
  0.0000000000E+00  2.1175823681E-22  1.1547649409E-05  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22

 Crystal Tensor_qq(ke,je,3,1)
  6.7931022018E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  6.0856183890E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.2535591763E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22
  6.0856183890E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22 -1.1209508315E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  2.1175823681E-22  4.5255732042E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22
  4.5255732042E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22  1.1547649409E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.1547649409E-05  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22

 Crystal Tensor_qq(ke,je,2,2)
 -2.5750705825E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22  1.2535591763E-04  0.0000000000E+00
  0.0000000000E+00 -4.2351647363E-22  8.2383835454E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.2535591763E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -3.3745167420E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00 -5.2939559203E-23  1.1547649409E-05  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22
  1.1547649409E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  5.2211576638E-04  0.0000000000E+00
  0.0000000000E+00  2.1175823681E-22  5.2211576638E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22

 Crystal Tensor_qq(ke,je,1,3)
  6.7931022018E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  6.0856183890E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.2535591763E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  6.0856183890E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22 -1.1209508315E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00 -5.2939559203E-23  1.1547649409E-05  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22
  1.1547649409E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  5.2211576638E-04  0.0000000000E+00
  0.0000000000E+00  2.1175823681E-22  5.2211576638E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22

 Crystal Tensor_qq(ke,je,3,3)
 -2.8616092645E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22 -1.1209508315E-04  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22 -3.3745167420E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22
 -1.1209508315E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22  6.8562818235E-04  0.0000000000E+00

 Convertion factor =  78.02673 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -12.800  5.78510E-02  5.70429E-02  5.59652E-02  5.47461E-02  5.35990E-02  4.96482E-02  5.58284E-02
   dip-dip  5.73808E-02  5.64208E-02  5.54608E-02  5.42648E-02  5.30689E-02  4.90718E-02  5.53035E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  4.70232E-04  6.22161E-04  5.04441E-04  4.81318E-04  5.30084E-04  5.76400E-04  5.24935E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -1.04151E-16 -3.71788E-05 -1.40274E-16 -2.47634E-05 -5.58515E-18  8.32422E-05 -1.41226E-17  1.80421E-04
   dip-dip -1.03392E-16  1.92930E-16 -1.40091E-16  2.12037E-16 -4.77815E-18  3.66043E-05 -1.39381E-17  2.26523E-04
   dip-qua  9.54513E-20  7.17458E-19  6.75550E-19  1.81410E-18 -1.08164E-18 -9.07160E-19 -2.18050E-19 -1.76698E-19
   qua-qua -8.54181E-19 -3.71788E-05 -8.58677E-19 -2.47634E-05  2.74649E-19  4.66380E-05  3.35516E-20 -4.61015E-05

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -12.70000 eV

 Vmoy = -20.18967 eV, Vmftabs(up) = -25.36775 eV, Vmftabs(dn) = -25.06312 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -1.888E-05   9.998E-03   1.542E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.440E-05   7.619E-03   1.175E-03
  1 -1    1  1    -1.025E-02   3.100E-01   2.955E-02
  1 -1    1  2     1.174E-03  -3.507E-02  -3.299E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -3.311E-03   1.007E-01   9.665E-03
  1  0    1  1    -8.343E-03   2.529E-01   2.419E-02
  1  0    1  2     1.038E-03  -3.103E-02  -2.919E-03
  1  0    2  1     1.162E-03  -3.406E-02  -3.132E-03
  1  0    2  2    -3.710E-03   1.124E-01   1.074E-02
  1  1    1  1    -6.828E-03   2.077E-01   1.993E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     1.028E-03  -3.013E-02  -2.771E-03
  1  1    2  2    -4.016E-03   1.214E-01   1.156E-02
  2 -2    1  1     5.388E-04  -2.675E-02  -4.309E-03
  2 -2    1  2    -3.136E-06   1.391E-04   2.048E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     5.013E-04  -2.492E-02  -4.020E-03
  2 -1    1  1     5.371E-04  -2.667E-02  -4.298E-03
  2 -1    1  2    -3.841E-06   1.704E-04   2.507E-05
  2 -1    2  1    -3.183E-06   1.404E-04   2.056E-05
  2 -1    2  2     5.028E-04  -2.499E-02  -4.029E-03
  2  0    1  1     5.355E-04  -2.660E-02  -4.287E-03
  2  0    1  2    -3.840E-06   1.704E-04   2.507E-05
  2  0    2  1    -3.898E-06   1.720E-04   2.518E-05
  2  0    2  2     5.043E-04  -2.506E-02  -4.039E-03
  2  1    1  1     5.338E-04  -2.653E-02  -4.277E-03
  2  1    1  2    -3.135E-06   1.391E-04   2.047E-05
  2  1    2  1    -3.897E-06   1.719E-04   2.518E-05
  2  1    2  2     5.058E-04  -2.512E-02  -4.049E-03
  2  2    1  1     5.321E-04  -2.645E-02  -4.266E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -3.182E-06   1.404E-04   2.056E-05
  2  2    2  2     5.073E-04  -2.519E-02  -4.059E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  7.0962644698E-03 -3.3426945289E-22  4.8056002458E-04 -3.9406752086E-06 -1.1997377523E-04  3.8198187610E-06
  4.8056002458E-04  3.9406752086E-06  6.4174447176E-03 -3.1312713631E-38  8.6036397878E-05 -3.4838358916E-06
 -1.1997377523E-04 -3.8198187610E-06  8.6036397878E-05  3.4838358916E-06  5.6530703050E-03  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
  2.7775512029E-05 -7.4144742094E-07 -1.5085002398E-05 -5.7906499139E-08  1.7446218126E-04 -1.0352966374E-08
 -1.5085002398E-05 -5.7906499139E-08  5.6762182541E-05  2.0960263293E-08  1.5981515734E-04  7.9201276424E-07
  1.7446218126E-04 -1.0352966374E-08  1.5981515734E-04  7.9201276424E-07 -2.1299046772E-05  3.4351882534E-07

 Tensor_dq(2,ks,j2), prototypical atom
  1.7537066074E-04 -1.6412591256E-08 -4.0463603825E-05  1.4234076528E-07  1.9429158940E-05 -5.4575379953E-07
 -4.0463603825E-05  1.4234076528E-07 -8.2719021128E-05  4.9333927914E-07  5.5616127909E-05 -5.7878753451E-07
  1.9429158940E-05 -5.4575379953E-07  5.5616127909E-05 -5.7878753451E-07 -7.2464306225E-05 -2.2461406962E-07

 Tensor_dq(3,ks,j2), prototypical atom
 -5.9593092993E-05 -1.7646242879E-08  1.1912270768E-05  7.4600992653E-07 -1.1230103807E-04 -3.5438563864E-07
  1.1912270768E-05  7.4600992653E-07 -1.4704361277E-04 -2.8964834616E-07  8.0173193903E-05 -1.0367776414E-06
 -1.1230103807E-04 -3.5438563864E-07  8.0173193903E-05 -1.0367776414E-06  8.4209395088E-05  3.2336627465E-07

 Tensor_qq(ke,je,1,1), prototypical atom
  9.6627755959E-05  0.0000000000E+00 -1.4452345145E-05  9.6499162951E-07  8.6924207909E-06 -3.6562289832E-07
 -1.4452345145E-05  9.6499162951E-07 -3.5819604331E-05 -6.4990714351E-07  2.7244719163E-06  1.9330336939E-07
  8.6924207909E-06 -3.6562289832E-07  2.7244719163E-06  1.9330336939E-07 -3.8145895997E-05  6.4881916474E-07

 Tensor_qq(ke,je,2,1), prototypical atom
 -1.4452345145E-05 -9.6499162951E-07  6.1662654946E-05  1.0445920403E-23  2.1525487831E-07  6.8056980396E-07
  6.1662654946E-05  3.2683636559E-24  6.1466875063E-06  1.4179420115E-06  1.6809609516E-06 -1.9014100108E-07
  2.1525487831E-07  6.8056980396E-07  1.6809609516E-06 -1.9014100108E-07  8.1414150292E-06 -4.5882347041E-07

 Tensor_qq(ke,je,3,1), prototypical atom
  8.6924207909E-06  3.6562289832E-07  2.1525487831E-07 -6.8056980396E-07  8.2266434995E-05  0.0000000000E+00
  2.1525487831E-07 -6.8056980396E-07  1.6447620004E-05 -9.0502777752E-07  9.6732312624E-06  1.0178321582E-06
  8.2266434995E-05  0.0000000000E+00  9.6732312624E-06  1.0178321582E-06 -1.6027382760E-05  5.2193780363E-07

 Tensor_qq(ke,je,1,2), prototypical atom
 -1.4452345145E-05 -9.6499162951E-07  6.1662654946E-05 -2.0891840806E-23  2.1525487831E-07  6.8056980396E-07
  6.1662654946E-05 -1.7623477150E-23  6.1466875063E-06  1.4179420115E-06  1.6809609516E-06 -1.9014100108E-07
  2.1525487831E-07  6.8056980396E-07  1.6809609516E-06 -1.9014100108E-07  8.1414150292E-06 -4.5882347041E-07

 Tensor_qq(ke,je,2,2), prototypical atom
 -3.5819604331E-05  6.4990714351E-07  6.1466875063E-06 -1.4179420115E-06  1.6447620004E-05  9.0502777752E-07
  6.1466875063E-06 -1.4179420115E-06  1.1009680554E-04 -4.7259002980E-38 -1.1376669842E-05  1.1669614231E-06
  1.6447620004E-05  9.0502777752E-07 -1.1376669842E-05  1.1669614231E-06 -4.7336797255E-05 -6.5601470364E-07

 Tensor_qq(ke,je,3,2), prototypical atom
  2.7244719163E-06 -1.9330336939E-07  1.6809609516E-06  1.9014100108E-07  9.6732312624E-06 -1.0178321582E-06
  1.6809609516E-06  1.9014100108E-07 -1.1376669842E-05 -1.1669614231E-06  6.8798413606E-05  5.1522929989E-23
  9.6732312624E-06 -1.0178321582E-06  6.8798413606E-05  3.1337761209E-23  6.8051569347E-06  1.3704945787E-06

 Tensor_qq(ke,je,1,3), prototypical atom
  8.6924207909E-06  3.6562289832E-07  2.1525487831E-07 -6.8056980396E-07  8.2266434995E-05  0.0000000000E+00
  2.1525487831E-07 -6.8056980396E-07  1.6447620004E-05 -9.0502777752E-07  9.6732312624E-06  1.0178321582E-06
  8.2266434995E-05  0.0000000000E+00  9.6732312624E-06  1.0178321582E-06 -1.6027382760E-05  5.2193780363E-07

 Tensor_qq(ke,je,2,3), prototypical atom
  2.7244719163E-06 -1.9330336939E-07  1.6809609516E-06  1.9014100108E-07  9.6732312624E-06 -1.0178321582E-06
  1.6809609516E-06  1.9014100108E-07 -1.1376669842E-05 -1.1669614231E-06  6.8798413606E-05 -1.1152592429E-23
  9.6732312624E-06 -1.0178321582E-06  6.8798413606E-05 -1.0445920403E-23  6.8051569347E-06  1.3704945787E-06

 Tensor_qq(ke,je,3,3), prototypical atom
 -3.8145895997E-05 -6.4881916474E-07  8.1414150292E-06  4.5882347041E-07 -1.6027382760E-05 -5.2193780363E-07
  8.1414150292E-06  4.5882347041E-07 -4.7336797255E-05  6.5601470364E-07  6.8051569347E-06 -1.3704945787E-06
 -1.6027382760E-05 -5.2193780363E-07  6.8051569347E-06 -1.3704945787E-06  9.3285927047E-05 -8.3567363223E-23

 Crystal Tensor_dd(ke,ks) (Mbarn)
  5.6770115758E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -9.5979020186E-04  0.0000000000E+00
  0.0000000000E+00 -1.6940658945E-21  5.1339557741E-02  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22
 -9.5979020186E-04  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22  4.5224562440E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  7.7302204767E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22  6.9539366327E-05  0.0000000000E+00
  0.0000000000E+00 -4.2351647363E-22 -2.8655683465E-04  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23
  6.9539366327E-05  0.0000000000E+00  0.0000000000E+00 -5.2939559203E-23 -3.0516716798E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  0.0000000000E+00  4.9330123957E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22
  4.9330123957E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22  1.3447687613E-05  0.0000000000E+00
  0.0000000000E+00  2.1175823681E-22  1.3447687613E-05  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22

 Crystal Tensor_qq(ke,je,3,1)
  6.9539366327E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  6.5813147996E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.3158096003E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  6.5813147996E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -1.2821906208E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  0.0000000000E+00  4.9330123957E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22
  4.9330123957E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22  1.3447687613E-05  0.0000000000E+00
  0.0000000000E+00  2.1175823681E-22  1.3447687613E-05  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22

 Crystal Tensor_qq(ke,je,2,2)
 -2.8655683465E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22  1.3158096003E-04  0.0000000000E+00
  0.0000000000E+00 -4.2351647363E-22  8.8077444429E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.3158096003E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22 -3.7869437804E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  0.0000000000E+00  1.3447687613E-05  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22
  1.3447687613E-05  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22  5.5038730884E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  5.5038730884E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,3)
  6.9539366327E-05  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22  6.5813147996E-04  0.0000000000E+00
  0.0000000000E+00 -2.1175823681E-22  1.3158096003E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  6.5813147996E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -1.2821906208E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  0.0000000000E+00  1.3447687613E-05  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22
  1.3447687613E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  5.5038730884E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  5.5038730884E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,3)
 -3.0516716798E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22 -1.2821906208E-04  0.0000000000E+00
  0.0000000000E+00 -1.0587911841E-22 -3.7869437804E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -1.2821906208E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  7.4628741638E-04  0.0000000000E+00

 Convertion factor =  78.02816 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -12.700  5.33964E-02  5.27912E-02  5.18794E-02  5.07437E-02  4.96700E-02  4.60834E-02  5.16765E-02
   dip-dip  5.28925E-02  5.21160E-02  5.13396E-02  5.02209E-02  4.91022E-02  4.54607E-02  5.11114E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  5.03890E-04  6.75121E-04  5.39799E-04  5.22858E-04  5.67853E-04  6.22689E-04  5.65064E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -8.84030E-17 -4.70474E-05 -1.20852E-16 -3.18170E-05  2.14735E-17  9.23289E-05 -1.87487E-17  1.48702E-04
   dip-dip -8.77186E-17  1.61366E-16 -1.20626E-16  1.86837E-16  2.17493E-17  3.31606E-05 -1.92756E-17  2.07107E-04
   dip-qua  3.94972E-19  5.77155E-19  9.42873E-19  1.57598E-18 -5.28318E-19 -8.63630E-19  3.97791E-19 -3.44903E-19
   qua-qua -1.07938E-18 -4.70474E-05 -1.16820E-18 -3.18170E-05  2.52491E-19  5.91683E-05  1.29124E-19 -5.84056E-05

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -12.60000 eV

 Vmoy = -20.19136 eV, Vmftabs(up) = -25.36796 eV, Vmftabs(dn) = -25.06334 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -1.858E-05   9.838E-03   1.518E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.421E-05   7.523E-03   1.161E-03
  1 -1    1  1    -1.001E-02   3.028E-01   2.887E-02
  1 -1    1  2     1.144E-03  -3.417E-02  -3.214E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -3.249E-03   9.881E-02   9.482E-03
  1  0    1  1    -8.159E-03   2.474E-01   2.365E-02
  1  0    1  2     1.013E-03  -3.026E-02  -2.846E-03
  1  0    2  1     1.133E-03  -3.318E-02  -3.051E-03
  1  0    2  2    -3.638E-03   1.102E-01   1.053E-02
  1  1    1  1    -6.686E-03   2.033E-01   1.951E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     1.003E-03  -2.939E-02  -2.702E-03
  1  1    2  2    -3.938E-03   1.190E-01   1.134E-02
  2 -2    1  1     5.240E-04  -2.601E-02  -4.191E-03
  2 -2    1  2    -3.054E-06   1.355E-04   1.994E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     4.875E-04  -2.423E-02  -3.909E-03
  2 -1    1  1     5.224E-04  -2.594E-02  -4.180E-03
  2 -1    1  2    -3.739E-06   1.659E-04   2.442E-05
  2 -1    2  1    -3.099E-06   1.367E-04   2.003E-05
  2 -1    2  2     4.889E-04  -2.430E-02  -3.918E-03
  2  0    1  1     5.208E-04  -2.587E-02  -4.170E-03
  2  0    1  2    -3.739E-06   1.659E-04   2.442E-05
  2  0    2  1    -3.795E-06   1.675E-04   2.453E-05
  2  0    2  2     4.904E-04  -2.436E-02  -3.927E-03
  2  1    1  1     5.192E-04  -2.580E-02  -4.159E-03
  2  1    1  2    -3.052E-06   1.354E-04   1.993E-05
  2  1    2  1    -3.795E-06   1.674E-04   2.452E-05
  2  1    2  2     4.919E-04  -2.443E-02  -3.937E-03
  2  2    1  1     5.175E-04  -2.573E-02  -4.149E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -3.098E-06   1.367E-04   2.002E-05
  2  2    2  2     4.933E-04  -2.449E-02  -3.946E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  6.5765269463E-03 -3.3427558369E-22  4.2952473674E-04 -3.4706528977E-06 -1.0399611178E-04  3.4206572467E-06
  4.2952473674E-04  3.4706528977E-06  5.9757980738E-03 -2.7834033719E-38  8.4124695675E-05 -2.7178597985E-06
 -1.0399611178E-04 -3.4206572467E-06  8.4124695675E-05  2.7178597985E-06  5.2716126032E-03  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
  2.3888577676E-05 -6.6042596814E-07 -1.6284168742E-05 -1.5188063657E-07  1.5624632741E-04 -7.2113410911E-08
 -1.6284168742E-05 -1.5188063657E-07  4.3870840342E-05 -2.8649808371E-07  1.4553001656E-04  1.0940790581E-06
  1.5624632741E-04 -7.2113410911E-08  1.4553001656E-04  1.0940790581E-06 -1.3341824112E-05  6.0726977002E-07

 Tensor_dq(2,ks,j2), prototypical atom
  1.6221676248E-04 -8.7851130071E-08 -4.2429269829E-05  2.1717496646E-07  1.5986804002E-05 -4.3315666463E-07
 -4.2429269829E-05  2.1717496646E-07 -7.5442421559E-05  6.5659854239E-07  5.1261669117E-05 -6.0410491549E-07
  1.5986804002E-05 -4.3315666463E-07  5.1261669117E-05 -6.0410491549E-07 -6.9039737250E-05 -3.2467958818E-07

 Tensor_dq(3,ks,j2), prototypical atom
 -5.2351666297E-05 -2.8522588267E-07  1.0762661481E-05  1.0425587786E-06 -9.7302206565E-05 -5.2961208605E-07
  1.0762661481E-05  1.0425587786E-06 -1.2879694038E-04 -1.5099965087E-07  7.2993219423E-05 -1.3520933240E-06
 -9.7302206565E-05 -5.2961208605E-07  7.2993219423E-05 -1.3520933240E-06  7.3071125453E-05  4.6210539213E-07

 Tensor_qq(ke,je,1,1), prototypical atom
  1.0308308045E-04 -4.1784447961E-23 -2.0048636665E-05  1.1405411196E-06  9.0357524153E-06 -4.8408304783E-07
 -2.0048636665E-05  1.1405411196E-06 -4.0181300596E-05 -8.4622554711E-07  3.3342809806E-06  2.4650501505E-07
  9.0357524153E-06 -4.8408304783E-07  3.3342809806E-06  2.4650501505E-07 -4.1172254987E-05  8.5340631515E-07

 Tensor_qq(ke,je,2,1), prototypical atom
 -2.0048636665E-05 -1.1405411196E-06  6.8077288168E-05  0.0000000000E+00  7.0974013411E-07  8.3248333015E-07
  6.8077288168E-05 -6.5741776752E-24  8.6045023990E-06  1.7281262768E-06  2.0147540909E-06 -2.4599527920E-07
  7.0974013411E-07  8.3248333015E-07  2.0147540909E-06 -2.4599527920E-07  1.1147911537E-05 -6.0264738190E-07

 Tensor_qq(ke,je,3,1), prototypical atom
  9.0357524153E-06  4.8408304783E-07  7.0974013411E-07 -8.3248333015E-07  9.0226142102E-05  1.2535334388E-22
  7.0974013411E-07 -8.3248333015E-07  1.7769420096E-05 -1.1662722357E-06  1.2050296805E-05  1.2390933919E-06
  9.0226142102E-05  8.3568895923E-23  1.2050296805E-05  1.2390933919E-06 -1.8667011183E-05  6.7099324140E-07

 Tensor_qq(ke,je,1,2), prototypical atom
 -2.0048636665E-05 -1.1405411196E-06  6.8077288168E-05  0.0000000000E+00  7.0974013411E-07  8.3248333015E-07
  6.8077288168E-05 -6.5741776752E-24  8.6045023990E-06  1.7281262768E-06  2.0147540909E-06 -2.4599527920E-07
  7.0974013411E-07  8.3248333015E-07  2.0147540909E-06 -2.4599527920E-07  1.1147911537E-05 -6.0264738190E-07

 Tensor_qq(ke,je,2,2), prototypical atom
 -4.0181300596E-05  8.4622554711E-07  8.6045023990E-06 -1.7281262768E-06  1.7769420096E-05  1.1662722357E-06
  8.6045023990E-06 -1.7281262768E-06  1.1950269071E-04  2.8413909421E-38 -1.5209470309E-05  1.3961002217E-06
  1.7769420096E-05  1.1662722357E-06 -1.5209470309E-05  1.3961002217E-06 -5.3869083463E-05 -8.6211318859E-07

 Tensor_qq(ke,je,3,2), prototypical atom
  3.3342809806E-06 -2.4650501505E-07  2.0147540909E-06  2.4599527920E-07  1.2050296805E-05 -1.2390933919E-06
  2.0147540909E-06  2.4599527920E-07 -1.5209470309E-05 -1.3961002217E-06  7.3323316371E-05  5.4945962042E-24
  1.2050296805E-05 -1.2390933919E-06  7.3323316371E-05  0.0000000000E+00  9.9960127866E-06  1.6660053752E-06

 Tensor_qq(ke,je,1,3), prototypical atom
  9.0357524153E-06  4.8408304783E-07  7.0974013411E-07 -8.3248333015E-07  9.0226142102E-05  4.1784447961E-23
  7.0974013411E-07 -8.3248333015E-07  1.7769420096E-05 -1.1662722357E-06  1.2050296805E-05  1.2390933919E-06
  9.0226142102E-05  4.1784447961E-23  1.2050296805E-05  1.2390933919E-06 -1.8667011183E-05  6.7099324140E-07

 Tensor_qq(ke,je,2,3), prototypical atom
  3.3342809806E-06 -2.4650501505E-07  2.0147540909E-06  2.4599527920E-07  1.2050296805E-05 -1.2390933919E-06
  2.0147540909E-06  2.4599527920E-07 -1.5209470309E-05 -1.3961002217E-06  7.3323316371E-05  2.6386820185E-23
  1.2050296805E-05 -1.2390933919E-06  7.3323316371E-05  2.0892223981E-23  9.9960127866E-06  1.6660053752E-06

 Tensor_qq(ke,je,3,3), prototypical atom
 -4.1172254987E-05 -8.5340631515E-07  1.1147911537E-05  6.0264738190E-07 -1.8667011183E-05 -6.7099324140E-07
  1.1147911537E-05  6.0264738190E-07 -5.3869083463E-05  8.6211318859E-07  9.9960127866E-06 -1.6660053752E-06
 -1.8667011183E-05 -6.7099324140E-07  9.9960127866E-06 -1.6660053752E-06  1.0295824136E-04 -4.1784447961E-23

 Crystal Tensor_dd(ke,ks) (Mbarn)
  5.2612215571E-02  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22 -8.3196889426E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  4.7806384590E-02  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22
 -8.3196889426E-04  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22  4.2172900826E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  8.2466464363E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22  7.2286019322E-05  0.0000000000E+00
  0.0000000000E+00  4.2351647363E-22 -3.2145040477E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  7.2286019322E-05  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22 -3.2937803989E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  0.0000000000E+00  5.4461830535E-04  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22
  5.4461830535E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22  1.6118032727E-05  0.0000000000E+00
  0.0000000000E+00 -2.1175823681E-22  1.6118032727E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,1)
  7.2286019322E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  7.2180913681E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.4215536077E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22
  7.2180913681E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22 -1.4933608947E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00 -4.2351647363E-22  5.4461830535E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  5.4461830535E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22  1.6118032727E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.6118032727E-05  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22

 Crystal Tensor_qq(ke,je,2,2)
 -3.2145040477E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22  1.4215536077E-04  0.0000000000E+00
  0.0000000000E+00  4.2351647363E-22  9.5602152568E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22
  1.4215536077E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22 -4.3095266770E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  0.0000000000E+00  1.6118032727E-05  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22
  1.6118032727E-05  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22  5.8658653097E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  5.8658653097E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22

 Crystal Tensor_qq(ke,je,1,3)
  7.2286019322E-05  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22  7.2180913681E-04  0.0000000000E+00
  0.0000000000E+00  2.1175823681E-22  1.4215536077E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22
  7.2180913681E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22 -1.4933608947E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  0.0000000000E+00  1.6118032727E-05  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22
  1.6118032727E-05  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22  5.8658653097E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  5.8658653097E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22

 Crystal Tensor_qq(ke,je,3,3)
 -3.2937803989E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22 -1.4933608947E-04  0.0000000000E+00
  0.0000000000E+00 -2.1175823681E-22 -4.3095266770E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22
 -1.4933608947E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22  8.2366593090E-04  0.0000000000E+00

 Convertion factor =  78.02959 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -12.600  4.96170E-02  4.91827E-02  4.83913E-02  4.73352E-02  4.63309E-02  4.30625E-02  4.81468E-02
   dip-dip  4.90708E-02  4.84386E-02  4.78064E-02  4.67604E-02  4.57143E-02  4.23805E-02  4.75305E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  5.46256E-04  7.44085E-04  5.84949E-04  5.74814E-04  6.16603E-04  6.81978E-04  6.16345E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -7.21221E-17 -6.07428E-05 -8.32276E-17 -4.16088E-05 -1.67313E-17  1.05950E-04 -1.78408E-18  1.09865E-04
   dip-dip -7.07291E-17  1.71830E-16 -8.29244E-17  1.88229E-16 -1.64387E-17  2.93962E-05 -1.36695E-18  1.85348E-04
   dip-qua -2.67689E-19  5.49173E-19  7.01047E-19  1.27615E-18 -7.92470E-19 -8.84227E-19 -6.27379E-19 -1.64738E-19
   qua-qua -1.12532E-18 -6.07428E-05 -1.00427E-18 -4.16088E-05  4.99898E-19  7.65534E-05  2.10246E-19 -7.54827E-05

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -12.50000 eV

 Vmoy = -20.19308 eV, Vmftabs(up) = -25.36818 eV, Vmftabs(dn) = -25.06355 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -1.829E-05   9.684E-03   1.494E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.404E-05   7.429E-03   1.146E-03
  1 -1    1  1    -9.785E-03   2.959E-01   2.821E-02
  1 -1    1  2     1.115E-03  -3.330E-02  -3.132E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -3.189E-03   9.699E-02   9.307E-03
  1  0    1  1    -7.984E-03   2.420E-01   2.314E-02
  1  0    1  2     9.881E-04  -2.952E-02  -2.776E-03
  1  0    2  1     1.104E-03  -3.234E-02  -2.973E-03
  1  0    2  2    -3.569E-03   1.081E-01   1.033E-02
  1  1    1  1    -6.549E-03   1.992E-01   1.911E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     9.786E-04  -2.867E-02  -2.635E-03
  1  1    2  2    -3.863E-03   1.167E-01   1.112E-02
  2 -2    1  1     5.101E-04  -2.532E-02  -4.080E-03
  2 -2    1  2    -2.976E-06   1.320E-04   1.944E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     4.744E-04  -2.358E-02  -3.804E-03
  2 -1    1  1     5.085E-04  -2.525E-02  -4.069E-03
  2 -1    1  2    -3.644E-06   1.617E-04   2.380E-05
  2 -1    2  1    -3.020E-06   1.333E-04   1.952E-05
  2 -1    2  2     4.758E-04  -2.365E-02  -3.813E-03
  2  0    1  1     5.069E-04  -2.518E-02  -4.059E-03
  2  0    1  2    -3.643E-06   1.617E-04   2.380E-05
  2  0    2  1    -3.699E-06   1.632E-04   2.391E-05
  2  0    2  2     4.773E-04  -2.371E-02  -3.822E-03
  2  1    1  1     5.054E-04  -2.511E-02  -4.049E-03
  2  1    1  2    -2.974E-06   1.320E-04   1.943E-05
  2  1    2  1    -3.698E-06   1.632E-04   2.391E-05
  2  1    2  2     4.787E-04  -2.377E-02  -3.831E-03
  2  2    1  1     5.038E-04  -2.504E-02  -4.038E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -3.019E-06   1.332E-04   1.952E-05
  2  2    2  2     4.801E-04  -2.383E-02  -3.840E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  6.1320811475E-03 -1.6714085724E-22  3.8468892322E-04 -3.0295438707E-06 -9.1521503329E-05  2.9185134352E-06
  3.8468892322E-04  3.0295438707E-06  5.5951063040E-03 -1.3917272105E-38  8.1668331346E-05 -1.9811896320E-06
 -9.1521503329E-05 -2.9185134352E-06  8.1668331346E-05  1.9811896320E-06  4.9452562488E-03 -1.6714085724E-22

 Tensor_dq(1,ks,j2), prototypical atom
  1.9532877131E-05 -5.4192593167E-07 -1.7183544462E-05 -2.8819480361E-07  1.3739217878E-04 -1.4665157247E-07
 -1.7183544462E-05 -2.8819480361E-07  3.1486047995E-05 -7.5267557836E-07  1.3189073069E-04  1.5183194143E-06
  1.3739217878E-04 -1.4665157247E-07  1.3189073069E-04  1.5183194143E-06 -3.9181754163E-06  9.9189914255E-07

 Tensor_dq(2,ks,j2), prototypical atom
  1.5007848886E-04 -1.7209607289E-07 -4.4108711061E-05  3.2021547618E-07  1.2639638253E-05 -3.1165849802E-07
 -4.4108711061E-05  3.2021547618E-07 -6.8618348610E-05  8.4630271917E-07  4.7782347948E-05 -6.3920895435E-07
  1.2639638253E-05 -3.1165849802E-07  4.7782347948E-05 -6.3920895435E-07 -6.5906477702E-05 -4.3603494169E-07

 Tensor_dq(3,ks,j2), prototypical atom
 -4.6513305327E-05 -6.6952245149E-07  9.7374594334E-06  1.4687161665E-06 -8.1506838671E-05 -7.9377850536E-07
  9.7374594334E-06  1.4687161665E-06 -1.0986401968E-04  6.8070034783E-08  6.5768106516E-05 -1.7932445844E-06
 -8.1506838671E-05 -7.9377850536E-07  6.5768106516E-05 -1.7932445844E-06  6.0324215322E-05  6.3831265109E-07

 Tensor_qq(ke,je,1,1), prototypical atom
  1.1158283318E-04 -4.1785214311E-23 -2.7277610176E-05  1.3665557770E-06  9.5387813404E-06 -6.5287991609E-07
 -2.7277610176E-05  1.3665557770E-06 -4.5575907034E-05 -1.1266239840E-06  4.0972317798E-06  3.2366175197E-07
  9.5387813404E-06 -6.5287991609E-07  4.0972317798E-06  3.2366175197E-07 -4.5070190481E-05  1.1456615743E-06

 Tensor_qq(ke,je,2,1), prototypical atom
 -2.7277610176E-05 -1.3665557770E-06  7.6313407190E-05  4.1785214311E-23  1.3957772178E-06  1.0402535957E-06
  7.6313407190E-05  4.1993645808E-23  1.1788212264E-05  2.1493751954E-06  2.4893214626E-06 -3.2589543248E-07
  1.3957772178E-06  1.0402535957E-06  2.4893214626E-06 -3.2589543248E-07  1.5060610105E-05 -8.1093843114E-07

 Tensor_qq(ke,je,3,1), prototypical atom
  9.5387813404E-06  6.5287991609E-07  1.3957772178E-06 -1.0402535957E-06  1.0056139133E-04  0.0000000000E+00
  1.3957772178E-06 -1.0402535957E-06  1.9821234263E-05 -1.5376889277E-06  1.5102177711E-05  1.5417293906E-06
  1.0056139133E-04  4.1785214311E-23  1.5102177711E-05  1.5417293906E-06 -2.2194408018E-05  8.8297320790E-07

 Tensor_qq(ke,je,1,2), prototypical atom
 -2.7277610176E-05 -1.3665557770E-06  7.6313407190E-05  4.1785214311E-23  1.3957772178E-06  1.0402535957E-06
  7.6313407190E-05  4.1993645808E-23  1.1788212264E-05  2.1493751954E-06  2.4893214626E-06 -3.2589543248E-07
  1.3957772178E-06  1.0402535957E-06  2.4893214626E-06 -3.2589543248E-07  1.5060610105E-05 -8.1093843114E-07

 Tensor_qq(ke,je,2,2), prototypical atom
 -4.5575907034E-05  1.1266239840E-06  1.1788212264E-05 -2.1493751954E-06  1.9821234263E-05  1.5376889277E-06
  1.1788212264E-05 -2.1493751954E-06  1.3197835787E-04  3.4793180263E-39 -2.0168507244E-05  1.7007043663E-06
  1.9821234263E-05  1.5376889277E-06 -2.0168507244E-05  1.7007043663E-06 -6.2324124622E-05 -1.1572307744E-06

 Tensor_qq(ke,je,3,2), prototypical atom
  4.0972317798E-06 -3.2366175197E-07  2.4893214626E-06  3.2589543248E-07  1.5102177711E-05 -1.5417293906E-06
  2.4893214626E-06  3.2589543248E-07 -2.0168507244E-05 -1.7007043663E-06  7.9147976065E-05 -2.0124910799E-23
  1.5102177711E-05 -1.5417293906E-06  7.9147976065E-05 -2.0892607155E-23  1.4147403282E-05  2.0669199126E-06

 Tensor_qq(ke,je,1,3), prototypical atom
  9.5387813404E-06  6.5287991609E-07  1.3957772178E-06 -1.0402535957E-06  1.0056139133E-04  0.0000000000E+00
  1.3957772178E-06 -1.0402535957E-06  1.9821234263E-05 -1.5376889277E-06  1.5102177711E-05  1.5417293906E-06
  1.0056139133E-04 -4.1785214311E-23  1.5102177711E-05  1.5417293906E-06 -2.2194408018E-05  8.8297320790E-07

 Tensor_qq(ke,je,2,3), prototypical atom
  4.0972317798E-06 -3.2366175197E-07  2.4893214626E-06  3.2589543248E-07  1.5102177711E-05 -1.5417293906E-06
  2.4893214626E-06  3.2589543248E-07 -2.0168507244E-05 -1.7007043663E-06  7.9147976065E-05  2.1660303512E-23
  1.5102177711E-05 -1.5417293906E-06  7.9147976065E-05  2.0892607155E-23  1.4147403282E-05  2.0669199126E-06

 Tensor_qq(ke,je,3,3), prototypical atom
 -4.5070190481E-05 -1.1456615743E-06  1.5060610105E-05  8.1093843114E-07 -2.2194408018E-05 -8.8297320790E-07
  1.5060610105E-05  8.1093843114E-07 -6.2324124622E-05  1.1572307744E-06  1.4147403282E-05 -2.0669199126E-06
 -2.2194408018E-05 -8.8297320790E-07  1.4147403282E-05 -2.0669199126E-06  1.1552410921E-04 -8.3570428622E-23

 Crystal Tensor_dd(ke,ks) (Mbarn)
  4.9056649180E-02  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22 -7.3217202664E-04  0.0000000000E+00
  0.0000000000E+00 -8.4703294725E-22  4.4760850432E-02  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22
 -7.3217202664E-04  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22  3.9562049991E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  8.9266266541E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22  7.6310250723E-05  0.0000000000E+00
  0.0000000000E+00 -4.2351647363E-22 -3.6460725627E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22
  7.6310250723E-05  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22 -3.6056152385E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  4.2351647363E-22  6.1050725752E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22
  6.1050725752E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.9914571701E-05  0.0000000000E+00
  0.0000000000E+00 -4.2351647363E-22  1.9914571701E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,1)
  7.6310250723E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  8.0449113061E-04  0.0000000000E+00
  0.0000000000E+00 -4.2351647363E-22  1.5856987410E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22
  8.0449113061E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22 -1.7755526414E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  0.0000000000E+00  6.1050725752E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  6.1050725752E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.9914571701E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.9914571701E-05  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22

 Crystal Tensor_qq(ke,je,2,2)
 -3.6460725627E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.5856987410E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.0558268630E-03  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22
  1.5856987410E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22 -4.9859299698E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  1.0587911841E-22  1.9914571701E-05  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22
  1.9914571701E-05  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22  6.3318380852E-04  0.0000000000E+00
  0.0000000000E+00  4.2351647363E-22  6.3318380852E-04  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22

 Crystal Tensor_qq(ke,je,1,3)
  7.6310250723E-05  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22  8.0449113061E-04  0.0000000000E+00
  0.0000000000E+00  4.2351647363E-22  1.5856987410E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22
  8.0449113061E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22 -1.7755526414E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  1.0587911841E-22  1.9914571701E-05  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22
  1.9914571701E-05  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22  6.3318380852E-04  0.0000000000E+00
  0.0000000000E+00  4.2351647363E-22  6.3318380852E-04  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22

 Crystal Tensor_qq(ke,je,3,3)
 -3.6056152385E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -1.7755526414E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -4.9859299698E-04  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22
 -1.7755526414E-04  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22  9.2419287365E-04  0.0000000000E+00

 Convertion factor =  78.03102 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -12.500  4.64119E-02  4.61211E-02  4.54042E-02  4.44249E-02  4.34874E-02  4.05056E-02  4.51426E-02
   dip-dip  4.58115E-02  4.52862E-02  4.47609E-02  4.37840E-02  4.28072E-02  3.97468E-02  4.44598E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  6.00339E-04  8.34954E-04  6.43352E-04  6.40906E-04  6.80225E-04  7.58761E-04  6.82733E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -9.38063E-17 -8.02358E-05 -9.89060E-17 -5.55694E-05  4.94844E-18  1.26115E-04 -2.58092E-19  5.83138E-05
   dip-dip -9.26543E-17  1.34852E-16 -9.82829E-17  1.79880E-16  5.05131E-18  2.48128E-05 -3.99487E-19  1.58120E-04
   dip-qua  1.66864E-19  3.84825E-19  5.87306E-19  9.46824E-19 -6.17340E-19 -7.84463E-19 -2.18743E-19 -1.71650E-19
   qua-qua -1.31879E-18 -8.02358E-05 -1.21048E-18 -5.55694E-05  5.14472E-19  1.01302E-04  3.60138E-19 -9.98058E-05

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -12.40000 eV

 Vmoy = -20.19477 eV, Vmftabs(up) = -25.36839 eV, Vmftabs(dn) = -25.06376 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -1.801E-05   9.534E-03   1.471E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.387E-05   7.338E-03   1.132E-03
  1 -1    1  1    -9.566E-03   2.892E-01   2.757E-02
  1 -1    1  2     1.087E-03  -3.246E-02  -3.052E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -3.132E-03   9.525E-02   9.140E-03
  1  0    1  1    -7.814E-03   2.369E-01   2.265E-02
  1  0    1  2     9.644E-04  -2.881E-02  -2.709E-03
  1  0    2  1     1.076E-03  -3.152E-02  -2.897E-03
  1  0    2  2    -3.503E-03   1.061E-01   1.014E-02
  1  1    1  1    -6.417E-03   1.952E-01   1.873E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     9.551E-04  -2.798E-02  -2.572E-03
  1  1    2  2    -3.791E-03   1.146E-01   1.091E-02
  2 -2    1  1     4.970E-04  -2.467E-02  -3.975E-03
  2 -2    1  2    -2.902E-06   1.288E-04   1.896E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     4.621E-04  -2.297E-02  -3.705E-03
  2 -1    1  1     4.954E-04  -2.460E-02  -3.965E-03
  2 -1    1  2    -3.554E-06   1.577E-04   2.322E-05
  2 -1    2  1    -2.946E-06   1.300E-04   1.905E-05
  2 -1    2  2     4.635E-04  -2.303E-02  -3.714E-03
  2  0    1  1     4.939E-04  -2.453E-02  -3.955E-03
  2  0    1  2    -3.553E-06   1.577E-04   2.322E-05
  2  0    2  1    -3.608E-06   1.592E-04   2.333E-05
  2  0    2  2     4.649E-04  -2.309E-02  -3.723E-03
  2  1    1  1     4.924E-04  -2.447E-02  -3.945E-03
  2  1    1  2    -2.901E-06   1.287E-04   1.895E-05
  2  1    2  1    -3.607E-06   1.592E-04   2.332E-05
  2  1    2  2     4.663E-04  -2.315E-02  -3.732E-03
  2  2    1  1     4.908E-04  -2.440E-02  -3.934E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -2.945E-06   1.300E-04   1.904E-05
  2  2    2  2     4.676E-04  -2.322E-02  -3.741E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  5.7519917148E-03 -1.6714392264E-22  3.4513226990E-04 -2.5907500458E-06 -8.3320023673E-05  2.2129174901E-06
  3.4513226990E-04  2.5907500458E-06  5.2653227763E-03  9.2783515672E-39  7.8684593270E-05 -1.2389220067E-06
 -8.3320023673E-05 -2.2129174901E-06  7.8684593270E-05  1.2389220067E-06  4.6666503902E-03 -1.6714392264E-22

 Tensor_dq(1,ks,j2), prototypical atom
  1.4430202898E-05 -3.5204498519E-07 -1.7723461572E-05 -4.9540012021E-07  1.1639902666E-04 -2.4269963114E-07
 -1.7723461572E-05 -4.9540012021E-07  1.8862057621E-05 -1.4803573855E-06  1.1839191700E-04  2.1356234202E-06
  1.1639902666E-04 -2.4269963114E-07  1.1839191700E-04  2.1356234202E-06  7.7843166007E-06  1.5704876592E-06

 Tensor_dq(2,ks,j2), prototypical atom
  1.3848738074E-04 -2.7612777215E-07 -4.5326108190E-05  4.6481340983E-07  9.2635689324E-06 -1.7582654435E-07
 -4.5326108190E-05  4.6481340983E-07 -6.1999394728E-05  1.0691518060E-06  4.5033720393E-05 -6.8409793706E-07
  9.2635689324E-06 -1.7582654435E-07  4.5033720393E-05 -6.8409793706E-07 -6.2882046123E-05 -5.5977855070E-07

 Tensor_dq(3,ks,j2), prototypical atom
 -4.1891746071E-05 -1.2475721908E-06  8.8661398638E-06  2.1004343172E-06 -6.3724548277E-05 -1.2013669360E-06
  8.8661398638E-06  2.1004343172E-06 -8.8664825169E-05  4.2524137799E-07  5.8082014933E-05 -2.4312544841E-06
 -6.3724548277E-05 -1.2013669360E-06  5.8082014933E-05 -2.4312544841E-06  4.4582482457E-05  8.7250375004E-07

 Tensor_qq(ke,je,1,1), prototypical atom
  1.2290625144E-04  1.6714392264E-22 -3.6886850620E-05  1.6650027507E-06  1.0226600924E-05 -9.0133555022E-07
 -3.6886850620E-05  1.6650027507E-06 -5.2459728731E-05 -1.5399891029E-06  5.0658159060E-06  4.3936335788E-07
  1.0226600924E-05 -9.0133555022E-07  5.0658159060E-06  4.3936335788E-07 -5.0183272453E-05  1.5772182614E-06

 Tensor_qq(ke,je,2,1), prototypical atom
 -3.6886850620E-05 -1.6650027507E-06  8.7148035355E-05  4.1785980661E-23  2.3656694474E-06  1.3333085207E-06
  8.7148035355E-05  3.6753372126E-23  1.6022900171E-05  2.7397871994E-06  3.1788536633E-06 -4.4413556295E-07
  2.3656694474E-06  1.3333085207E-06  3.1788536633E-06 -4.4413556295E-07  2.0300577652E-05 -1.1224125592E-06

 Tensor_qq(ke,je,3,1), prototypical atom
  1.0226600924E-05  9.0133555022E-07  2.3656694474E-06 -1.3333085207E-06  1.1421712142E-04 -1.6714392264E-22
  2.3656694474E-06 -1.3333085207E-06  2.2919668893E-05 -2.0820189758E-06  1.9090316876E-05  1.9683378155E-06
  1.1421712142E-04  0.0000000000E+00  1.9090316876E-05  1.9683378155E-06 -2.7029914563E-05  1.1935544225E-06

 Tensor_qq(ke,je,1,2), prototypical atom
 -3.6886850620E-05 -1.6650027507E-06  8.7148035355E-05 -4.1785980661E-23  2.3656694474E-06  1.3333085207E-06
  8.7148035355E-05 -4.6818589196E-23  1.6022900171E-05  2.7397871994E-06  3.1788536633E-06 -4.4413556295E-07
  2.3656694474E-06  1.3333085207E-06  3.1788536633E-06 -4.4413556295E-07  2.0300577652E-05 -1.1224125592E-06

 Tensor_qq(ke,je,2,2), prototypical atom
 -5.2459728731E-05  1.5399891029E-06  1.6022900171E-05 -2.7397871994E-06  2.2919668893E-05  2.0820189758E-06
  1.6022900171E-05 -2.7397871994E-06  1.4875629842E-04 -8.8144339888E-38 -2.6752497861E-05  2.1169021925E-06
  2.2919668893E-05  2.0820189758E-06 -2.6752497861E-05  2.1169021925E-06 -7.3557534012E-05 -1.5936670888E-06

 Tensor_qq(ke,je,3,2), prototypical atom
  5.0658159060E-06 -4.3936335788E-07  3.1788536633E-06  4.4413556295E-07  1.9090316876E-05 -1.9683378155E-06
  3.1788536633E-06  4.4413556295E-07 -2.6752497861E-05 -2.1169021925E-06  8.6742393446E-05  3.2113996228E-23
  1.9090316876E-05 -1.9683378155E-06  8.6742393446E-05  0.0000000000E+00  1.9707894312E-05  2.6277560856E-06

 Tensor_qq(ke,je,1,3), prototypical atom
  1.0226600924E-05  9.0133555022E-07  2.3656694474E-06 -1.3333085207E-06  1.1421712142E-04  1.6714392264E-22
  2.3656694474E-06 -1.3333085207E-06  2.2919668893E-05 -2.0820189758E-06  1.9090316876E-05  1.9683378155E-06
  1.1421712142E-04  8.3571961321E-23  1.9090316876E-05  1.9683378155E-06 -2.7029914563E-05  1.1935544225E-06

 Tensor_qq(ke,je,2,3), prototypical atom
  5.0658159060E-06 -4.3936335788E-07  3.1788536633E-06  4.4413556295E-07  1.9090316876E-05 -1.9683378155E-06
  3.1788536633E-06  4.4413556295E-07 -2.6752497861E-05 -2.1169021925E-06  8.6742393446E-05  3.2113996228E-23
  1.9090316876E-05 -1.9683378155E-06  8.6742393446E-05  0.0000000000E+00  1.9707894312E-05  2.6277560856E-06

 Tensor_qq(ke,je,3,3), prototypical atom
 -5.0183272453E-05 -1.5772182614E-06  2.0300577652E-05  1.1224125592E-06 -2.7029914563E-05 -1.1935544225E-06
  2.0300577652E-05  1.1224125592E-06 -7.3557534012E-05  1.5936670888E-06  1.9707894312E-05 -2.6277560856E-06
 -2.7029914563E-05 -1.1935544225E-06  1.9707894312E-05 -2.6277560856E-06  1.3224257416E-04  1.6714392264E-22

 Crystal Tensor_dd(ke,ks) (Mbarn)
  4.6015933719E-02  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22 -6.6656018938E-04  0.0000000000E+00
  0.0000000000E+00 -8.4703294725E-22  4.2122582211E-02  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22
 -6.6656018938E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22  3.7333203122E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  9.8325001155E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22  8.1812807389E-05  0.0000000000E+00
  0.0000000000E+00  4.2351647363E-22 -4.1967782985E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  8.1812807389E-05  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22 -4.0146617963E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00 -4.2351647363E-22  6.9718428284E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22
  6.9718428284E-04  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22  2.5430829307E-05  0.0000000000E+00
  0.0000000000E+00 -4.2351647363E-22  2.5430829307E-05  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22

 Crystal Tensor_qq(ke,je,3,1)
  8.1812807389E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  9.1373697133E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.8335735114E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  9.1373697133E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -2.1623931650E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00 -4.2351647363E-22  6.9718428284E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22
  6.9718428284E-04  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22  2.5430829307E-05  0.0000000000E+00
  0.0000000000E+00 -4.2351647363E-22  2.5430829307E-05  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22

 Crystal Tensor_qq(ke,je,2,2)
 -4.1967782985E-04  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22  1.8335735114E-04  0.0000000000E+00
  0.0000000000E+00  8.4703294725E-22  1.1900503874E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.8335735114E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -5.8846027210E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00 -1.0587911841E-22  2.5430829307E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  2.5430829307E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  6.9393914757E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  6.9393914757E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,3)
  8.1812807389E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  9.1373697133E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.8335735114E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  9.1373697133E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -2.1623931650E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  1.0587911841E-22  2.5430829307E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  2.5430829307E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  6.9393914757E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  6.9393914757E-04  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22

 Crystal Tensor_qq(ke,je,3,3)
 -4.0146617963E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22 -2.1623931650E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -5.8846027210E-04  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22
 -2.1623931650E-04  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22  1.0579405933E-03  0.0000000000E+00

 Convertion factor =  78.03246 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -12.400  4.37161E-02  4.35410E-02  4.28430E-02  4.19400E-02  4.10686E-02  3.83617E-02  4.25943E-02
   dip-dip  4.30453E-02  4.25840E-02  4.21226E-02  4.12132E-02  4.03038E-02  3.75017E-02  4.18239E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  6.70743E-04  9.57046E-04  7.20380E-04  7.26812E-04  7.64805E-04  8.59963E-04  7.70362E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -8.82554E-17 -1.08839E-04 -1.03474E-16 -7.61123E-05 -2.10845E-17  1.56207E-04 -2.81377E-18 -1.55025E-05
   dip-dip -8.72520E-17  1.34481E-16 -1.02906E-16  1.62484E-16 -2.09055E-17  1.85709E-05 -2.03452E-18  1.20039E-04
   dip-qua  2.58759E-19  1.88587E-19  6.15798E-19  9.96672E-19 -6.97554E-19 -5.36518E-19 -1.14400E-18  2.00287E-19
   qua-qua -1.26217E-18 -1.08839E-04 -1.18365E-18 -7.61123E-05  5.18557E-19  1.37636E-04  3.64756E-19 -1.35541E-04

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -12.30000 eV

 Vmoy = -20.19650 eV, Vmftabs(up) = -25.36860 eV, Vmftabs(dn) = -25.06397 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -1.774E-05   9.389E-03   1.448E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.370E-05   7.250E-03   1.118E-03
  1 -1    1  1    -9.354E-03   2.828E-01   2.696E-02
  1 -1    1  2     1.060E-03  -3.165E-02  -2.976E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -3.077E-03   9.357E-02   8.979E-03
  1  0    1  1    -7.651E-03   2.320E-01   2.218E-02
  1  0    1  2     9.414E-04  -2.812E-02  -2.644E-03
  1  0    2  1     1.049E-03  -3.073E-02  -2.825E-03
  1  0    2  2    -3.439E-03   1.042E-01   9.956E-03
  1  1    1  1    -6.290E-03   1.913E-01   1.836E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     9.323E-04  -2.731E-02  -2.510E-03
  1  1    2  2    -3.721E-03   1.125E-01   1.071E-02
  2 -2    1  1     4.846E-04  -2.405E-02  -3.875E-03
  2 -2    1  2    -2.833E-06   1.257E-04   1.851E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     4.504E-04  -2.239E-02  -3.611E-03
  2 -1    1  1     4.831E-04  -2.399E-02  -3.866E-03
  2 -1    1  2    -3.469E-06   1.540E-04   2.267E-05
  2 -1    2  1    -2.876E-06   1.269E-04   1.860E-05
  2 -1    2  2     4.518E-04  -2.245E-02  -3.620E-03
  2  0    1  1     4.816E-04  -2.392E-02  -3.856E-03
  2  0    1  2    -3.468E-06   1.540E-04   2.267E-05
  2  0    2  1    -3.522E-06   1.554E-04   2.278E-05
  2  0    2  2     4.532E-04  -2.251E-02  -3.629E-03
  2  1    1  1     4.801E-04  -2.385E-02  -3.846E-03
  2  1    1  2    -2.832E-06   1.257E-04   1.851E-05
  2  1    2  1    -3.521E-06   1.554E-04   2.277E-05
  2  1    2  2     4.545E-04  -2.257E-02  -3.638E-03
  2  2    1  1     4.786E-04  -2.379E-02  -3.836E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -2.875E-06   1.269E-04   1.859E-05
  2  2    2  2     4.559E-04  -2.263E-02  -3.646E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  5.4290792430E-03  0.0000000000E+00  3.1022330936E-04 -2.1256206030E-06 -8.1311197682E-05  1.1190278018E-06
  3.1022330936E-04  2.1256206030E-06  4.9785062753E-03  0.0000000000E+00  7.5140835652E-05 -4.6115502583E-07
 -8.1311197682E-05 -1.1190278018E-06  7.5140835652E-05  4.6115502583E-07  4.4317550722E-03  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
  8.1562767099E-06 -2.7373634916E-08 -1.7786576903E-05 -8.2611304337E-07  9.0991076881E-05 -3.7501568262E-07
 -1.7786576903E-05 -8.2611304337E-07  4.9723922959E-06 -2.6568329194E-06  1.0439012648E-04  3.0710552693E-06
  9.0991076881E-05 -3.7501568262E-07  1.0439012648E-04  3.0710552693E-06  2.3129196977E-05  2.4743842047E-06

 Tensor_dq(2,ks,j2), prototypical atom
  1.2680498254E-04 -4.1050431632E-07 -4.5720538740E-05  6.7365648749E-07  5.6930186977E-06 -2.0500958577E-08
 -4.5720538740E-05  6.7365648749E-07 -5.5241184466E-05  1.3296085211E-06  4.2879983219E-05 -7.3674837389E-07
  5.6930186977E-06 -2.0500958577E-08  4.2879983219E-05 -7.3674837389E-07 -5.9700579996E-05 -6.9119439680E-07

 Tensor_dq(3,ks,j2), prototypical atom
 -3.8388794226E-05 -2.1589600549E-06  8.1904603244E-06  3.0736937747E-06 -4.2137044181E-05 -1.8506346567E-06
  8.1904603244E-06  3.0736937747E-06 -6.2795391994E-05  1.0277356661E-06  4.9297313531E-05 -3.3902964945E-06
 -4.2137044181E-05 -1.8506346567E-06  4.9297313531E-05 -3.3902964945E-06  2.3555929820E-05  1.1993238620E-06

 Tensor_qq(ke,je,1,1), prototypical atom
  1.3831915333E-04 -1.6714698804E-22 -5.0091827740E-05  2.0714002715E-06  1.1131251670E-05 -1.2815001108E-06
 -5.0091827740E-05  2.0714002715E-06 -6.1558781127E-05 -2.1732690833E-06  6.3136325912E-06  6.2005987005E-07
  1.1131251670E-05 -1.2815001108E-06  6.3136325912E-06  6.2005987005E-07 -5.7070634212E-05  2.2402468218E-06

 Tensor_qq(ke,je,2,1), prototypical atom
 -5.0091827740E-05 -2.0714002715E-06  1.0184756406E-04 -4.1786747010E-23  3.7750452806E-06  1.7625849519E-06
  1.0184756406E-04 -3.8842235694E-23  2.1834189150E-05  3.5998057327E-06  4.2125401351E-06 -6.2642882551E-07
  3.7750452806E-06  1.7625849519E-06  4.2125401351E-06 -6.2642882551E-07  2.7557680663E-05 -1.6068080609E-06

 Tensor_qq(ke,je,3,1), prototypical atom
  1.1131251670E-05  1.2815001108E-06  3.7750452806E-06 -1.7625849519E-06  1.3271156070E-04  1.6714698804E-22
  3.7750452806E-06 -1.7625849519E-06  2.7615820296E-05 -2.9098377412E-06  2.4415099853E-05  2.5921225645E-06
  1.3271156070E-04 -8.3573494020E-23  2.4415099853E-05  2.5921225645E-06 -3.3875149637E-05  1.6653877936E-06

 Tensor_qq(ke,je,1,2), prototypical atom
 -5.0091827740E-05 -2.0714002715E-06  1.0184756406E-04 -4.1786747010E-23  3.7750452806E-06  1.7625849519E-06
  1.0184756406E-04 -3.8842235694E-23  2.1834189150E-05  3.5998057327E-06  4.2125401351E-06 -6.2642882551E-07
  3.7750452806E-06  1.7625849519E-06  4.2125401351E-06 -6.2642882551E-07  2.7557680663E-05 -1.6068080609E-06

 Tensor_qq(ke,je,2,2), prototypical atom
 -6.1558781127E-05  2.1732690833E-06  2.1834189150E-05 -3.5998057327E-06  2.7615820296E-05  2.9098377412E-06
  2.1834189150E-05 -3.5998057327E-06  1.7185732172E-04 -9.9744108608E-38 -3.5763468576E-05  2.7047784617E-06
  2.7615820296E-05  2.9098377412E-06 -3.5763468576E-05  2.7047784617E-06 -8.8975552338E-05 -2.2648515333E-06

 Tensor_qq(ke,je,3,2), prototypical atom
  6.3136325912E-06 -6.2005987005E-07  4.2125401351E-06  6.2642882551E-07  2.4415099853E-05 -2.5921225645E-06
  4.2125401351E-06  6.2642882551E-07 -3.5763468576E-05 -2.7047784617E-06  9.6851332759E-05 -1.6860999840E-23
  2.4415099853E-05 -2.5921225645E-06  9.6851332759E-05  4.1786747010E-23  2.7411582990E-05  3.4419207454E-06

 Tensor_qq(ke,je,1,3), prototypical atom
  1.1131251670E-05  1.2815001108E-06  3.7750452806E-06 -1.7625849519E-06  1.3271156070E-04  1.6714698804E-22
  3.7750452806E-06 -1.7625849519E-06  2.7615820296E-05 -2.9098377412E-06  2.4415099853E-05  2.5921225645E-06
  1.3271156070E-04 -8.3573494020E-23  2.4415099853E-05  2.5921225645E-06 -3.3875149637E-05  1.6653877936E-06

 Tensor_qq(ke,je,2,3), prototypical atom
  6.3136325912E-06 -6.2005987005E-07  4.2125401351E-06  6.2642882551E-07  2.4415099853E-05 -2.5921225645E-06
  4.2125401351E-06  6.2642882551E-07 -3.5763468576E-05 -2.7047784617E-06  9.6851332759E-05 -1.6860999840E-23
  2.4415099853E-05 -2.5921225645E-06  9.6851332759E-05  4.1786747010E-23  2.7411582990E-05  3.4419207454E-06

 Tensor_qq(ke,je,3,3), prototypical atom
 -5.7070634212E-05 -2.2402468218E-06  2.7557680663E-05  1.6068080609E-06 -3.3875149637E-05 -1.6653877936E-06
  2.7557680663E-05  1.6068080609E-06 -8.8975552338E-05  2.2648515333E-06  2.7411582990E-05 -3.4419207454E-06
 -3.3875149637E-05 -1.6653877936E-06  2.7411582990E-05 -3.4419207454E-06  1.5518341261E-04  0.0000000000E+00

 Crystal Tensor_dd(ke,ks) (Mbarn)
  4.3432633944E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -6.5048958146E-04  0.0000000000E+00
  0.0000000000E+00  8.4703294725E-22  3.9828050202E-02  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22
 -6.5048958146E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  3.5454040577E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  1.1065532266E-03  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22  8.9050013358E-05  0.0000000000E+00
  0.0000000000E+00 -8.4703294725E-22 -4.9247024901E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  8.9050013358E-05  0.0000000000E+00  0.0000000000E+00  2.1175823681E-22 -4.5656507369E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  8.4703294725E-22  8.1478051246E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  8.1478051246E-04  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22  3.3700321080E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  3.3700321080E-05  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22

 Crystal Tensor_qq(ke,je,3,1)
  8.9050013358E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.0616924856E-03  0.0000000000E+00
  0.0000000000E+00  4.2351647363E-22  2.2092656237E-04  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22
  1.0616924856E-03  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22 -2.7100119709E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  8.4703294725E-22  8.1478051246E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  8.1478051246E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  3.3700321080E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  3.3700321080E-05  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22

 Crystal Tensor_qq(ke,je,2,2)
 -4.9247024901E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  2.2092656237E-04  0.0000000000E+00
  0.0000000000E+00  8.4703294725E-22  1.3748585737E-03  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22
  2.2092656237E-04  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22 -7.1180441870E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  0.0000000000E+00  3.3700321080E-05  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22
  3.3700321080E-05  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22  7.7481066207E-04  0.0000000000E+00
  0.0000000000E+00  8.4703294725E-22  7.7481066207E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,3)
  8.9050013358E-05  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22  1.0616924856E-03  0.0000000000E+00
  0.0000000000E+00 -4.2351647363E-22  2.2092656237E-04  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22
  1.0616924856E-03  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22 -2.7100119709E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  0.0000000000E+00  3.3700321080E-05  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22
  3.3700321080E-05  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22  7.7481066207E-04  0.0000000000E+00
  0.0000000000E+00  8.4703294725E-22  7.7481066207E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,3)
 -4.5656507369E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22 -2.7100119709E-04  0.0000000000E+00
  0.0000000000E+00  4.2351647363E-22 -7.1180441870E-04  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22
 -2.7100119709E-04  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22  1.2414673009E-03  0.0000000000E+00

 Convertion factor =  78.03389 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -12.300  4.15052E-02  4.14099E-02  4.06528E-02  3.98287E-02  3.90266E-02  3.66118E-02  4.04607E-02
   dip-dip  4.07404E-02  4.02842E-02  3.98281E-02  3.89872E-02  3.81463E-02  3.56151E-02  3.95716E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  7.64837E-04  1.12569E-03  8.24755E-04  8.41584E-04  8.80289E-04  9.96691E-04  8.89171E-04

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -8.36769E-17 -1.52397E-04 -8.74587E-17 -1.07518E-04 -1.54179E-17  2.02159E-04  4.28526E-18 -1.28842E-04
   dip-dip -8.18191E-17  1.34388E-16 -8.65942E-17  1.47981E-16 -1.58138E-17  9.14874E-06  3.57263E-18  6.12193E-05
   dip-qua -1.38991E-19  1.50461E-19  4.89425E-19  8.15846E-19 -5.72733E-19 -5.17527E-19  5.16554E-19 -2.90109E-19
   qua-qua -1.71875E-18 -1.52397E-04 -1.35388E-18 -1.07518E-04  9.68593E-19  1.93011E-04  1.96083E-19 -1.90061E-04

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -12.20000 eV

 Vmoy = -20.19823 eV, Vmftabs(up) = -25.36882 eV, Vmftabs(dn) = -25.06418 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -1.747E-05   9.249E-03   1.427E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.354E-05   7.164E-03   1.105E-03
  1 -1    1  1    -9.150E-03   2.766E-01   2.637E-02
  1 -1    1  2     1.033E-03  -3.087E-02  -2.902E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -3.024E-03   9.196E-02   8.824E-03
  1  0    1  1    -7.494E-03   2.272E-01   2.172E-02
  1  0    1  2     9.192E-04  -2.745E-02  -2.581E-03
  1  0    2  1     1.024E-03  -2.998E-02  -2.755E-03
  1  0    2  2    -3.379E-03   1.024E-01   9.779E-03
  1  1    1  1    -6.168E-03   1.876E-01   1.800E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     9.104E-04  -2.666E-02  -2.450E-03
  1  1    2  2    -3.655E-03   1.104E-01   1.052E-02
  2 -2    1  1     4.729E-04  -2.347E-02  -3.782E-03
  2 -2    1  2    -2.767E-06   1.228E-04   1.809E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     4.394E-04  -2.184E-02  -3.523E-03
  2 -1    1  1     4.714E-04  -2.341E-02  -3.772E-03
  2 -1    1  2    -3.389E-06   1.504E-04   2.215E-05
  2 -1    2  1    -2.809E-06   1.240E-04   1.817E-05
  2 -1    2  2     4.407E-04  -2.190E-02  -3.532E-03
  2  0    1  1     4.699E-04  -2.334E-02  -3.762E-03
  2  0    1  2    -3.388E-06   1.504E-04   2.215E-05
  2  0    2  1    -3.440E-06   1.519E-04   2.226E-05
  2  0    2  2     4.421E-04  -2.196E-02  -3.540E-03
  2  1    1  1     4.684E-04  -2.328E-02  -3.753E-03
  2  1    1  2    -2.766E-06   1.228E-04   1.808E-05
  2  1    2  1    -3.440E-06   1.519E-04   2.225E-05
  2  1    2  2     4.434E-04  -2.202E-02  -3.549E-03
  2  2    1  1     4.670E-04  -2.321E-02  -3.743E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -2.808E-06   1.240E-04   1.817E-05
  2  2    2  2     4.447E-04  -2.208E-02  -3.557E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  5.1603635590E-03  8.3575026720E-23  2.7967870190E-04 -1.6044959441E-06 -8.9466576727E-05 -7.2564015494E-07
  2.7967870190E-04  1.6044959441E-06  4.7283878679E-03  0.0000000000E+00  7.0935887293E-05  3.6639000971E-07
 -8.9466576727E-05  7.2564015494E-07  7.0935887293E-05 -3.6639000971E-07  4.2406495526E-03  4.1787513360E-23

 Tensor_dq(1,ks,j2), prototypical atom
  3.0042352094E-08  5.5826789565E-07 -1.7160218265E-05 -1.3831855460E-06  5.7394786749E-05 -5.7061133954E-07
 -1.7160218265E-05 -1.3831855460E-06 -1.1833594177E-05 -4.6428739809E-06  8.8980628443E-05  4.5576751331E-06
  5.7394786749E-05 -5.7061133954E-07  8.8980628443E-05  4.5576751331E-06  4.4530582781E-05  3.9528990765E-06

 Tensor_dq(2,ks,j2), prototypical atom
  1.1402066373E-04 -5.9216013637E-07 -4.4563096412E-05  9.8699446393E-07  1.6856497118E-06  1.5568736102E-07
 -4.4563096412E-05  9.8699446393E-07 -4.7790871599E-05  1.6217190851E-06  4.1170420298E-05 -7.8909368831E-07
  1.6856497118E-06  1.5568736102E-07  4.1170420298E-05 -7.8909368831E-07 -5.5918959122E-05 -8.0857625688E-07

 Tensor_dq(3,ks,j2), prototypical atom
 -3.6013457051E-05 -3.6723287701E-06  7.7700207418E-06  4.6462050122E-06 -1.3702019032E-05 -2.9284524375E-06
  7.7700207418E-06  4.6462050122E-06 -2.8204393733E-05  2.0861916780E-06  3.8331049002E-05 -4.8994272506E-06
 -1.3702019032E-05 -2.9284524375E-06  3.8331049002E-05 -4.8994272506E-06 -6.7981236980E-06  1.6815358482E-06

 Tensor_qq(ke,je,1,1), prototypical atom
  1.5996475595E-04  0.0000000000E+00 -6.8967341474E-05  2.6460699568E-06  1.2285084903E-05 -1.8909886787E-06
 -6.8967341474E-05  2.6460699568E-06 -7.4085002625E-05 -3.1900489962E-06  7.9425836568E-06  9.1658009155E-07
  1.2285084903E-05 -1.8909886787E-06  7.9425836568E-06  9.1658009155E-07 -6.6685057520E-05  3.3089099080E-06

 Tensor_qq(ke,je,2,1), prototypical atom
 -6.8967341474E-05 -2.6460699568E-06  1.2257570764E-04  8.3575026720E-23  5.8989122271E-06  2.4211953693E-06
  1.2257570764E-04  7.3314328020E-23  3.0110490542E-05  4.9131766999E-06  5.8275133912E-06 -9.2185400344E-07
  5.8989122271E-06  2.4211953693E-06  5.8275133912E-06 -9.2185400344E-07  3.8021245837E-05 -2.3970930699E-06

 Tensor_qq(ke,je,3,1), prototypical atom
  1.2285084903E-05  1.8909886787E-06  5.8989122271E-06 -2.4211953693E-06  1.5858562722E-04  3.3430010688E-22
  5.8989122271E-06 -2.4211953693E-06  3.4909566413E-05 -4.2266445661E-06  3.1708564876E-05  3.5455296258E-06
  1.5858562722E-04  5.0145016032E-22  3.1708564876E-05  3.5455296258E-06 -4.3960670978E-05  2.4143426320E-06

 Tensor_qq(ke,je,1,2), prototypical atom
 -6.8967341474E-05 -2.6460699568E-06  1.2257570764E-04  0.0000000000E+00  5.8989122271E-06  2.4211953693E-06
  1.2257570764E-04 -1.0260698700E-23  3.0110490542E-05  4.9131766999E-06  5.8275133912E-06 -9.2185400344E-07
  5.8989122271E-06  2.4211953693E-06  5.8275133912E-06 -9.2185400344E-07  3.8021245837E-05 -2.3970930699E-06

 Tensor_qq(ke,je,2,2), prototypical atom
 -7.4085002625E-05  3.1900489962E-06  3.0110490542E-05 -4.9131766999E-06  3.4909566413E-05  4.2266445661E-06
  3.0110490542E-05 -4.9131766999E-06  2.0473912589E-04  4.6393459474E-38 -4.8552120758E-05  3.5691055747E-06
  3.4909566413E-05  4.2266445661E-06 -4.8552120758E-05  3.5691055747E-06 -1.1100631675E-04 -3.3474139818E-06

 Tensor_qq(ke,je,3,2), prototypical atom
  7.9425836568E-06 -9.1658009155E-07  5.8275133912E-06  9.2185400344E-07  3.1708564876E-05 -3.5455296258E-06
  5.8275133912E-06  9.2185400344E-07 -4.8552120758E-05 -3.5691055747E-06  1.1070126322E-04  1.6312677147E-23
  3.1708564876E-05 -3.5455296258E-06  1.1070126322E-04  0.0000000000E+00  3.8521590909E-05  4.6781373296E-06

 Tensor_qq(ke,je,1,3), prototypical atom
  1.2285084903E-05  1.8909886787E-06  5.8989122271E-06 -2.4211953693E-06  1.5858562722E-04 -5.0145016032E-22
  5.8989122271E-06 -2.4211953693E-06  3.4909566413E-05 -4.2266445661E-06  3.1708564876E-05  3.5455296258E-06
  1.5858562722E-04 -1.6715005344E-22  3.1708564876E-05  3.5455296258E-06 -4.3960670978E-05  2.4143426320E-06

 Tensor_qq(ke,je,2,3), prototypical atom
  7.9425836568E-06 -9.1658009155E-07  5.8275133912E-06  9.2185400344E-07  3.1708564876E-05 -3.5455296258E-06
  5.8275133912E-06  9.2185400344E-07 -4.8552120758E-05 -3.5691055747E-06  1.1070126322E-04  1.6312677147E-23
  3.1708564876E-05 -3.5455296258E-06  1.1070126322E-04  8.3575026720E-23  3.8521590909E-05  4.6781373296E-06

 Tensor_qq(ke,je,3,3), prototypical atom
 -6.6685057520E-05 -3.3089099080E-06  3.8021245837E-05  2.3970930699E-06 -4.3960670978E-05 -2.4143426320E-06
  3.8021245837E-05  2.3970930699E-06 -1.1100631675E-04  3.3474139818E-06  3.8521590909E-05 -4.6781373296E-06
 -4.3960670978E-05 -2.4143426320E-06  3.8521590909E-05 -4.6781373296E-06  1.8792015010E-04  1.6715005344E-22

 Crystal Tensor_dd(ke,ks) (Mbarn)
  4.1282908472E-02  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22 -7.1573261382E-04  0.0000000000E+00
  0.0000000000E+00 -4.2351647363E-22  3.7827102943E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -7.1573261382E-04  0.0000000000E+00  0.0000000000E+00 -1.0587911841E-22  3.3925196421E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  1.2797180476E-03  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22  9.8280679228E-05  0.0000000000E+00
  0.0000000000E+00 -8.4703294725E-22 -5.9268002100E-04  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22
  9.8280679228E-05  0.0000000000E+00  0.0000000000E+00 -2.1175823681E-22 -5.3348046016E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  8.4703294725E-22  9.8060566115E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  9.8060566115E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.6620107130E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  4.6620107130E-05  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22

 Crystal Tensor_qq(ke,je,3,1)
  9.8280679228E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.2686850177E-03  0.0000000000E+00
  0.0000000000E+00 -8.4703294725E-22  2.7927653130E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.2686850177E-03  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22 -3.5168536782E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  8.4703294725E-22  9.8060566115E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  9.8060566115E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.6620107130E-05  0.0000000000E+00
  0.0000000000E+00 -8.4703294725E-22  4.6620107130E-05  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22

 Crystal Tensor_qq(ke,je,2,2)
 -5.9268002100E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  2.7927653130E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.6379130072E-03  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22
  2.7927653130E-04  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22 -8.8805053397E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  2.1175823681E-22  4.6620107130E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  4.6620107130E-05  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22  8.8561010578E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  8.8561010578E-04  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21

 Crystal Tensor_qq(ke,je,1,3)
  9.8280679228E-05  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22  1.2686850177E-03  0.0000000000E+00
  0.0000000000E+00  8.4703294725E-22  2.7927653130E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.2686850177E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -3.5168536782E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  0.0000000000E+00  4.6620107130E-05  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22
  4.6620107130E-05  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22  8.8561010578E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  8.8561010578E-04  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21

 Crystal Tensor_qq(ke,je,3,3)
 -5.3348046016E-04  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22 -3.5168536782E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -8.8805053397E-04  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21
 -3.5168536782E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.5033612008E-03  0.0000000000E+00

 Convertion factor =  78.03532 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -12.200  3.98094E-02  3.97381E-02  3.87984E-02  3.80607E-02  3.73373E-02  3.52803E-02  3.87344E-02
   dip-dip  3.89145E-02  3.83708E-02  3.78271E-02  3.70604E-02  3.62936E-02  3.40928E-02  3.76784E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  8.94925E-04  1.36730E-03  9.71291E-04  1.00029E-03  1.04370E-03  1.18750E-03  1.05599E-03

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -8.90649E-17 -2.21779E-04 -9.73462E-17 -1.57805E-04 -9.88832E-18  2.74921E-04 -2.33788E-18 -3.14836E-04
   dip-dip -8.70318E-17  1.18024E-16 -9.55557E-17  1.12158E-16 -1.02730E-17 -6.40724E-06 -2.39142E-18 -3.76987E-05
   dip-qua  7.39168E-20 -1.28422E-19  7.40834E-20  3.23766E-19 -5.51347E-20 -3.10831E-19 -6.37674E-19  3.34962E-20
   qua-qua -2.10695E-18 -2.21779E-04 -1.86466E-18 -1.57805E-04  4.39822E-19  2.81328E-04  6.91213E-19 -2.77137E-04

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -12.10000 eV

 Vmoy = -20.20001 eV, Vmftabs(up) = -25.36903 eV, Vmftabs(dn) = -25.06439 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -1.721E-05   9.113E-03   1.406E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.338E-05   7.080E-03   1.092E-03
  1 -1    1  1    -8.952E-03   2.707E-01   2.580E-02
  1 -1    1  2     1.008E-03  -3.011E-02  -2.830E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -2.973E-03   9.042E-02   8.676E-03
  1  0    1  1    -7.342E-03   2.226E-01   2.128E-02
  1  0    1  2     8.977E-04  -2.681E-02  -2.520E-03
  1  0    2  1     9.986E-04  -2.924E-02  -2.687E-03
  1  0    2  2    -3.320E-03   1.006E-01   9.609E-03
  1  1    1  1    -6.050E-03   1.840E-01   1.766E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     8.892E-04  -2.604E-02  -2.392E-03
  1  1    2  2    -3.591E-03   1.085E-01   1.034E-02
  2 -2    1  1     4.617E-04  -2.292E-02  -3.693E-03
  2 -2    1  2    -2.705E-06   1.201E-04   1.769E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     4.290E-04  -2.132E-02  -3.439E-03
  2 -1    1  1     4.603E-04  -2.286E-02  -3.683E-03
  2 -1    1  2    -3.312E-06   1.471E-04   2.166E-05
  2 -1    2  1    -2.746E-06   1.213E-04   1.777E-05
  2 -1    2  2     4.303E-04  -2.138E-02  -3.448E-03
  2  0    1  1     4.589E-04  -2.279E-02  -3.674E-03
  2  0    1  2    -3.312E-06   1.470E-04   2.166E-05
  2  0    2  1    -3.363E-06   1.485E-04   2.176E-05
  2  0    2  2     4.316E-04  -2.144E-02  -3.456E-03
  2  1    1  1     4.574E-04  -2.273E-02  -3.664E-03
  2  1    1  2    -2.704E-06   1.200E-04   1.768E-05
  2  1    2  1    -3.363E-06   1.485E-04   2.176E-05
  2  1    2  2     4.329E-04  -2.149E-02  -3.464E-03
  2  2    1  1     4.560E-04  -2.266E-02  -3.655E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -2.745E-06   1.212E-04   1.776E-05
  2  2    2  2     4.341E-04  -2.155E-02  -3.473E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  4.9493028881E-03  3.3430623768E-22  2.5375310957E-04 -1.0083322277E-06 -1.1592497585E-04 -4.0853991286E-06
  2.5375310957E-04  1.0083322277E-06  4.5104359730E-03 -1.8557724117E-38  6.5874495631E-05  1.2030225779E-06
 -1.1592497585E-04  4.0853991286E-06  6.5874495631E-05 -1.2030225779E-06  4.1004066035E-03  3.3430623768E-22

 Tensor_dq(1,ks,j2), prototypical atom
 -1.1103965546E-05  1.6739685298E-06 -1.5460591931E-05 -2.3823312901E-06  8.8107074891E-06 -8.8339075743E-07
 -1.5460591931E-05 -2.3823312901E-06 -3.4598686627E-05 -8.1824157056E-06  7.0772856000E-05  7.0603804209E-06
  8.8107074891E-06 -8.8339075743E-07  7.0772856000E-05  7.0603804209E-06  7.6569481517E-05  6.5126719522E-06

 Tensor_dq(2,ks,j2), prototypical atom
  9.8305600024E-05 -8.5025763611E-07 -4.0341365644E-05  1.4810599896E-06 -3.1413399083E-06  3.3812598968E-07
 -4.0341365644E-05  1.4810599896E-06 -3.8641711560E-05  1.9037398592E-06  3.9698774563E-05 -8.1569890487E-07
 -3.1413399083E-06  3.3812598968E-07  3.9698774563E-05 -8.1569890487E-07 -5.0709113984E-05 -8.4073866307E-07

 Tensor_dq(3,ks,j2), prototypical atom
 -3.4939126483E-05 -6.3435924836E-06  7.6834586036E-06  7.3430439355E-06  2.7135032168E-05 -4.8144214843E-06
  7.6834586036E-06  7.3430439355E-06  2.2607715111E-05  4.0432047386E-06  2.3151003965E-05 -7.4102970685E-06
  2.7135032168E-05 -4.8144214843E-06  2.3151003965E-05 -7.4102970685E-06 -5.4168515647E-05  2.4431633628E-06

 Tensor_qq(ke,je,1,1), prototypical atom
  1.9170941407E-04 -5.0145935651E-22 -9.7290704745E-05  3.4986645747E-06  1.3694693355E-05 -2.9256933879E-06
 -9.7290704745E-05  3.4986645747E-06 -9.2195104556E-05 -4.9205139437E-06  1.0086324473E-05  1.4339689642E-06
  1.3694693355E-05 -2.9256933879E-06  1.0086324473E-05  1.4339689642E-06 -8.0765036970E-05  5.1364690292E-06

 Tensor_qq(ke,je,2,1), prototypical atom
 -9.7290704745E-05 -3.4986645747E-06  1.5328342417E-04  0.0000000000E+00  9.2558194282E-06  3.4915075186E-06
  1.5328342417E-04 -7.3010669708E-23  4.2444636564E-05  7.0412761417E-06  8.4907005765E-06 -1.4313205031E-06
  9.2558194282E-06  3.4915075186E-06  8.4907005765E-06 -1.4313205031E-06  5.3885589866E-05 -3.7654293490E-06

 Tensor_qq(ke,je,3,1), prototypical atom
  1.3694693355E-05  2.9256933879E-06  9.2558194282E-06 -3.4915075186E-06  1.9634813336E-04  3.3430623768E-22
  9.2558194282E-06 -3.4915075186E-06  4.6728661818E-05 -6.4403899982E-06  4.2010726055E-05  5.0842576443E-06
  1.9634813336E-04  5.0145935651E-22  4.2010726055E-05  5.0842576443E-06 -5.9586503937E-05  3.6690171484E-06

 Tensor_qq(ke,je,1,2), prototypical atom
 -9.7290704745E-05 -3.4986645747E-06  1.5328342417E-04 -8.3576559419E-23  9.2558194282E-06  3.4915075186E-06
  1.5328342417E-04 -1.5658722913E-22  4.2444636564E-05  7.0412761417E-06  8.4907005765E-06 -1.4313205031E-06
  9.2558194282E-06  3.4915075186E-06  8.4907005765E-06 -1.4313205031E-06  5.3885589866E-05 -3.7654293490E-06

 Tensor_qq(ke,je,2,2), prototypical atom
 -9.2195104556E-05  4.9205139437E-06  4.2444636564E-05 -7.0412761417E-06  4.6728661818E-05  6.4403899982E-06
  4.2444636564E-05 -7.0412761417E-06  2.5369961898E-04 -1.5774065500E-37 -6.7537781082E-05  4.9040164327E-06
  4.6728661818E-05  6.4403899982E-06 -6.7537781082E-05  4.9040164327E-06 -1.4413089284E-04 -5.1997388734E-06

 Tensor_qq(ke,je,3,2), prototypical atom
  1.0086324473E-05 -1.4339689642E-06  8.4907005765E-06  1.4313205031E-06  4.2010726055E-05 -5.0842576443E-06
  8.4907005765E-06  1.4313205031E-06 -6.7537781082E-05 -4.9040164327E-06  1.3043787153E-04  2.0473862447E-22
  4.2010726055E-05 -5.0842576443E-06  1.3043787153E-04  2.5072967826E-22  5.5360340219E-05  6.6624102627E-06

 Tensor_qq(ke,je,1,3), prototypical atom
  1.3694693355E-05  2.9256933879E-06  9.2558194282E-06 -3.4915075186E-06  1.9634813336E-04  3.3430623768E-22
  9.2558194282E-06 -3.4915075186E-06  4.6728661818E-05 -6.4403899982E-06  4.2010726055E-05  5.0842576443E-06
  1.9634813336E-04 -1.6715311884E-22  4.2010726055E-05  5.0842576443E-06 -5.9586503937E-05  3.6690171484E-06

 Tensor_qq(ke,je,2,3), prototypical atom
  1.0086324473E-05 -1.4339689642E-06  8.4907005765E-06  1.4313205031E-06  4.2010726055E-05 -5.0842576443E-06
  8.4907005765E-06  1.4313205031E-06 -6.7537781082E-05 -4.9040164327E-06  1.3043787153E-04 -4.5991053787E-23
  4.2010726055E-05 -5.0842576443E-06  1.3043787153E-04  8.3576559419E-23  5.5360340219E-05  6.6624102627E-06

 Tensor_qq(ke,je,3,3), prototypical atom
 -8.0765036970E-05 -5.1364690292E-06  5.3885589866E-05  3.7654293490E-06 -5.9586503937E-05 -3.6690171484E-06
  5.3885589866E-05  3.7654293490E-06 -1.4413089284E-04  5.1997388734E-06  5.5360340219E-05 -6.6624102627E-06
 -5.9586503937E-05 -3.6690171484E-06  5.5360340219E-05 -6.6624102627E-06  2.3705449494E-04 -6.6861247535E-22

 Crystal Tensor_dd(ke,ks) (Mbarn)
  3.9594423105E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -9.2739980676E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  3.6083487784E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -9.2739980676E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  3.2803252828E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  1.5336753126E-03  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22  1.0955754684E-04  0.0000000000E+00
  0.0000000000E+00  8.4703294725E-22 -7.3756083645E-04  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22
  1.0955754684E-04  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22 -6.4612029576E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00 -8.4703294725E-22  1.2262673934E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.2262673934E-03  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21  6.7925604612E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  6.7925604612E-05  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22

 Crystal Tensor_qq(ke,je,3,1)
  1.0955754684E-04  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22  1.5707850669E-03  0.0000000000E+00
  0.0000000000E+00 -8.4703294725E-22  3.7382929455E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.5707850669E-03  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21 -4.7669203149E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00 -8.4703294725E-22  1.2262673934E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.2262673934E-03  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21  6.7925604612E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  6.7925604612E-05  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22

 Crystal Tensor_qq(ke,je,2,2)
 -7.3756083645E-04  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21  3.7382929455E-04  0.0000000000E+00
  0.0000000000E+00  1.6940658945E-21  2.0295969519E-03  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21
  3.7382929455E-04  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21 -1.1530471428E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  0.0000000000E+00  6.7925604612E-05  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21
  6.7925604612E-05  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21  1.0435029722E-03  0.0000000000E+00
  0.0000000000E+00 -1.6940658945E-21  1.0435029722E-03  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21

 Crystal Tensor_qq(ke,je,1,3)
  1.0955754684E-04  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22  1.5707850669E-03  0.0000000000E+00
  0.0000000000E+00 -8.4703294725E-22  3.7382929455E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.5707850669E-03  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21 -4.7669203149E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  4.2351647363E-22  6.7925604612E-05  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21
  6.7925604612E-05  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21  1.0435029722E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.0435029722E-03  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21

 Crystal Tensor_qq(ke,je,3,3)
 -6.4612029576E-04  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22 -4.7669203149E-04  0.0000000000E+00
  0.0000000000E+00  8.4703294725E-22 -1.1530471428E-03  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21
 -4.7669203149E-04  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21  1.8964359595E-03  0.0000000000E+00

 Convertion factor =  78.03675 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -12.100  3.87544E-02  3.86079E-02  3.72704E-02  3.66344E-02  3.60123E-02  3.44670E-02  3.74616E-02
   dip-dip  3.76715E-02  3.68775E-02  3.60835E-02  3.54048E-02  3.47262E-02  3.30018E-02  3.61604E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  1.08290E-03  1.73038E-03  1.18687E-03  1.22958E-03  1.28613E-03  1.46524E-03  1.30121E-03

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -6.21581E-17 -3.38596E-04 -7.62007E-17 -2.43054E-04 -5.09724E-18  3.96023E-04 -3.19130E-18 -6.41786E-04
   dip-dip -5.95596E-17  1.12733E-16 -7.35518E-17  1.34741E-16 -5.45088E-18 -3.42769E-05 -3.51005E-18 -2.17493E-04
   dip-qua  2.92824E-20 -4.66485E-19  2.10472E-19 -1.92460E-19 -2.11466E-19  1.35595E-19 -3.05927E-19  6.03196E-20
   qua-qua -2.62783E-18 -3.38596E-04 -2.85937E-18 -2.43054E-04  5.65105E-19  4.30300E-04  6.24669E-19 -4.24293E-04

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -12.00000 eV

 Vmoy = -20.20188 eV, Vmftabs(up) = -25.36923 eV, Vmftabs(dn) = -25.06459 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -1.696E-05   8.981E-03   1.386E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.323E-05   6.999E-03   1.080E-03
  1 -1    1  1    -8.760E-03   2.649E-01   2.525E-02
  1 -1    1  2     9.837E-04  -2.937E-02  -2.761E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -2.924E-03   8.892E-02   8.532E-03
  1  0    1  1    -7.195E-03   2.181E-01   2.086E-02
  1  0    1  2     8.769E-04  -2.618E-02  -2.461E-03
  1  0    2  1     9.744E-04  -2.853E-02  -2.621E-03
  1  0    2  2    -3.263E-03   9.886E-02   9.445E-03
  1  1    1  1    -5.936E-03   1.805E-01   1.732E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     8.686E-04  -2.543E-02  -2.336E-03
  1  1    2  2    -3.529E-03   1.066E-01   1.016E-02
  2 -2    1  1     4.512E-04  -2.240E-02  -3.608E-03
  2 -2    1  2    -2.646E-06   1.175E-04   1.731E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     4.191E-04  -2.083E-02  -3.360E-03
  2 -1    1  1     4.498E-04  -2.233E-02  -3.599E-03
  2 -1    1  2    -3.240E-06   1.439E-04   2.119E-05
  2 -1    2  1    -2.687E-06   1.186E-04   1.739E-05
  2 -1    2  2     4.203E-04  -2.089E-02  -3.368E-03
  2  0    1  1     4.484E-04  -2.227E-02  -3.590E-03
  2  0    1  2    -3.240E-06   1.439E-04   2.119E-05
  2  0    2  1    -3.290E-06   1.453E-04   2.129E-05
  2  0    2  2     4.216E-04  -2.094E-02  -3.376E-03
  2  1    1  1     4.470E-04  -2.221E-02  -3.581E-03
  2  1    1  2    -2.645E-06   1.174E-04   1.730E-05
  2  1    2  1    -3.290E-06   1.453E-04   2.129E-05
  2  1    2  2     4.229E-04  -2.100E-02  -3.384E-03
  2  2    1  1     4.456E-04  -2.215E-02  -3.571E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -2.686E-06   1.186E-04   1.738E-05
  2  2    2  2     4.241E-04  -2.105E-02  -3.392E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  4.8110891363E-03  0.0000000000E+00  2.3370203463E-04 -3.8281028078E-07 -1.7816014269E-04 -1.0709091924E-05
  2.3370203463E-04  3.8281028078E-07  4.3219614774E-03  0.0000000000E+00  5.9628070522E-05  1.8138986935E-06
 -1.7816014269E-04  1.0709091924E-05  5.9628070522E-05 -1.8138986935E-06  4.0320772069E-03  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
 -2.7322780509E-05  3.9396609128E-06 -1.1977030670E-05 -4.3129618339E-06 -6.8045348894E-05 -1.4311777682E-06
 -1.1977030670E-05 -4.3129618339E-06 -6.9620576863E-05 -1.4934567584E-05  4.7473729325E-05  1.1581211312E-05
 -6.8045348894E-05 -1.4311777682E-06  4.7473729325E-05  1.1581211312E-05  1.2863970076E-04  1.1267947969E-05

 Tensor_dq(2,ks,j2), prototypical atom
  7.5933382656E-05 -1.2393194634E-06 -2.9720497858E-05  2.3125298904E-06 -9.4237586435E-06  4.5392161292E-07
 -2.9720497858E-05  2.3125298904E-06 -2.5739155864E-05  2.0154422199E-06  3.8125669385E-05 -7.3929729362E-07
 -9.4237586435E-06  4.5392161292E-07  3.8125669385E-05 -7.3929729362E-07 -4.2357265580E-05 -5.6579298934E-07

 Tensor_dq(3,ks,j2), prototypical atom
 -3.5637948798E-05 -1.1422862434E-05  7.9917833019E-06  1.2327995508E-05  9.1419884777E-05 -8.3400414193E-06
  7.9917833019E-06  1.2327995508E-05  1.0485249780E-04  7.9045272526E-06 -4.5780228056E-07 -1.1883028731E-05
  9.1419884777E-05 -8.3400414193E-06 -4.5780228056E-07 -1.1883028731E-05 -1.3441557948E-04  3.7547840340E-06

 Tensor_qq(ke,je,1,1), prototypical atom
  2.4104750453E-04 -2.0058742108E-21 -1.4247193991E-04  4.8448982825E-06  1.5246978335E-05 -4.8096695240E-06
 -1.4247193991E-04  4.8448982825E-06 -1.2000224889E-04 -8.0872398981E-06  1.2881909264E-05  2.4086271539E-06
  1.5246978335E-05 -4.8096695240E-06  1.2881909264E-05  2.4086271539E-06 -1.0274104039E-04  8.5002856920E-06

 Tensor_qq(ke,je,2,1), prototypical atom
 -1.4247193991E-04 -4.8448982825E-06  2.0175236988E-04  0.0000000000E+00  1.4901768894E-05  5.3592429006E-06
  2.0175236988E-04 -7.5315414910E-23  6.1888522089E-05  1.0756554093E-05  1.3204636526E-05 -2.3812398792E-06
  1.4901768894E-05  5.3592429006E-06  1.3204636526E-05 -2.3812398792E-06  7.9537465150E-05 -6.3163113403E-06

 Tensor_qq(ke,je,3,1), prototypical atom
  1.5246978335E-05  4.8096695240E-06  1.4901768894E-05 -5.3592429006E-06  2.5453352274E-04  6.6862473695E-22
  1.4901768894E-05 -5.3592429006E-06  6.7065511822E-05 -1.0423390116E-05  5.7107131625E-05  7.7389629224E-06
  2.5453352274E-04  1.0029371054E-21  5.7107131625E-05  7.7389629224E-06 -8.5368364522E-05  5.9146699233E-06

 Tensor_qq(ke,je,1,2), prototypical atom
 -1.4247193991E-04 -4.8448982825E-06  2.0175236988E-04  1.6715618424E-22  1.4901768894E-05  5.3592429006E-06
  2.0175236988E-04  9.1840769326E-23  6.1888522089E-05  1.0756554093E-05  1.3204636526E-05 -2.3812398792E-06
  1.4901768894E-05  5.3592429006E-06  1.3204636526E-05 -2.3812398792E-06  7.9537465150E-05 -6.3163113403E-06

 Tensor_qq(ke,je,2,2), prototypical atom
 -1.2000224889E-04  8.0872398981E-06  6.1888522089E-05 -1.0756554093E-05  6.7065511822E-05  1.0423390116E-05
  6.1888522089E-05 -1.0756554093E-05  3.3106144123E-04 -3.1548709556E-37 -9.7375392612E-05  7.0935371946E-06
  6.7065511822E-05  1.0423390116E-05 -9.7375392612E-05  7.0935371946E-06 -1.9726847785E-04 -8.6106072798E-06

 Tensor_qq(ke,je,3,2), prototypical atom
  1.2881909264E-05 -2.4086271539E-06  1.3204636526E-05  2.3812398792E-06  5.7107131625E-05 -7.7389629224E-06
  1.3204636526E-05  2.3812398792E-06 -9.7375392612E-05 -7.0935371946E-06  1.6007712223E-04  1.1193739549E-22
  5.7107131625E-05 -7.7389629224E-06  1.6007712223E-04  1.6715618424E-22  8.2544061695E-05  1.0074429729E-05

 Tensor_qq(ke,je,1,3), prototypical atom
  1.5246978335E-05  4.8096695240E-06  1.4901768894E-05 -5.3592429006E-06  2.5453352274E-04  0.0000000000E+00
  1.4901768894E-05 -5.3592429006E-06  6.7065511822E-05 -1.0423390116E-05  5.7107131625E-05  7.7389629224E-06
  2.5453352274E-04 -6.6862473695E-22  5.7107131625E-05  7.7389629224E-06 -8.5368364522E-05  5.9146699233E-06

 Tensor_qq(ke,je,2,3), prototypical atom
  1.2881909264E-05 -2.4086271539E-06  1.3204636526E-05  2.3812398792E-06  5.7107131625E-05 -7.7389629224E-06
  1.3204636526E-05  2.3812398792E-06 -9.7375392612E-05 -7.0935371946E-06  1.6007712223E-04  1.1193739549E-22
  5.7107131625E-05 -7.7389629224E-06  1.6007712223E-04  1.6715618424E-22  8.2544061695E-05  1.0074429729E-05

 Tensor_qq(ke,je,3,3), prototypical atom
 -1.0274104039E-04 -8.5002856920E-06  7.9537465150E-05  6.3163113403E-06 -8.5368364522E-05 -5.9146699233E-06
  7.9537465150E-05  6.3163113403E-06 -1.9726847785E-04  8.6106072798E-06  8.2544061695E-05 -1.0074429729E-05
 -8.5368364522E-05 -5.9146699233E-06  8.2544061695E-05 -1.0074429729E-05  3.1575519514E-04  0.0000000000E+00

 Crystal Tensor_dd(ke,ks) (Mbarn)
  3.8488713090E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -1.4252811415E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  3.4575691819E-02  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22
 -1.4252811415E-03  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22  3.2256617655E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  1.9283800363E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.2197582668E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -9.6001799113E-04  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22
  1.2197582668E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -8.2192832310E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00 -1.6940658945E-21  1.6140189591E-03  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21
  1.6140189591E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.0563709221E-04  0.0000000000E+00
  0.0000000000E+00 -1.6940658945E-21  1.0563709221E-04  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21

 Crystal Tensor_qq(ke,je,3,1)
  1.2197582668E-04  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21  2.0362681820E-03  0.0000000000E+00
  0.0000000000E+00  1.6940658945E-21  5.3652409458E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  2.0362681820E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -6.8294691617E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00 -1.6940658945E-21  1.6140189591E-03  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21
  1.6140189591E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.0563709221E-04  0.0000000000E+00
  0.0000000000E+00 -1.6940658945E-21  1.0563709221E-04  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21

 Crystal Tensor_qq(ke,je,2,2)
 -9.6001799113E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  5.3652409458E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.6484915298E-03  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21
  5.3652409458E-04  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21 -1.5781478228E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00 -8.4703294725E-22  1.0563709221E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.0563709221E-04  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21  1.2806169778E-03  0.0000000000E+00
  0.0000000000E+00  3.3881317890E-21  1.2806169778E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21

 Crystal Tensor_qq(ke,je,1,3)
  1.2197582668E-04  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21  2.0362681820E-03  0.0000000000E+00
  0.0000000000E+00  1.6940658945E-21  5.3652409458E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  2.0362681820E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -6.8294691617E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  8.4703294725E-22  1.0563709221E-04  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21
  1.0563709221E-04  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21  1.2806169778E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.2806169778E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,3)
 -8.2192832310E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -6.8294691617E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -1.5781478228E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
 -6.8294691617E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  2.5260415611E-03  0.0000000000E+00

 Convertion factor =  78.03818 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -12.000  3.86610E-02  3.82437E-02  3.60998E-02  3.55953E-02  3.51236E-02  3.44251E-02  3.67907E-02
   dip-dip  3.72905E-02  3.59331E-02  3.45757E-02  3.40152E-02  3.34548E-02  3.25331E-02  3.51070E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  1.37050E-03  2.31062E-03  1.52413E-03  1.58004E-03  1.66883E-03  1.89201E-03  1.68371E-03

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -6.29863E-17 -5.49168E-04 -7.89945E-17 -3.98098E-04  1.73879E-17  6.11025E-04 -4.89313E-18 -1.26233E-03
   dip-dip -5.98817E-17  1.18069E-16 -7.56979E-17  1.29442E-16  1.57492E-17 -8.85048E-05 -6.73461E-18 -5.71381E-04
   dip-qua -6.10978E-19 -1.15066E-18 -2.08357E-20 -1.12640E-18  1.30972E-19  6.83849E-19 -3.13340E-19  3.83392E-19
   qua-qua -2.49362E-18 -5.49168E-04 -3.27582E-18 -3.98098E-04  1.50780E-18  6.99529E-04  2.15482E-18 -6.90953E-04

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -11.90000 eV

 Vmoy = -20.20374 eV, Vmftabs(up) = -25.36944 eV, Vmftabs(dn) = -25.06480 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -1.672E-05   8.853E-03   1.366E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.308E-05   6.920E-03   1.068E-03
  1 -1    1  1    -8.575E-03   2.593E-01   2.471E-02
  1 -1    1  2     9.600E-04  -2.866E-02  -2.694E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -2.877E-03   8.748E-02   8.394E-03
  1  0    1  1    -7.052E-03   2.138E-01   2.044E-02
  1  0    1  2     8.567E-04  -2.558E-02  -2.404E-03
  1  0    2  1     9.509E-04  -2.784E-02  -2.557E-03
  1  0    2  2    -3.209E-03   9.720E-02   9.287E-03
  1  1    1  1    -5.826E-03   1.772E-01   1.700E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     8.486E-04  -2.484E-02  -2.282E-03
  1  1    2  2    -3.469E-03   1.048E-01   9.988E-03
  2 -2    1  1     4.412E-04  -2.190E-02  -3.528E-03
  2 -2    1  2    -2.590E-06   1.150E-04   1.695E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     4.096E-04  -2.036E-02  -3.284E-03
  2 -1    1  1     4.398E-04  -2.184E-02  -3.519E-03
  2 -1    1  2    -3.171E-06   1.409E-04   2.075E-05
  2 -1    2  1    -2.630E-06   1.162E-04   1.703E-05
  2 -1    2  2     4.109E-04  -2.042E-02  -3.292E-03
  2  0    1  1     4.384E-04  -2.178E-02  -3.510E-03
  2  0    1  2    -3.171E-06   1.408E-04   2.075E-05
  2  0    2  1    -3.221E-06   1.422E-04   2.085E-05
  2  0    2  2     4.121E-04  -2.047E-02  -3.300E-03
  2  1    1  1     4.370E-04  -2.171E-02  -3.501E-03
  2  1    1  2    -2.589E-06   1.150E-04   1.694E-05
  2  1    2  1    -3.220E-06   1.422E-04   2.085E-05
  2  1    2  2     4.134E-04  -2.053E-02  -3.308E-03
  2  2    1  1     4.357E-04  -2.165E-02  -3.492E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -2.629E-06   1.161E-04   1.702E-05
  2  2    2  2     4.146E-04  -2.058E-02  -3.316E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  4.7873315625E-03  2.6745479942E-21  2.2291310010E-04 -6.3862131149E-08 -3.1651801099E-04 -2.4978789629E-05
  2.2291310010E-04  6.3862131149E-08  4.1636399258E-03  0.0000000000E+00  5.1728159002E-05  1.2633009669E-06
 -3.1651801099E-04  2.4978789629E-05  5.1728159002E-05 -1.2633009669E-06  4.0903477885E-03  2.6745479942E-21

 Tensor_dq(1,ks,j2), prototypical atom
 -5.2590496563E-05  8.9028193621E-06 -5.3360331368E-06 -8.3779312945E-06 -2.0138702797E-04 -2.4974014523E-06
 -5.3360331368E-06 -8.3779312945E-06 -1.3136292148E-04 -2.8932657120E-05  1.5101654437E-05  2.0473139440E-05
 -2.0138702797E-04 -2.4974014523E-06  1.5101654437E-05  2.0473139440E-05  2.2173977885E-04  2.0899737755E-05

 Tensor_dq(2,ks,j2), prototypical atom
  3.8386069496E-05 -1.8731879490E-06 -4.7015371768E-06  3.8400050162E-06 -1.8228201709E-05  2.2099748595E-07
 -4.7015371768E-06  3.8400050162E-06 -4.3951014189E-06  1.3934654564E-06  3.5841843515E-05 -3.1661247307E-07
 -1.8228201709E-05  2.2099748595E-07  3.5841843515E-05 -3.1661247307E-07 -2.6910718244E-05  7.2967685733E-07

 Tensor_dq(3,ks,j2), prototypical atom
 -3.9180947994E-05 -2.1994175925E-05  8.4944923296E-06  2.2437410417E-05  2.0312068337E-04 -1.5483487650E-05
  8.4944923296E-06  2.2437410417E-05  2.5246710902E-04  1.6163930670E-05 -4.2220457993E-05 -2.0533391935E-05
  2.0312068337E-04 -1.5483487650E-05 -4.2220457993E-05 -2.0533391935E-05 -2.8341523552E-04  6.2770576206E-06

 Tensor_qq(ke,je,1,1), prototypical atom
  3.2387516755E-04 -6.6863699854E-22 -2.2044360860E-04  7.1528515671E-06  1.6377802303E-05 -8.5351326719E-06
 -2.2044360860E-04  7.1528515671E-06 -1.6602486828E-04 -1.4419050819E-05  1.6283690497E-05  4.4273336470E-06
  1.6377802303E-05 -8.5351326719E-06  1.6283690497E-05  4.4273336470E-06 -1.4009201684E-04  1.5272059327E-05

 Tensor_qq(ke,je,2,1), prototypical atom
 -2.2044360860E-04 -7.1528515671E-06  2.8482359100E-04  0.0000000000E+00  2.5201280708E-05  8.9074826843E-06
  2.8482359100E-04  2.0730574916E-22  9.4757804300E-05  1.7872380711E-05  2.2374987688E-05 -4.3335143067E-06
  2.5201280708E-05  8.9074826843E-06  2.2374987688E-05 -4.3335143067E-06  1.2467917058E-04 -1.1518053893E-05

 Tensor_qq(ke,je,3,1), prototypical atom
  1.6377802303E-05  8.5351326719E-06  2.5201280708E-05 -8.9074826843E-06  3.5054996312E-04  0.0000000000E+00
  2.5201280708E-05 -8.9074826843E-06  1.0485313784E-04 -1.8193771172E-05  8.0222073583E-05  1.2698646865E-05
  3.5054996312E-04  0.0000000000E+00  8.0222073583E-05  1.2698646865E-05 -1.3130022430E-04  1.0267569091E-05

 Tensor_qq(ke,je,1,2), prototypical atom
 -2.2044360860E-04 -7.1528515671E-06  2.8482359100E-04 -6.6863699854E-22  2.5201280708E-05  8.9074826843E-06
  2.8482359100E-04 -1.2701275011E-22  9.4757804300E-05  1.7872380711E-05  2.2374987688E-05 -4.3335143067E-06
  2.5201280708E-05  8.9074826843E-06  2.2374987688E-05 -4.3335143067E-06  1.2467917058E-04 -1.1518053893E-05

 Tensor_qq(ke,je,2,2), prototypical atom
 -1.6602486828E-04  1.4419050819E-05  9.4757804300E-05 -1.7872380711E-05  1.0485313784E-04  1.8193771172E-05
  9.4757804300E-05 -1.7872380711E-05  4.6308201290E-04 -3.7116809545E-37 -1.4783825415E-04  1.0948833226E-05
  1.0485313784E-04  1.8193771172E-05 -1.4783825415E-04  1.0948833226E-05 -2.8980956078E-04 -1.5479230539E-05

 Tensor_qq(ke,je,3,2), prototypical atom
  1.6283690497E-05 -4.4273336470E-06  2.2374987688E-05  4.3335143067E-06  8.0222073583E-05 -1.2698646865E-05
  2.2374987688E-05  4.3335143067E-06 -1.4783825415E-04 -1.0948833226E-05  2.0781678204E-04  2.1781036649E-22
  8.0222073583E-05 -1.2698646865E-05  2.0781678204E-04  0.0000000000E+00  1.3017312692E-04  1.6455074919E-05

 Tensor_qq(ke,je,1,3), prototypical atom
  1.6377802303E-05  8.5351326719E-06  2.5201280708E-05 -8.9074826843E-06  3.5054996312E-04  0.0000000000E+00
  2.5201280708E-05 -8.9074826843E-06  1.0485313784E-04 -1.8193771172E-05  8.0222073583E-05  1.2698646865E-05
  3.5054996312E-04  0.0000000000E+00  8.0222073583E-05  1.2698646865E-05 -1.3130022430E-04  1.0267569091E-05

 Tensor_qq(ke,je,2,3), prototypical atom
  1.6283690497E-05 -4.4273336470E-06  2.2374987688E-05  4.3335143067E-06  8.0222073583E-05 -1.2698646865E-05
  2.2374987688E-05  4.3335143067E-06 -1.4783825415E-04 -1.0948833226E-05  2.0781678204E-04  5.5212886576E-22
  8.0222073583E-05 -1.2698646865E-05  2.0781678204E-04  3.3431849927E-22  1.3017312692E-04  1.6455074919E-05

 Tensor_qq(ke,je,3,3), prototypical atom
 -1.4009201684E-04 -1.5272059327E-05  1.2467917058E-04  1.1518053893E-05 -1.3130022430E-04 -1.0267569091E-05
  1.2467917058E-04  1.1518053893E-05 -2.8980956078E-04  1.5479230539E-05  1.3017312692E-04 -1.6455074919E-05
 -1.3130022430E-04 -1.0267569091E-05  1.3017312692E-04 -1.6455074919E-05  4.5281951907E-04 -6.6863699854E-22

 Crystal Tensor_dd(ke,ks) (Mbarn)
  3.8298652500E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -2.5321440879E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  3.3309119406E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -2.5321440879E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  3.2722782308E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  2.5910013404E-03  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21  1.3102241843E-04  0.0000000000E+00
  0.0000000000E+00 -1.6940658945E-21 -1.3281989463E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.3102241843E-04  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21 -1.1207361347E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  0.0000000000E+00  2.2785887280E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
  2.2785887280E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.7899990150E-04  0.0000000000E+00
  0.0000000000E+00 -3.3881317890E-21  1.7899990150E-04  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21

 Crystal Tensor_qq(ke,je,3,1)
  1.3102241843E-04  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21  2.8043997049E-03  0.0000000000E+00
  0.0000000000E+00  3.3881317890E-21  8.3882510276E-04  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
  2.8043997049E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21 -1.0504017944E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00 -1.6940658945E-21  2.2785887280E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
  2.2785887280E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.7899990150E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.7899990150E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,2)
 -1.3281989463E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  8.3882510276E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  3.7046561032E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  8.3882510276E-04  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21 -2.3184764862E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  0.0000000000E+00  1.7899990150E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.7899990150E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.6625342563E-03  0.0000000000E+00
  0.0000000000E+00  3.3881317890E-21  1.6625342563E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,3)
  1.3102241843E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  2.8043997049E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  8.3882510276E-04  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
  2.8043997049E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21 -1.0504017944E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  1.6940658945E-21  1.7899990150E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.7899990150E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.6625342563E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.6625342563E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,3)
 -1.1207361347E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -1.0504017944E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -2.3184764862E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -1.0504017944E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  3.6225561525E-03  0.0000000000E+00

 Convertion factor =  78.03961 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -11.900  4.03111E-02  3.92010E-02  3.54056E-02  3.50881E-02  3.48788E-02  3.57710E-02  3.71050E-02
   dip-dip  3.84665E-02  3.58878E-02  3.33091E-02  3.29320E-02  3.25549E-02  3.31767E-02  3.47769E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  1.84460E-03  3.31324E-03  2.09652E-03  2.15609E-03  2.32386E-03  2.59430E-03  2.32815E-03

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -7.63866E-17 -9.61171E-04 -7.69803E-17 -7.04839E-04  1.84227E-17  1.02416E-03  2.75208E-18 -2.54941E-03
   dip-dip -7.06060E-17  1.12359E-16 -7.12485E-17  1.38365E-16  1.49947E-17 -2.04048E-04  5.85890E-19 -1.33272E-03
   dip-qua -3.33846E-19 -2.28353E-18 -4.51714E-19 -2.60305E-18  2.10507E-19  1.95928E-18  4.91521E-19  1.19569E-18
   qua-qua -5.44674E-18 -9.61171E-04 -5.28007E-18 -7.04839E-04  3.21746E-18  1.22821E-03  1.67467E-18 -1.21669E-03

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -11.80000 eV

 Vmoy = -20.20566 eV, Vmftabs(up) = -25.36965 eV, Vmftabs(dn) = -25.06501 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -1.649E-05   8.728E-03   1.347E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.293E-05   6.842E-03   1.056E-03
  1 -1    1  1    -8.394E-03   2.538E-01   2.419E-02
  1 -1    1  2     9.368E-04  -2.796E-02  -2.628E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -2.831E-03   8.609E-02   8.261E-03
  1  0    1  1    -6.914E-03   2.096E-01   2.004E-02
  1  0    1  2     8.370E-04  -2.499E-02  -2.348E-03
  1  0    2  1     9.280E-04  -2.716E-02  -2.494E-03
  1  0    2  2    -3.156E-03   9.560E-02   9.134E-03
  1  1    1  1    -5.718E-03   1.739E-01   1.669E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     8.291E-04  -2.427E-02  -2.229E-03
  1  1    2  2    -3.411E-03   1.031E-01   9.821E-03
  2 -2    1  1     4.316E-04  -2.142E-02  -3.452E-03
  2 -2    1  2    -2.537E-06   1.127E-04   1.660E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     4.007E-04  -1.992E-02  -3.212E-03
  2 -1    1  1     4.303E-04  -2.136E-02  -3.443E-03
  2 -1    1  2    -3.106E-06   1.380E-04   2.033E-05
  2 -1    2  1    -2.576E-06   1.138E-04   1.668E-05
  2 -1    2  2     4.019E-04  -1.997E-02  -3.220E-03
  2  0    1  1     4.289E-04  -2.130E-02  -3.434E-03
  2  0    1  2    -3.106E-06   1.380E-04   2.033E-05
  2  0    2  1    -3.155E-06   1.393E-04   2.043E-05
  2  0    2  2     4.031E-04  -2.002E-02  -3.228E-03
  2  1    1  1     4.276E-04  -2.125E-02  -3.425E-03
  2  1    1  2    -2.535E-06   1.126E-04   1.659E-05
  2  1    2  1    -3.154E-06   1.393E-04   2.043E-05
  2  1    2  2     4.043E-04  -2.008E-02  -3.236E-03
  2  2    1  1     4.262E-04  -2.119E-02  -3.416E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -2.575E-06   1.137E-04   1.668E-05
  2  2    2  2     4.055E-04  -2.013E-02  -3.244E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  4.9864124926E-03  0.0000000000E+00  2.2978598955E-04 -1.5839794032E-06 -6.3155877703E-04 -5.8820136588E-05
  2.2978598955E-04  1.5839794032E-06  4.0448548361E-03 -1.8558745100E-38  4.1791278996E-05 -4.0096418122E-06
 -6.3155877703E-04  5.8820136588E-05  4.1791278996E-05  4.0096418122E-06  4.4197648312E-03  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
 -9.4942932427E-05  2.0610691888E-05  7.2318250042E-06 -1.7646894675E-05 -4.5601502698E-04 -4.8122242630E-06
  7.2318250042E-06 -1.7646894675E-05 -2.5564020615E-04 -6.0689821024E-05 -3.3679584938E-05  3.9676503914E-05
 -4.5601502698E-04 -4.8122242630E-06 -3.3679584938E-05  3.9676503914E-05  4.0647973802E-04  4.2430783175E-05

 Tensor_dq(2,ks,j2), prototypical atom
 -3.6363099254E-05 -3.0320295525E-06  5.6110997960E-05  7.0056360607E-06 -3.1132289191E-05 -1.3913060561E-06
  5.6110997960E-05  7.0056360607E-06  3.7451489685E-05 -1.9471681915E-06  3.1807993302E-05  1.2696531571E-06
 -3.1132289191E-05 -1.3913060561E-06  3.1807993302E-05  1.2696531571E-06  5.9042206653E-06  5.4691642135E-06

 Tensor_dq(3,ks,j2), prototypical atom
 -4.7727058762E-05 -4.6279491530E-05  7.3251458099E-06  4.5167267149E-05  4.1827439319E-04 -3.1272254974E-05
  7.3251458099E-06  4.5167267149E-05  5.4825215371E-04  3.5469782735E-05 -1.2721605836E-04 -3.8818676723E-05
  4.1827439319E-04 -3.1272254974E-05 -1.2721605836E-04 -3.8818676723E-05 -5.9007766038E-04  1.1788736194E-05

 Tensor_qq(ke,je,1,1), prototypical atom
  4.7758698434E-04 -2.6745970405E-21 -3.6928951428E-04  1.1557744475E-05  1.4876970758E-05 -1.6513577349E-05
 -3.6928951428E-04  1.1557744475E-05 -2.4951692239E-04 -2.8348499074E-05  1.9115513508E-05  9.0851733033E-06
  1.4876970758E-05 -1.6513577349E-05  1.9115513508E-05  9.0851733033E-06 -2.1121165669E-04  3.0287349555E-05

 Tensor_qq(ke,je,2,1), prototypical atom
 -3.6928951428E-04 -1.1557744475E-05  4.4317358849E-04 -1.3372985203E-21  4.6064445274E-05  1.6235547817E-05
  4.4317358849E-04 -5.9057904843E-22  1.5516800523E-04  3.2991681973E-05  4.2631193648E-05 -8.8212511713E-06
  4.6064445274E-05  1.6235547817E-05  4.2631193648E-05 -8.8212511713E-06  2.1356907506E-04 -2.3181769893E-05

 Tensor_qq(ke,je,3,1), prototypical atom
  1.4876970758E-05  1.6513577349E-05  4.6064445274E-05 -1.6235547817E-05  5.2244431452E-04  2.6745970405E-21
  4.6064445274E-05 -1.6235547817E-05  1.8115188131E-04 -3.4670397965E-05  1.1767447933E-04  2.2768657663E-05
  5.2244431452E-04  2.6745970405E-21  1.1767447933E-04  2.2768657663E-05 -2.2013675549E-04  1.9474490954E-05

 Tensor_qq(ke,je,1,2), prototypical atom
 -3.6928951428E-04 -1.1557744475E-05  4.4317358849E-04 -2.0059477804E-21  4.6064445274E-05  1.6235547817E-05
  4.4317358849E-04 -1.9278775687E-21  1.5516800523E-04  3.2991681973E-05  4.2631193648E-05 -8.8212511713E-06
  4.6064445274E-05  1.6235547817E-05  4.2631193648E-05 -8.8212511713E-06  2.1356907506E-04 -2.3181769893E-05

 Tensor_qq(ke,je,2,2), prototypical atom
 -2.4951692239E-04  2.8348499074E-05  1.5516800523E-04 -3.2991681973E-05  1.8115188131E-04  3.4670397965E-05
  1.5516800523E-04 -3.2991681973E-05  7.1063212251E-04 -1.7816395296E-36 -2.4151249201E-04  1.8235556171E-05
  1.8115188131E-04  3.4670397965E-05 -2.4151249201E-04  1.8235556171E-05 -4.6760911905E-04 -3.0712902023E-05

 Tensor_qq(ke,je,3,2), prototypical atom
  1.9115513508E-05 -9.0851733033E-06  4.2631193648E-05  8.8212511713E-06  1.1767447933E-04 -2.2768657663E-05
  4.2631193648E-05  8.8212511713E-06 -2.4151249201E-04 -1.8235556171E-05  2.9223060623E-04  7.8231650378E-22
  1.1767447933E-04 -2.2768657663E-05  2.9223060623E-04  6.6864926014E-22  2.2287926535E-04  2.9537720696E-05

 Tensor_qq(ke,je,1,3), prototypical atom
  1.4876970758E-05  1.6513577349E-05  4.6064445274E-05 -1.6235547817E-05  5.2244431452E-04 -1.3372985203E-21
  4.6064445274E-05 -1.6235547817E-05  1.8115188131E-04 -3.4670397965E-05  1.1767447933E-04  2.2768657663E-05
  5.2244431452E-04 -1.3372985203E-21  1.1767447933E-04  2.2768657663E-05 -2.2013675549E-04  1.9474490954E-05

 Tensor_qq(ke,je,2,3), prototypical atom
  1.9115513508E-05 -9.0851733033E-06  4.2631193648E-05  8.8212511713E-06  1.1767447933E-04 -2.2768657663E-05
  4.2631193648E-05  8.8212511713E-06 -2.4151249201E-04 -1.8235556171E-05  2.9223060623E-04  7.8231650378E-22
  1.1767447933E-04 -2.2768657663E-05  2.9223060623E-04  6.6864926014E-22  2.2287926535E-04  2.9537720696E-05

 Tensor_qq(ke,je,3,3), prototypical atom
 -2.1121165669E-04 -3.0287349555E-05  2.1356907506E-04  2.3181769893E-05 -2.2013675549E-04 -1.9474490954E-05
  2.1356907506E-04  2.3181769893E-05 -4.6760911905E-04  3.0712902023E-05  2.2287926535E-04 -2.9537720696E-05
 -2.2013675549E-04 -1.9474490954E-05  2.2287926535E-04 -2.9537720696E-05  7.1748944784E-04  1.3372985203E-21

 Crystal Tensor_dd(ke,ks) (Mbarn)
  3.9891299941E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -5.0524702163E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  3.2358838689E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -5.0524702163E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  3.5358118650E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  3.8206958747E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21  1.1901576607E-04  0.0000000000E+00
  0.0000000000E+00 -3.3881317890E-21 -1.9961353791E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.1901576607E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -1.6896932535E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  0.0000000000E+00  3.5453887079E-03  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21
  3.5453887079E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  3.4104954918E-04  0.0000000000E+00
  0.0000000000E+00  6.7762635780E-21  3.4104954918E-04  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21

 Crystal Tensor_qq(ke,je,3,1)
  1.1901576607E-04  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21  4.1795545162E-03  0.0000000000E+00
  0.0000000000E+00 -6.7762635780E-21  1.4492150505E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  4.1795545162E-03  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21 -1.7610940439E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  0.0000000000E+00  3.5453887079E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.5453887079E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  3.4104954918E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  3.4104954918E-04  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21

 Crystal Tensor_qq(ke,je,2,2)
 -1.9961353791E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.4492150505E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  5.6850569801E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.4492150505E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -3.7408729524E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  0.0000000000E+00  3.4104954918E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.4104954918E-04  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21  2.3378448498E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.3378448498E-03  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21

 Crystal Tensor_qq(ke,je,1,3)
  1.1901576607E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.1795545162E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.4492150505E-03  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21
  4.1795545162E-03  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21 -1.7610940439E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  0.0000000000E+00  3.4104954918E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.4104954918E-04  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21  2.3378448498E-03  0.0000000000E+00
  0.0000000000E+00 -6.7762635780E-21  2.3378448498E-03  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21

 Crystal Tensor_qq(ke,je,3,3)
 -1.6896932535E-03  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21 -1.7610940439E-03  0.0000000000E+00
  0.0000000000E+00  6.7762635780E-21 -3.7408729524E-03  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21
 -1.7610940439E-03  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21  5.7399155827E-03  0.0000000000E+00

 Convertion factor =  78.04104 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -11.800  4.56853E-02  4.28827E-02  3.55377E-02  3.55092E-02  3.58337E-02  4.00684E-02  3.93935E-02
   dip-dip  4.29809E-02  3.76699E-02  3.23588E-02  3.23137E-02  3.22685E-02  3.62190E-02  3.58694E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  2.70440E-03  5.21281E-03  3.17884E-03  3.19556E-03  3.56519E-03  3.84937E-03  3.52405E-03

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -7.22664E-17 -1.84047E-03 -1.21397E-16 -1.36627E-03  3.83947E-18  1.88618E-03 -1.20949E-17 -5.48720E-03
   dip-dip -6.45584E-17  1.05964E-16 -1.11680E-16  1.52171E-16 -4.46090E-19 -4.75351E-04 -1.73248E-17 -3.13597E-03
   dip-qua -1.82303E-18 -4.23464E-18 -1.13647E-18 -5.59933E-18  2.22356E-18  4.21035E-18  1.90231E-18  2.55280E-18
   qua-qua -5.88499E-18 -1.84047E-03 -8.58012E-18 -1.36627E-03  2.06200E-18  2.36153E-03  3.32757E-18 -2.35123E-03

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -11.70000 eV

 Vmoy = -20.20757 eV, Vmftabs(up) = -25.36986 eV, Vmftabs(dn) = -25.06521 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -1.626E-05   8.608E-03   1.328E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.279E-05   6.767E-03   1.044E-03
  1 -1    1  1    -8.220E-03   2.485E-01   2.369E-02
  1 -1    1  2     9.144E-04  -2.729E-02  -2.565E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -2.787E-03   8.475E-02   8.132E-03
  1  0    1  1    -6.780E-03   2.055E-01   1.965E-02
  1  0    1  2     8.180E-04  -2.441E-02  -2.294E-03
  1  0    2  1     9.058E-04  -2.651E-02  -2.434E-03
  1  0    2  2    -3.105E-03   9.405E-02   8.986E-03
  1  1    1  1    -5.615E-03   1.708E-01   1.638E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     8.103E-04  -2.371E-02  -2.178E-03
  1  1    2  2    -3.356E-03   1.014E-01   9.660E-03
  2 -2    1  1     4.226E-04  -2.097E-02  -3.379E-03
  2 -2    1  2    -2.486E-06   1.104E-04   1.627E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     3.922E-04  -1.949E-02  -3.144E-03
  2 -1    1  1     4.212E-04  -2.092E-02  -3.371E-03
  2 -1    1  2    -3.044E-06   1.352E-04   1.993E-05
  2 -1    2  1    -2.525E-06   1.115E-04   1.635E-05
  2 -1    2  2     3.934E-04  -1.955E-02  -3.152E-03
  2  0    1  1     4.199E-04  -2.086E-02  -3.362E-03
  2  0    1  2    -3.044E-06   1.352E-04   1.993E-05
  2  0    2  1    -3.092E-06   1.366E-04   2.003E-05
  2  0    2  2     3.945E-04  -1.960E-02  -3.159E-03
  2  1    1  1     4.186E-04  -2.080E-02  -3.353E-03
  2  1    1  2    -2.485E-06   1.104E-04   1.627E-05
  2  1    2  1    -3.091E-06   1.366E-04   2.002E-05
  2  1    2  2     3.957E-04  -1.965E-02  -3.167E-03
  2  2    1  1     4.173E-04  -2.074E-02  -3.345E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -2.524E-06   1.115E-04   1.635E-05
  2  2    2  2     3.969E-04  -1.970E-02  -3.175E-03

 iapr =  1, Z = 23, lmax = 2

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  5.6799956035E-03 -1.0698584348E-20  2.7435688754E-04 -1.0400756447E-05 -1.3669470798E-03 -1.4328907288E-04
  2.7435688754E-04  1.0400756447E-05  4.0030782988E-03 -1.4847268342E-37  3.1114424966E-05 -2.6490918632E-05
 -1.3669470798E-03  1.4328907288E-04  3.1114424966E-05  2.6490918632E-05  5.3918997500E-03 -1.0698584348E-20

 Tensor_dq(1,ks,j2), prototypical atom
 -1.7099286302E-04  4.7402948932E-05  3.0569816642E-05 -3.7796414410E-05 -9.7966920467E-04 -9.9486723590E-06
  3.0569816642E-05 -3.7796414410E-05 -5.2174786418E-04 -1.3498963888E-04 -1.1687242764E-04  8.3101169097E-05
 -9.7966920467E-04 -9.9486723590E-06 -1.1687242764E-04  8.3101169097E-05  7.9637671436E-04  9.3885728166E-05

 Tensor_dq(2,ks,j2), prototypical atom
 -2.1165616933E-04 -5.5743042455E-06  2.1602868916E-04  1.4638431021E-05 -4.8871928497E-05 -7.5386333754E-06
  2.1602868916E-04  1.4638431021E-05  1.3424140062E-04 -1.4375198690E-05  2.5039245763E-05  6.7247939535E-06
 -4.8871928497E-05 -7.5386333754E-06  2.5039245763E-05  6.7247939535E-06  8.5763160647E-05  2.1493546227E-05

 Tensor_dq(3,ks,j2), prototypical atom
 -6.3198478191E-05 -1.0409046349E-04 -7.0454488526E-06  9.8453203676E-05  8.6010662160E-04 -6.7357103401E-05
 -7.0454488526E-06  9.8453203676E-05  1.1911164904E-03  8.1958800250E-05 -3.2249671439E-04 -7.8933135519E-05
  8.6010662160E-04 -6.7357103401E-05 -3.2249671439E-04 -7.8933135519E-05 -1.2738838822E-03  2.4532899229E-05

 Tensor_qq(ke,je,1,1), prototypical atom
  7.9657895283E-04  5.3492921738E-21 -6.8719124646E-04  2.0960495253E-05  2.9059873513E-06 -3.3142508163E-05
 -6.8719124646E-04  2.0960495253E-05 -4.1556517990E-04 -5.9757975418E-05  1.4545463458E-05  2.0471030470E-05
  2.9059873513E-06 -3.3142508163E-05  1.4545463458E-05  2.0471030470E-05 -3.6622820613E-04  6.4455697069E-05

 Tensor_qq(ke,je,2,1), prototypical atom
 -6.8719124646E-04 -2.0960495253E-05  7.8356265373E-04  0.0000000000E+00  9.3792289766E-05  3.0994442782E-05
  7.8356265373E-04  2.5668355666E-21  2.7501208384E-04  6.6540354061E-05  9.4929952582E-05 -1.9806322623E-05
  9.3792289766E-05  3.0994442782E-05  9.4929952582E-05 -1.9806322623E-05  4.1363846813E-04 -4.9687784061E-05

 Tensor_qq(ke,je,3,1), prototypical atom
  2.9059873513E-06  3.3142508163E-05  9.3792289766E-05 -3.0994442782E-05  8.5104906782E-04  5.3492921738E-21
  9.3792289766E-05 -3.0994442782E-05  3.3817818921E-04 -7.0010168215E-05  1.8539691341E-04  4.3647771309E-05
  8.5104906782E-04  2.6746460869E-21  1.8539691341E-04  4.3647771309E-05 -3.9549545404E-04  3.9912263810E-05

 Tensor_qq(ke,je,1,2), prototypical atom
 -6.8719124646E-04 -2.0960495253E-05  7.8356265373E-04 -4.0119691304E-21  9.3792289766E-05  3.0994442782E-05
  7.8356265373E-04 -1.4451335637E-21  2.7501208384E-04  6.6540354061E-05  9.4929952582E-05 -1.9806322623E-05
  9.3792289766E-05  3.0994442782E-05  9.4929952582E-05 -1.9806322623E-05  4.1363846813E-04 -4.9687784061E-05

 Tensor_qq(ke,je,2,2), prototypical atom
 -4.1556517990E-04  5.9757975418E-05  2.7501208384E-04 -6.6540354061E-05  3.3817818921E-04  7.0010168215E-05
  2.7501208384E-04 -6.6540354061E-05  1.2133553352E-03 -1.1877814674E-36 -4.3271103630E-04  3.2070351477E-05
  3.3817818921E-04  7.0010168215E-05 -4.3271103630E-04  3.2070351477E-05 -8.3603414995E-04 -6.5422381413E-05

 Tensor_qq(ke,je,3,2), prototypical atom
  1.4545463458E-05 -2.0471030470E-05  9.4929952582E-05  1.9806322623E-05  1.8539691341E-04 -4.3647771309E-05
  9.4929952582E-05  1.9806322623E-05 -4.3271103630E-04 -3.2070351477E-05  4.5934880377E-04 -1.3414814098E-21
  1.8539691341E-04 -4.3647771309E-05  4.5934880377E-04  2.6746460869E-21  4.2446851944E-04  5.7449835549E-05

 Tensor_qq(ke,je,1,3), prototypical atom
  2.9059873513E-06  3.3142508163E-05  9.3792289766E-05 -3.0994442782E-05  8.5104906782E-04  0.0000000000E+00
  9.3792289766E-05 -3.0994442782E-05  3.3817818921E-04 -7.0010168215E-05  1.8539691341E-04  4.3647771309E-05
  8.5104906782E-04 -2.6746460869E-21  1.8539691341E-04  4.3647771309E-05 -3.9549545404E-04  3.9912263810E-05

 Tensor_qq(ke,je,2,3), prototypical atom
  1.4545463458E-05 -2.0471030470E-05  9.4929952582E-05  1.9806322623E-05  1.8539691341E-04 -4.3647771309E-05
  9.4929952582E-05  1.9806322623E-05 -4.3271103630E-04 -3.2070351477E-05  4.5934880377E-04  1.3331646771E-21
  1.8539691341E-04 -4.3647771309E-05  4.5934880377E-04  4.0119691304E-21  4.2446851944E-04  5.7449835549E-05

 Tensor_qq(ke,je,3,3), prototypical atom
 -3.6622820613E-04 -6.4455697069E-05  4.1363846813E-04  4.9687784061E-05 -3.9549545404E-04 -3.9912263810E-05
  4.1363846813E-04  4.9687784061E-05 -8.3603414995E-04  6.5422381413E-05  4.2446851944E-04 -5.7449835549E-05
 -3.9549545404E-04 -3.9912263810E-05  4.2446851944E-04 -5.7449835549E-05  1.2783204772E-03  0.0000000000E+00

 Crystal Tensor_dd(ke,ks) (Mbarn)
  4.5439964828E-02  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21 -1.0935576638E-02  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  3.2024626390E-02  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21
 -1.0935576638E-02  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21  4.3135198000E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  6.3726316226E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  2.3247898811E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -3.3245214392E-03  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21
  2.3247898811E-05  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21 -2.9298256490E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00 -6.7762635780E-21  6.2685012298E-03  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20
  6.2685012298E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  7.5943962066E-04  0.0000000000E+00
  0.0000000000E+00  1.3552527156E-20  7.5943962066E-04  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20

 Crystal Tensor_qq(ke,je,3,1)
  2.3247898811E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  6.8083925426E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.7054255136E-03  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20
  6.8083925426E-03  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20 -3.1639636323E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  0.0000000000E+00  6.2685012298E-03  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20
  6.2685012298E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  7.5943962066E-04  0.0000000000E+00
  0.0000000000E+00  1.3552527156E-20  7.5943962066E-04  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20

 Crystal Tensor_qq(ke,je,2,2)
 -3.3245214392E-03  0.0000000000E+00  0.0000000000E+00 -2.7105054312E-20  2.7054255136E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  9.7068426812E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  2.7054255136E-03  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20 -6.6882731996E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  6.7762635780E-21  7.5943962066E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  7.5943962066E-04  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20  3.6747904302E-03  0.0000000000E+00
  0.0000000000E+00 -1.3552527156E-20  3.6747904302E-03  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20

 Crystal Tensor_qq(ke,je,1,3)
  2.3247898811E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  6.8083925426E-03  0.0000000000E+00
  0.0000000000E+00 -1.3552527156E-20  2.7054255136E-03  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20
  6.8083925426E-03  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20 -3.1639636323E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  6.7762635780E-21  7.5943962066E-04  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20
  7.5943962066E-04  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20  3.6747904302E-03  0.0000000000E+00
  0.0000000000E+00 -1.3552527156E-20  3.6747904302E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,3)
 -2.9298256490E-03  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20 -3.1639636323E-03  0.0000000000E+00
  0.0000000000E+00 -1.3552527156E-20 -6.6882731996E-03  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20
 -3.1639636323E-03  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20  1.0226563818E-02  0.0000000000E+00

 Convertion factor =  78.04247 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -11.700  5.96995E-02  5.27018E-02  3.75323E-02  3.79425E-02  3.94747E-02  5.12071E-02  4.61668E-02
   dip-dip  5.52639E-02  4.36443E-02  3.20246E-02  3.26679E-02  3.33113E-02  4.49475E-02  4.01999E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  4.43559E-03  9.05758E-03  5.50770E-03  5.27451E-03  6.16345E-03  6.25965E-03  5.96691E-03

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -9.39086E-17 -3.76579E-03 -1.25126E-16 -2.79482E-03  1.36439E-17  3.69903E-03  1.23001E-17 -1.25025E-02
   dip-dip -7.85563E-17  1.25409E-16 -1.04396E-16  1.88534E-16  2.74303E-18 -1.14611E-03  2.55891E-18 -7.63172E-03
   dip-qua -2.08038E-18 -1.07418E-17 -5.57094E-18 -1.15075E-17  3.53535E-18  1.20756E-17  3.84849E-18  7.47628E-18
   qua-qua -1.32719E-17 -3.76579E-03 -1.51591E-17 -2.79482E-03  7.36556E-18  4.84514E-03  5.89272E-18 -4.87077E-03

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -11.60000 eV

 Vmoy = -20.20952 eV, Vmftabs(up) = -25.37006 eV, Vmftabs(dn) = -25.06541 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -1.604E-05   8.490E-03   1.310E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.265E-05   6.694E-03   1.033E-03
  1 -1    1  1    -8.051E-03   2.434E-01   2.320E-02
  1 -1    1  2     8.927E-04  -2.664E-02  -2.503E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -2.744E-03   8.345E-02   8.007E-03
  1  0    1  1    -6.650E-03   2.016E-01   1.927E-02
  1  0    1  2     7.995E-04  -2.386E-02  -2.242E-03
  1  0    2  1     8.844E-04  -2.588E-02  -2.376E-03
  1  0    2  2    -3.055E-03   9.256E-02   8.843E-03
  1  1    1  1    -5.514E-03   1.677E-01   1.609E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     7.920E-04  -2.318E-02  -2.128E-03
  1  1    2  2    -3.302E-03   9.976E-02   9.505E-03
  2 -2    1  1     4.139E-04  -2.055E-02  -3.310E-03
  2 -2    1  2    -2.438E-06   1.083E-04   1.596E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     3.840E-04  -1.909E-02  -3.079E-03
  2 -1    1  1     4.126E-04  -2.049E-02  -3.302E-03
  2 -1    1  2    -2.985E-06   1.326E-04   1.955E-05
  2 -1    2  1    -2.476E-06   1.094E-04   1.604E-05
  2 -1    2  2     3.852E-04  -1.914E-02  -3.086E-03
  2  0    1  1     4.113E-04  -2.043E-02  -3.293E-03
  2  0    1  2    -2.985E-06   1.326E-04   1.954E-05
  2  0    2  1    -3.032E-06   1.340E-04   1.965E-05
  2  0    2  2     3.864E-04  -1.919E-02  -3.094E-03
  2  1    1  1     4.100E-04  -2.037E-02  -3.285E-03
  2  1    1  2    -2.437E-06   1.083E-04   1.596E-05
  2  1    2  1    -3.032E-06   1.339E-04   1.964E-05
  2  1    2  2     3.875E-04  -1.924E-02  -3.101E-03
  2  2    1  1     4.087E-04  -2.031E-02  -3.276E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -2.475E-06   1.093E-04   1.604E-05
  2  2    2  2     3.887E-04  -1.929E-02  -3.109E-03

 iapr =  1, Z = 23, lmax = 3

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  7.3372984505E-03  2.1397561066E-20  4.0030341253E-04 -2.6128322233E-05 -2.8227930959E-03 -3.0212326784E-04
  4.0030341253E-04  2.6128322233E-05  4.1407007278E-03  0.0000000000E+00  3.4136584630E-05 -8.0093810098E-05
 -2.8227930959E-03  3.0212326784E-04  3.4136584630E-05  8.0093810098E-05  7.5258727358E-03  2.1397561066E-20

 Tensor_dq(1,ks,j2), prototypical atom
 -2.9468297451E-04  6.7550594469E-05  4.0312752446E-05 -4.4987507477E-05 -2.0283027962E-03 -1.6116092293E-05
  4.0312752446E-05 -4.4987507477E-05 -9.5391108024E-04 -2.4903051188E-04 -3.4404601884E-04  1.5586748770E-04
 -2.0283027962E-03 -1.6116092293E-05 -3.4404601884E-04  1.5586748770E-04  1.4612331747E-03  1.9670616451E-04

 Tensor_dq(2,ks,j2), prototypical atom
 -6.6192392126E-04 -1.2155631206E-05  6.4880665323E-04  3.4061016230E-05 -6.9582364051E-05 -1.7103043491E-05
  6.4880665323E-04  3.4061016230E-05  3.8984021108E-04 -3.8817004124E-05  8.0027042697E-06  1.8983741266E-05
 -6.9582364051E-05 -1.7103043491E-05  8.0027042697E-06  1.8983741266E-05  2.8527330555E-04  5.5185866191E-05

 Tensor_dq(3,ks,j2), prototypical atom
 -6.6527492027E-05 -1.8505989698E-04 -9.0422122191E-05  1.7187570672E-04  1.6397491817E-03 -1.2608920991E-04
 -9.0422122191E-05  1.7187570672E-04  2.4483646190E-03  1.5219509703E-04 -7.5284247343E-04 -1.4277242323E-04
  1.6397491817E-03 -1.2608920991E-04 -7.5284247343E-04 -1.4277242323E-04 -2.6627565644E-03  3.7908842160E-05

 Tensor_qq(ke,je,1,1), prototypical atom
  1.4829936932E-03  8.0240853999E-21 -1.3934364259E-03  3.9729772984E-05 -4.1844989881E-05 -4.4944504730E-05
 -1.3934364259E-03  3.9729772984E-05 -7.4821552566E-04 -9.6513484239E-05 -2.5854652223E-05  3.7379791852E-05
 -4.1844989881E-05 -4.4944504730E-05 -2.5854652223E-05  3.7379791852E-05 -7.2627918445E-04  1.0522518248E-04

 Tensor_qq(ke,je,2,1), prototypical atom
 -1.3934364259E-03 -3.9729772984E-05  1.5570780528E-03  0.0000000000E+00  2.1905564715E-04  4.0370290965E-05
  1.5570780528E-03 -4.8405702333E-22  5.0604499295E-04  1.0897550919E-04  2.4842820430E-04 -3.6117472423E-05
  2.1905564715E-04  4.0370290965E-05  2.4842820430E-04 -3.6117472423E-05  8.9652243012E-04 -7.6500413827E-05

 Tensor_qq(ke,je,3,1), prototypical atom
 -4.1844989881E-05  4.4944504730E-05  2.1905564715E-04 -4.0370290965E-05  1.4638137004E-03  0.0000000000E+00
  2.1905564715E-04 -4.0370290965E-05  5.6717205203E-04 -1.1516484084E-04  3.6012517348E-04  7.2753064557E-05
  1.4638137004E-03 -5.3493902666E-21  3.6012517348E-04  7.2753064557E-05 -6.4124231487E-04  7.6855138665E-05

 Tensor_qq(ke,je,1,2), prototypical atom
 -1.3934364259E-03 -3.9729772984E-05  1.5570780528E-03 -2.6746951333E-21  2.1905564715E-04  4.0370290965E-05
  1.5570780528E-03 -4.8405702333E-22  5.0604499295E-04  1.0897550919E-04  2.4842820430E-04 -3.6117472423E-05
  2.1905564715E-04  4.0370290965E-05  2.4842820430E-04 -3.6117472423E-05  8.9652243012E-04 -7.6500413827E-05

 Tensor_qq(ke,je,2,2), prototypical atom
 -7.4821552566E-04  9.6513484239E-05  5.0604499295E-04 -1.0897550919E-04  5.6717205203E-04  1.1516484084E-04
  5.0604499295E-04 -1.0897550919E-04  2.1721275918E-03  2.9695081208E-37 -8.2554759129E-04  5.1389431766E-05
  5.6717205203E-04  1.1516484084E-04 -8.2554759129E-04  5.1389431766E-05 -1.5297318019E-03 -1.0773298861E-04

 Tensor_qq(ke,je,3,2), prototypical atom
 -2.5854652223E-05 -3.7379791852E-05  2.4842820430E-04  3.6117472423E-05  3.6012517348E-04 -7.2753064557E-05
  2.4842820430E-04  3.6117472423E-05 -8.2554759129E-04 -5.1389431766E-05  8.2445762232E-04  8.8530111180E-22
  3.6012517348E-04 -7.2753064557E-05  8.2445762232E-04  5.3493902666E-21  8.7256025546E-04  9.8723261113E-05

 Tensor_qq(ke,je,1,3), prototypical atom
 -4.1844989881E-05  4.4944504730E-05  2.1905564715E-04 -4.0370290965E-05  1.4638137004E-03  5.3493902666E-21
  2.1905564715E-04 -4.0370290965E-05  5.6717205203E-04 -1.1516484084E-04  3.6012517348E-04  7.2753064557E-05
  1.4638137004E-03  8.0240853999E-21  3.6012517348E-04  7.2753064557E-05 -6.4124231487E-04  7.6855138665E-05

 Tensor_qq(ke,je,2,3), prototypical atom
 -2.5854652223E-05 -3.7379791852E-05  2.4842820430E-04  3.6117472423E-05  3.6012517348E-04 -7.2753064557E-05
  2.4842820430E-04  3.6117472423E-05 -8.2554759129E-04 -5.1389431766E-05  8.2445762232E-04  8.8530111180E-22
  3.6012517348E-04 -7.2753064557E-05  8.2445762232E-04  5.3493902666E-21  8.7256025546E-04  9.8723261113E-05

 Tensor_qq(ke,je,3,3), prototypical atom
 -7.2627918445E-04 -1.0522518248E-04  8.9652243012E-04  7.6500413827E-05 -6.4124231487E-04 -7.6855138665E-05
  8.9652243012E-04  7.6500413827E-05 -1.5297318019E-03  1.0773298861E-04  8.7256025546E-04 -9.8723261113E-05
 -6.4124231487E-04 -7.6855138665E-05  8.7256025546E-04 -9.8723261113E-05  2.4150945244E-03 -2.1397561066E-20

 Crystal Tensor_dd(ke,ks) (Mbarn)
  5.8698387604E-02  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21 -2.2582344767E-02  0.0000000000E+00
  0.0000000000E+00 -6.7762635780E-21  3.3125605823E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -2.2582344767E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  6.0206981886E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  1.1863949546E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -3.3475991905E-04  0.0000000000E+00
  0.0000000000E+00  1.3552527156E-20 -5.9857242053E-03  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20
 -3.3475991905E-04  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20 -5.8102334756E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  0.0000000000E+00  1.2456624422E-02  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20
  1.2456624422E-02  0.0000000000E+00  0.0000000000E+00 -2.7105054312E-20  1.9874256344E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.9874256344E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,1)
 -3.3475991905E-04  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20  1.1710509603E-02  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  4.5373764163E-03  0.0000000000E+00  0.0000000000E+00  2.7105054312E-20
  1.1710509603E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -5.1299385189E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  0.0000000000E+00  1.2456624422E-02  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20
  1.2456624422E-02  0.0000000000E+00  0.0000000000E+00 -2.7105054312E-20  1.9874256344E-03  0.0000000000E+00
  0.0000000000E+00  1.3552527156E-20  1.9874256344E-03  0.0000000000E+00  0.0000000000E+00 -2.7105054312E-20

 Crystal Tensor_qq(ke,je,2,2)
 -5.9857242053E-03  0.0000000000E+00  0.0000000000E+00  2.7105054312E-20  4.5373764163E-03  0.0000000000E+00
  0.0000000000E+00  2.7105054312E-20  1.7377020735E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  4.5373764163E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -1.2237854415E-02  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  0.0000000000E+00  1.9874256344E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.9874256344E-03  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20  6.5956609786E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  6.5956609786E-03  0.0000000000E+00  0.0000000000E+00 -2.7105054312E-20

 Crystal Tensor_qq(ke,je,1,3)
 -3.3475991905E-04  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20  1.1710509603E-02  0.0000000000E+00
  0.0000000000E+00  1.3552527156E-20  4.5373764163E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.1710509603E-02  0.0000000000E+00  0.0000000000E+00  2.7105054312E-20 -5.1299385189E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  0.0000000000E+00  1.9874256344E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.9874256344E-03  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20  6.5956609786E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  6.5956609786E-03  0.0000000000E+00  0.0000000000E+00 -2.7105054312E-20

 Crystal Tensor_qq(ke,je,3,3)
 -5.8102334756E-03  0.0000000000E+00  0.0000000000E+00  2.7105054312E-20 -5.1299385189E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -1.2237854415E-02  0.0000000000E+00  0.0000000000E+00  2.7105054312E-20
 -5.1299385189E-03  0.0000000000E+00  0.0000000000E+00  2.7105054312E-20  1.9320756195E-02  0.0000000000E+00

 Convertion factor =  78.04390 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -11.600  8.96514E-02  7.33899E-02  4.41307E-02  4.48873E-02  4.88068E-02  7.48130E-02  6.16693E-02
   dip-dip  8.16042E-02  5.73649E-02  3.31256E-02  3.52134E-02  3.73011E-02  6.39069E-02  5.06770E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  8.04718E-03  1.60250E-02  1.10051E-02  9.67392E-03  1.15056E-02  1.09062E-02  1.09923E-02

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -1.06420E-16 -6.51580E-03 -1.55471E-16 -4.26916E-03  2.73610E-17  5.78805E-03  1.66726E-17 -2.44504E-02
   dip-dip -7.04204E-17  1.41066E-16 -1.22845E-16  2.63952E-16  6.53095E-18 -2.39863E-03  4.70028E-18 -1.60839E-02
   dip-qua -1.33408E-17 -1.87371E-17 -8.23260E-18 -2.60628E-17  1.82286E-17  2.30928E-17  3.28560E-18  1.95688E-17
   qua-qua -2.26593E-17 -6.51580E-03 -2.43933E-17 -4.26916E-03  2.60147E-18  8.18668E-03  8.68672E-18 -8.36649E-03

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -11.50000 eV

 Vmoy = -20.21152 eV, Vmftabs(up) = -25.37026 eV, Vmftabs(dn) = -25.06561 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -1.582E-05   8.376E-03   1.292E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.251E-05   6.622E-03   1.022E-03
  1 -1    1  1    -7.887E-03   2.384E-01   2.273E-02
  1 -1    1  2     8.717E-04  -2.601E-02  -2.443E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -2.703E-03   8.220E-02   7.886E-03
  1  0    1  1    -6.524E-03   1.978E-01   1.891E-02
  1  0    1  2     7.816E-04  -2.332E-02  -2.191E-03
  1  0    2  1     8.635E-04  -2.527E-02  -2.319E-03
  1  0    2  2    -3.008E-03   9.111E-02   8.705E-03
  1  1    1  1    -5.417E-03   1.647E-01   1.580E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     7.743E-04  -2.265E-02  -2.080E-03
  1  1    2  2    -3.249E-03   9.818E-02   9.354E-03
  2 -2    1  1     4.057E-04  -2.014E-02  -3.244E-03
  2 -2    1  2    -2.392E-06   1.063E-04   1.567E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     3.763E-04  -1.870E-02  -3.017E-03
  2 -1    1  1     4.044E-04  -2.008E-02  -3.236E-03
  2 -1    1  2    -2.929E-06   1.301E-04   1.918E-05
  2 -1    2  1    -2.430E-06   1.074E-04   1.575E-05
  2 -1    2  2     3.774E-04  -1.875E-02  -3.024E-03
  2  0    1  1     4.031E-04  -2.002E-02  -3.227E-03
  2  0    1  2    -2.928E-06   1.301E-04   1.918E-05
  2  0    2  1    -2.975E-06   1.315E-04   1.928E-05
  2  0    2  2     3.786E-04  -1.880E-02  -3.031E-03
  2  1    1  1     4.019E-04  -1.997E-02  -3.219E-03
  2  1    1  2    -2.391E-06   1.062E-04   1.566E-05
  2  1    2  1    -2.975E-06   1.314E-04   1.928E-05
  2  1    2  2     3.797E-04  -1.886E-02  -3.039E-03
  2  2    1  1     4.006E-04  -1.991E-02  -3.211E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -2.429E-06   1.073E-04   1.574E-05
  2  2    2  2     3.809E-04  -1.891E-02  -3.046E-03

 iapr =  1, Z = 23, lmax = 3

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  9.2484126003E-03 -1.0698976719E-20  6.7086530482E-04  3.5978811741E-05 -3.0545688946E-03 -1.7582694791E-04
  6.7086530482E-04 -3.5978811741E-05  4.5467062153E-03 -2.9695625733E-37  9.2266548284E-05 -1.1302827677E-07
 -3.0545688946E-03  1.7582694791E-04  9.2266548284E-05  1.1302827677E-07  8.1712691850E-03 -1.0698976719E-20

 Tensor_dq(1,ks,j2), prototypical atom
 -5.1058177738E-04 -4.5500155307E-05 -5.2834371353E-05  5.4325442034E-05 -3.0488335723E-03 -4.4703143291E-06
 -5.2834371353E-05  5.4325442034E-05 -2.6683466769E-04 -7.2838725569E-05 -1.2407549589E-03  7.5963089090E-05
 -3.0488335723E-03 -4.4703143291E-06 -1.2407549589E-03  7.5963089090E-05  1.0633624772E-03  1.3149722995E-04

 Tensor_dq(2,ks,j2), prototypical atom
 -1.2089522699E-03 -1.4753929493E-05  1.1617564587E-03  4.1194612165E-05 -1.6373833210E-04  1.4165765816E-05
  1.1617564587E-03  4.1194612165E-05  7.9151931197E-04  1.9657471851E-05 -9.6354586772E-05 -4.3100783355E-06
 -1.6373833210E-04  1.4165765816E-05 -9.6354586772E-05 -4.3100783355E-06  4.3858708749E-04 -5.6002980824E-06

 Tensor_dq(3,ks,j2), prototypical atom
 -9.0874130300E-05 -1.5483312378E-05 -1.3606882588E-04  2.0538520450E-05  1.6354643847E-03 -4.9791889479E-05
 -1.3606882588E-04  2.0538520450E-05  2.7210188717E-03  2.5385477660E-05 -9.3242731598E-04 -7.0901064643E-05
  1.6354643847E-03 -4.9791889479E-05 -9.3242731598E-04 -7.0901064643E-05 -2.9717541477E-03 -8.9765466974E-06

 Tensor_qq(ke,je,1,1), prototypical atom
  1.9774064775E-03  1.3373720898E-21 -1.8858512423E-03  3.6269855471E-05  1.2642269545E-05  1.4374506945E-05
 -1.8858512423E-03  3.6269855471E-05 -1.0746834440E-03  1.8193397622E-05  3.6284281021E-05 -8.6241810999E-06
  1.2642269545E-05  1.4374506945E-05  3.6284281021E-05 -8.6241810999E-06 -9.0344535233E-04 -1.9458555559E-05

 Tensor_qq(ke,je,2,1), prototypical atom
 -1.8858512423E-03 -3.6269855471E-05  2.1226141014E-03  0.0000000000E+00  3.3858813127E-04 -9.1912933867E-06
  2.1226141014E-03  4.2951327673E-22  6.9617729181E-04  3.2451530622E-06  3.5976798057E-04  7.5268484115E-06
  3.3858813127E-04 -9.1912933867E-06  3.5976798057E-04  7.5268484115E-06  1.2056031812E-03  3.4953488268E-05

 Tensor_qq(ke,je,3,1), prototypical atom
  1.2642269545E-05 -1.4374506945E-05  3.3858813127E-04  9.1912933867E-06  1.9701138788E-03  0.0000000000E+00
  3.3858813127E-04  9.1912933867E-06  1.4515006860E-04 -1.5992784206E-05  8.6324307269E-04  2.1972469324E-05
  1.9701138788E-03 -1.3373720898E-21  8.6324307269E-04  2.1972469324E-05 -3.0582033722E-04  3.5496325802E-05

 Tensor_qq(ke,je,1,2), prototypical atom
 -1.8858512423E-03 -3.6269855471E-05  2.1226141014E-03  6.6868604492E-22  3.3858813127E-04 -9.1912933867E-06
  2.1226141014E-03  1.0981993216E-21  6.9617729181E-04  3.2451530622E-06  3.5976798057E-04  7.5268484115E-06
  3.3858813127E-04 -9.1912933867E-06  3.5976798057E-04  7.5268484115E-06  1.2056031812E-03  3.4953488268E-05

 Tensor_qq(ke,je,2,2), prototypical atom
 -1.0746834440E-03 -1.8193397622E-05  6.9617729181E-04 -3.2451530622E-06  1.4515006860E-04  1.5992784206E-05
  6.9617729181E-04 -3.2451530622E-06  2.6185264086E-03  2.9695625733E-37 -1.2067320972E-03  3.5350203345E-05
  1.4515006860E-04  1.5992784206E-05 -1.2067320972E-03  3.5350203345E-05 -1.6581312962E-03  1.6573681698E-05

 Tensor_qq(ke,je,3,2), prototypical atom
  3.6284281021E-05  8.6241810999E-06  3.5976798057E-04 -7.5268484115E-06  8.6324307269E-04 -2.1972469324E-05
  3.5976798057E-04 -7.5268484115E-06 -1.2067320972E-03 -3.5350203345E-05  1.3078210336E-03 -6.5266767023E-22
  8.6324307269E-04 -2.1972469324E-05  1.3078210336E-03  0.0000000000E+00  1.1843978642E-03  3.2630306927E-05

 Tensor_qq(ke,je,1,3), prototypical atom
  1.2642269545E-05 -1.4374506945E-05  3.3858813127E-04  9.1912933867E-06  1.9701138788E-03 -2.6747441797E-21
  3.3858813127E-04  9.1912933867E-06  1.4515006860E-04 -1.5992784206E-05  8.6324307269E-04  2.1972469324E-05
  1.9701138788E-03 -4.0121162695E-21  8.6324307269E-04  2.1972469324E-05 -3.0582033722E-04  3.5496325802E-05

 Tensor_qq(ke,je,2,3), prototypical atom
  3.6284281021E-05  8.6241810999E-06  3.5976798057E-04 -7.5268484115E-06  8.6324307269E-04 -2.1972469324E-05
  3.5976798057E-04 -7.5268484115E-06 -1.2067320972E-03 -3.5350203345E-05  1.3078210336E-03  1.6018374692E-23
  8.6324307269E-04 -2.1972469324E-05  1.3078210336E-03  6.6868604492E-22  1.1843978642E-03  3.2630306927E-05

 Tensor_qq(ke,je,3,3), prototypical atom
 -9.0344535233E-04  1.9458555559E-05  1.2056031812E-03 -3.4953488268E-05 -3.0582033722E-04 -3.5496325802E-05
  1.2056031812E-03 -3.4953488268E-05 -1.6581312962E-03 -1.6573681698E-05  1.1843978642E-03 -3.2630306927E-05
 -3.0582033722E-04 -3.5496325802E-05  1.1843978642E-03 -3.2630306927E-05  2.7451762764E-03  0.0000000000E+00

 Crystal Tensor_dd(ke,ks) (Mbarn)
  7.3987300803E-02  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20 -2.4436551156E-02  0.0000000000E+00
  0.0000000000E+00  1.3552527156E-20  3.6373649723E-02  0.0000000000E+00  0.0000000000E+00  2.6469779602E-23
 -2.4436551156E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  6.5370153480E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  1.5819251820E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.0113815636E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -8.5974675518E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.0113815636E-04  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21 -7.2275628186E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  0.0000000000E+00  1.6980912812E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.6980912812E-02  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22  2.8781438445E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.8781438445E-03  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20

 Crystal Tensor_qq(ke,je,3,1)
  1.0113815636E-04  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21  1.5760911031E-02  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.1612005488E-03  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21
  1.5760911031E-02  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21 -2.4465626977E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  0.0000000000E+00  1.6980912812E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.6980912812E-02  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22  2.8781438445E-03  0.0000000000E+00
  0.0000000000E+00  3.3881317890E-21  2.8781438445E-03  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20

 Crystal Tensor_qq(ke,je,2,2)
 -8.5974675518E-03  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22  1.1612005488E-03  0.0000000000E+00
  0.0000000000E+00 -8.4703294725E-22  2.0948211269E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.1612005488E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -1.3265050370E-02  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  3.3881317890E-21  2.8781438445E-03  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21
  2.8781438445E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.0462568269E-02  0.0000000000E+00
  0.0000000000E+00  6.7762635780E-21  1.0462568269E-02  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20

 Crystal Tensor_qq(ke,je,1,3)
  1.0113815636E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.5760911031E-02  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.1612005488E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.5760911031E-02  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21 -2.4465626977E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  0.0000000000E+00  2.8781438445E-03  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21
  2.8781438445E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.0462568269E-02  0.0000000000E+00
  0.0000000000E+00 -6.7762635780E-21  1.0462568269E-02  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20

 Crystal Tensor_qq(ke,je,3,3)
 -7.2275628186E-03  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20 -2.4465626977E-03  0.0000000000E+00
  0.0000000000E+00 -1.3552527156E-20 -1.3265050370E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -2.4465626977E-03  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20  2.1961410211E-02  0.0000000000E+00

 Convertion factor =  78.04534 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -11.500  1.05909E-01  8.22449E-02  5.23990E-02  5.57661E-02  5.84111E-02  8.47186E-02  7.30725E-02
   dip-dip  9.44911E-02  6.54324E-02  3.63736E-02  4.06200E-02  4.48664E-02  6.94435E-02  5.85770E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  1.14182E-02  1.68126E-02  1.60253E-02  1.51461E-02  1.35448E-02  1.52751E-02  1.44955E-02

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -1.12088E-16 -1.29817E-03 -1.80646E-16  5.38192E-04 -8.65788E-18 -4.22224E-04  2.83705E-18 -1.02306E-02
   dip-dip -7.07749E-17  1.68003E-16 -1.41270E-16  2.84158E-16 -1.88833E-17 -1.42434E-03 -3.37868E-18 -9.40454E-03
   dip-qua -1.23734E-17 -2.43299E-17 -1.67886E-17 -3.41627E-17  1.47823E-17  3.31474E-17  7.66862E-19  1.07016E-17
   qua-qua -2.89399E-17 -1.29817E-03 -2.25878E-17  5.38192E-04 -4.55683E-18  1.00212E-03  5.44887E-18 -8.26052E-04

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -11.40000 eV

 Vmoy = -20.21344 eV, Vmftabs(up) = -25.37047 eV, Vmftabs(dn) = -25.06581 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 2

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -1.561E-05   8.265E-03   1.275E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.238E-05   6.552E-03   1.011E-03
  1 -1    1  1    -7.729E-03   2.337E-01   2.227E-02
  1 -1    1  2     8.514E-04  -2.540E-02  -2.386E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -2.663E-03   8.098E-02   7.770E-03
  1  0    1  1    -6.403E-03   1.941E-01   1.856E-02
  1  0    1  2     7.642E-04  -2.280E-02  -2.142E-03
  1  0    2  1     8.434E-04  -2.467E-02  -2.265E-03
  1  0    2  2    -2.961E-03   8.971E-02   8.571E-03
  1  1    1  1    -5.323E-03   1.619E-01   1.553E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     7.571E-04  -2.215E-02  -2.033E-03
  1  1    2  2    -3.199E-03   9.666E-02   9.208E-03
  2 -2    1  1     3.978E-04  -1.975E-02  -3.181E-03
  2 -2    1  2    -2.348E-06   1.043E-04   1.538E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     3.689E-04  -1.834E-02  -2.957E-03
  2 -1    1  1     3.966E-04  -1.969E-02  -3.173E-03
  2 -1    1  2    -2.875E-06   1.278E-04   1.884E-05
  2 -1    2  1    -2.385E-06   1.054E-04   1.546E-05
  2 -1    2  2     3.700E-04  -1.839E-02  -2.965E-03
  2  0    1  1     3.953E-04  -1.963E-02  -3.165E-03
  2  0    1  2    -2.875E-06   1.278E-04   1.883E-05
  2  0    2  1    -2.921E-06   1.291E-04   1.893E-05
  2  0    2  2     3.712E-04  -1.844E-02  -2.972E-03
  2  1    1  1     3.941E-04  -1.958E-02  -3.157E-03
  2  1    1  2    -2.347E-06   1.043E-04   1.538E-05
  2  1    2  1    -2.920E-06   1.291E-04   1.893E-05
  2  1    2  2     3.723E-04  -1.848E-02  -2.979E-03
  2  2    1  1     3.928E-04  -1.952E-02  -3.148E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -2.384E-06   1.054E-04   1.546E-05
  2  2    2  2     3.734E-04  -1.853E-02  -2.986E-03

 iapr =  1, Z = 23, lmax = 3

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  9.9888327860E-03  1.0699172904E-20  1.0733817447E-03  7.8634191047E-05 -1.9761542881E-03  1.7458391559E-04
  1.0733817447E-03 -7.8634191047E-05  4.6068439062E-03  1.4848085128E-36  1.4622839509E-04  1.0701653322E-04
 -1.9761542881E-03 -1.7458391559E-04  1.4622839509E-04 -1.0701653322E-04  6.4709459715E-03  1.0699172904E-20

 Tensor_dq(1,ks,j2), prototypical atom
 -8.1189417432E-04 -7.4908269158E-05  3.2352770071E-05  4.5534889634E-05 -3.1924619664E-03 -3.1369914024E-06
  3.2352770071E-05  4.5534889634E-05  8.1700181016E-04  1.9630507420E-04 -1.8964497631E-03 -9.9548897609E-05
 -3.1924619664E-03 -3.1369914024E-06 -1.8964497631E-03 -9.9548897609E-05  2.6189191979E-04 -1.2551430017E-04

 Tensor_dq(2,ks,j2), prototypical atom
 -1.0487045236E-03 -2.6077029450E-06  9.0957196119E-04  1.3445632050E-05 -4.1853047681E-04  3.3499798501E-05
  9.0957196119E-04  1.3445632050E-05  9.0676098583E-04  7.2650411962E-05 -3.2443892294E-04 -3.3011195450E-05
 -4.1853047681E-04  3.3499798501E-05 -3.2443892294E-04 -3.3011195450E-05  1.6971430952E-04 -7.7139356266E-05

 Tensor_dq(3,ks,j2), prototypical atom
 -1.2094229386E-04  1.1419939516E-04 -4.7049449672E-05 -7.2971329059E-05  1.0247694155E-03  1.1373453289E-04
 -4.7049449672E-05 -7.2971329059E-05  1.7063249529E-03 -1.2673988421E-04 -5.7619891398E-04  8.4643760092E-05
  1.0247694155E-03  1.1373453289E-04 -5.7619891398E-04  8.4643760092E-05 -1.8446856667E-03  5.5232919046E-06

 Tensor_qq(ke,je,1,1), prototypical atom
  1.3567306749E-03  0.0000000000E+00 -1.1774612301E-03  8.5119082109E-06  2.7524609213E-04  3.1783663973E-05
 -1.1774612301E-03  8.5119082109E-06 -9.3375175488E-04  8.7321787980E-05  2.7534103799E-04 -4.3464648579E-05
  2.7524609213E-04  3.1783663973E-05  2.7534103799E-04 -4.3464648579E-05 -4.2647181369E-04 -9.5585786210E-05

 Tensor_qq(ke,je,2,1), prototypical atom
 -1.1774612301E-03 -8.5119082109E-06  1.3491224877E-03  0.0000000000E+00  1.3272699176E-04 -1.2751514639E-05
  1.3491224877E-03 -1.6324195382E-21  5.4048719548E-04 -6.1175399159E-05  1.2141246586E-04  3.7816871596E-05
  1.3272699176E-04 -1.2751514639E-05  1.2141246586E-04  3.7816871596E-05  6.4930159205E-04  7.5700931702E-05

 Tensor_qq(ke,je,3,1), prototypical atom
  2.7524609213E-04 -3.1783663973E-05  1.3272699176E-04  1.2751514639E-05  1.8484617084E-03 -5.3495864521E-21
  1.3272699176E-04  1.2751514639E-05 -4.0359983168E-04  1.1071532945E-04  1.0451591187E-03 -6.0515740600E-05
  1.8484617084E-03 -2.6747932261E-21  1.0451591187E-03 -6.0515740600E-05 -1.5392716112E-06 -8.2398315404E-05

 Tensor_qq(ke,je,1,2), prototypical atom
 -1.1774612301E-03 -8.5119082109E-06  1.3491224877E-03  5.3495864521E-21  1.3272699176E-04 -1.2751514639E-05
  1.3491224877E-03  3.7171669139E-21  5.4048719548E-04 -6.1175399159E-05  1.2141246586E-04  3.7816871596E-05
  1.3272699176E-04 -1.2751514639E-05  1.2141246586E-04  3.7816871596E-05  6.4930159205E-04  7.5700931702E-05

 Tensor_qq(ke,je,2,2), prototypical atom
 -9.3375175488E-04 -8.7321787980E-05  5.4048719548E-04  6.1175399159E-05 -4.0359983168E-04 -1.1071532945E-04
  5.4048719548E-04  6.1175399159E-05  2.0078420325E-03  8.9088510770E-37 -1.1096312360E-03 -1.6651264555E-05
 -4.0359983168E-04 -1.1071532945E-04 -1.1096312360E-03 -1.6651264555E-05 -1.1276448894E-03  9.9399266395E-05

 Tensor_qq(ke,je,3,2), prototypical atom
  2.7534103799E-04  4.3464648579E-05  1.2141246586E-04 -3.7816871596E-05  1.0451591187E-03  6.0515740600E-05
  1.2141246586E-04 -3.7816871596E-05 -1.1096312360E-03  1.6651264555E-05  1.2444291109E-03 -2.0612095924E-21
  1.0451591187E-03  6.0515740600E-05  1.2444291109E-03 -2.6747932261E-21  8.1985267319E-04 -6.6139931428E-05

 Tensor_qq(ke,je,1,3), prototypical atom
  2.7524609213E-04 -3.1783663973E-05  1.3272699176E-04  1.2751514639E-05  1.8484617084E-03  0.0000000000E+00
  1.3272699176E-04  1.2751514639E-05 -4.0359983168E-04  1.1071532945E-04  1.0451591187E-03 -6.0515740600E-05
  1.8484617084E-03  0.0000000000E+00  1.0451591187E-03 -6.0515740600E-05 -1.5392716112E-06 -8.2398315404E-05

 Tensor_qq(ke,je,2,3), prototypical atom
  2.7534103799E-04  4.3464648579E-05  1.2141246586E-04 -3.7816871596E-05  1.0451591187E-03  6.0515740600E-05
  1.2141246586E-04 -3.7816871596E-05 -1.1096312360E-03  1.6651264555E-05  1.2444291109E-03 -2.0612095924E-21
  1.0451591187E-03  6.0515740600E-05  1.2444291109E-03 -2.6747932261E-21  8.1985267319E-04 -6.6139931428E-05

 Tensor_qq(ke,je,3,3), prototypical atom
 -4.2647181369E-04  9.5585786210E-05  6.4930159205E-04 -7.5700931702E-05 -1.5392716112E-06  8.2398315404E-05
  6.4930159205E-04 -7.5700931702E-05 -1.1276448894E-03 -9.9399266395E-05  8.1985267319E-04  6.6139931428E-05
 -1.5392716112E-06  8.2398315404E-05  8.1985267319E-04  6.6139931428E-05  1.6781415537E-03 -5.3495864521E-21

 Crystal Tensor_dd(ke,ks) (Mbarn)
  7.9910662288E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -1.5809234305E-02  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  3.6854751250E-02  0.0000000000E+00  0.0000000000E+00  2.7105054312E-20
 -1.5809234305E-02  0.0000000000E+00  0.0000000000E+00 -2.7105054312E-20  5.1767567772E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  1.0853845399E-02  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21  2.2019687370E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -7.4700140391E-03  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20
  2.2019687370E-03  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20 -3.4117745095E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  0.0000000000E+00  1.0792979902E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.0792979902E-02  0.0000000000E+00  0.0000000000E+00 -2.7105054312E-20  9.7129972692E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  9.7129972692E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,1)
  2.2019687370E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21  1.4787693667E-02  0.0000000000E+00
  0.0000000000E+00 -3.3881317890E-21 -3.2287986534E-03  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20
  1.4787693667E-02  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20 -1.2314172889E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  3.3881317890E-21  1.0792979902E-02  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
  1.0792979902E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  9.7129972692E-04  0.0000000000E+00
  0.0000000000E+00  3.3881317890E-21  9.7129972692E-04  0.0000000000E+00  0.0000000000E+00 -2.7105054312E-20

 Crystal Tensor_qq(ke,je,2,2)
 -7.4700140391E-03  0.0000000000E+00  0.0000000000E+00  2.7105054312E-20 -3.2287986534E-03  0.0000000000E+00
  0.0000000000E+00  2.7105054312E-20  1.6062736260E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -3.2287986534E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -9.0211591155E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00 -1.3552527156E-20  9.7129972692E-04  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20
  9.7129972692E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  9.9554328875E-03  0.0000000000E+00
  0.0000000000E+00 -1.3552527156E-20  9.9554328875E-03  0.0000000000E+00  0.0000000000E+00  2.7105054312E-20

 Crystal Tensor_qq(ke,je,1,3)
  2.2019687370E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21  1.4787693667E-02  0.0000000000E+00
  0.0000000000E+00  3.3881317890E-21 -3.2287986534E-03  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20
  1.4787693667E-02  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20 -1.2314172889E-05  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  0.0000000000E+00  9.7129972692E-04  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20
  9.7129972692E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  9.9554328875E-03  0.0000000000E+00
  0.0000000000E+00  1.3552527156E-20  9.9554328875E-03  0.0000000000E+00  0.0000000000E+00 -2.7105054312E-20

 Crystal Tensor_qq(ke,je,3,3)
 -3.4117745095E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -1.2314172889E-05  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -9.0211591155E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -1.2314172889E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.3425132429E-02  0.0000000000E+00

 Convertion factor =  78.04677 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -11.400  9.32303E-02  7.08404E-02  4.81183E-02  5.74321E-02  5.62566E-02  6.87957E-02  6.73012E-02
   dip-dip  8.37454E-02  6.03001E-02  3.68548E-02  4.23938E-02  4.79328E-02  5.45561E-02  5.61777E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  9.48491E-03  1.05404E-02  1.12635E-02  1.50383E-02  8.32375E-03  1.42396E-02  1.11235E-02

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -1.07390E-16  6.47220E-03 -1.98724E-16  3.64804E-03  1.79548E-17 -6.54663E-03 -1.08873E-17  1.75459E-02
   dip-dip -8.61356E-17  1.57232E-16 -1.66950E-16  2.70696E-16  1.04800E-17  1.34857E-03 -1.66330E-17  9.23932E-03
   dip-qua -5.25473E-18 -1.43902E-17 -1.38092E-17 -3.21851E-17  1.14891E-17  2.44448E-17  1.93501E-18 -1.78798E-17
   qua-qua -1.59998E-17  6.47220E-03 -1.79651E-17  3.64804E-03 -4.01425E-18 -7.89520E-03  3.81066E-18  8.30657E-03

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -11.30000 eV

 Vmoy = -20.21537 eV, Vmftabs(up) = -25.37067 eV, Vmftabs(dn) = -25.06601 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 3

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -1.541E-05   8.157E-03   1.258E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.225E-05   6.484E-03   1.000E-03
  1 -1    1  1    -7.575E-03   2.290E-01   2.183E-02
  1 -1    1  2     8.316E-04  -2.481E-02  -2.330E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -2.624E-03   7.981E-02   7.657E-03
  1  0    1  1    -6.284E-03   1.905E-01   1.821E-02
  1  0    1  2     7.473E-04  -2.230E-02  -2.094E-03
  1  0    2  1     8.238E-04  -2.410E-02  -2.211E-03
  1  0    2  2    -2.917E-03   8.836E-02   8.442E-03
  1  1    1  1    -5.231E-03   1.591E-01   1.526E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     7.404E-04  -2.166E-02  -1.987E-03
  1  1    2  2    -3.150E-03   9.518E-02   9.067E-03
  2 -2    1  1     3.903E-04  -1.937E-02  -3.121E-03
  2 -2    1  2    -2.306E-06   1.025E-04   1.511E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     3.619E-04  -1.799E-02  -2.901E-03
  2 -1    1  1     3.891E-04  -1.932E-02  -3.113E-03
  2 -1    1  2    -2.824E-06   1.255E-04   1.851E-05
  2 -1    2  1    -2.343E-06   1.035E-04   1.519E-05
  2 -1    2  2     3.630E-04  -1.803E-02  -2.908E-03
  2  0    1  1     3.879E-04  -1.926E-02  -3.105E-03
  2  0    1  2    -2.823E-06   1.255E-04   1.850E-05
  2  0    2  1    -2.869E-06   1.268E-04   1.860E-05
  2  0    2  2     3.641E-04  -1.808E-02  -2.915E-03
  2  1    1  1     3.866E-04  -1.921E-02  -3.097E-03
  2  1    1  2    -2.305E-06   1.025E-04   1.511E-05
  2  1    2  1    -2.869E-06   1.268E-04   1.860E-05
  2  1    2  2     3.652E-04  -1.813E-02  -2.922E-03
  2  2    1  1     3.854E-04  -1.915E-02  -3.089E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -2.342E-06   1.035E-04   1.518E-05
  2  2    2  2     3.663E-04  -1.818E-02  -2.929E-03
  3 -3    1  1     2.253E-05  -1.477E-03  -3.058E-04
  3 -3    1  2    -2.675E-08   1.361E-06   2.239E-07
  3 -3    2  1     0.000E+00   0.000E+00   0.000E+00
  3 -3    2  2     2.313E-05  -1.517E-03  -3.143E-04
  3 -2    1  1     2.252E-05  -1.477E-03  -3.057E-04
  3 -2    1  2    -3.454E-08   1.757E-06   2.890E-07
  3 -2    2  1    -2.595E-08   1.320E-06   2.169E-07
  3 -2    2  2     2.314E-05  -1.518E-03  -3.144E-04
  3 -1    1  1     2.251E-05  -1.476E-03  -3.056E-04
  3 -1    1  2    -3.784E-08   1.925E-06   3.166E-07
  3 -1    2  1    -3.350E-08   1.704E-06   2.801E-07
  3 -1    2  2     2.315E-05  -1.519E-03  -3.145E-04
  3  0    1  1     2.250E-05  -1.476E-03  -3.055E-04
  3  0    1  2    -3.784E-08   1.925E-06   3.166E-07
  3  0    2  1    -3.670E-08   1.867E-06   3.068E-07
  3  0    2  2     2.316E-05  -1.519E-03  -3.146E-04
  3  1    1  1     2.249E-05  -1.475E-03  -3.055E-04
  3  1    1  2    -3.454E-08   1.757E-06   2.890E-07
  3  1    2  1    -3.670E-08   1.866E-06   3.068E-07
  3  1    2  2     2.317E-05  -1.520E-03  -3.147E-04
  3  2    1  1     2.248E-05  -1.475E-03  -3.054E-04
  3  2    1  2    -2.675E-08   1.361E-06   2.239E-07
  3  2    2  1    -3.350E-08   1.704E-06   2.801E-07
  3  2    2  2     2.318E-05  -1.520E-03  -3.148E-04
  3  3    1  1     2.247E-05  -1.474E-03  -3.053E-04
  3  3    1  2     0.000E+00   0.000E+00   0.000E+00
  3  3    2  1    -2.595E-08   1.320E-06   2.169E-07
  3  3    2  2     2.319E-05  -1.521E-03  -3.149E-04

 iapr =  1, Z = 23, lmax = 3

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  7.8319571911E-03  1.0699369090E-20  8.4677181816E-04  5.9008975427E-05 -1.0187900339E-03  1.5289889576E-04
  8.4677181816E-04 -5.9008975427E-05  4.2647380806E-03  5.9393429562E-37  1.2240626160E-04  7.0101096332E-05
 -1.0187900339E-03 -1.5289889576E-04  1.2240626160E-04 -7.0101096332E-05  4.8075068139E-03  1.0699369090E-20

 Tensor_dq(1,ks,j2), prototypical atom
 -5.6850550685E-04 -4.6414166421E-05  1.6668731406E-05  2.4319120947E-05 -1.9852276606E-03  6.0704107655E-07
  1.6668731406E-05  2.4319120947E-05  6.0980958998E-04  1.4663280489E-04 -1.2371697594E-03 -7.7288069086E-05
 -1.9852276606E-03  6.0704107655E-07 -1.2371697594E-03 -7.7288069086E-05  1.3758859366E-04 -1.0589004029E-04

 Tensor_dq(2,ks,j2), prototypical atom
 -6.6665966446E-04  2.1366011469E-06  5.2668387306E-04  3.5196118446E-06 -3.4712102388E-04  2.2897373534E-05
  5.2668387306E-04  3.5196118446E-06  6.5300067187E-04  4.0541073957E-05 -2.2612853495E-04 -1.7207588204E-05
 -3.4712102388E-04  2.2897373534E-05 -2.2612853495E-04 -1.7207588204E-05  3.4472665563E-05 -4.7652141763E-05

 Tensor_dq(3,ks,j2), prototypical atom
 -8.3177411028E-05  6.9990134331E-05 -2.3847314742E-05 -4.4496995311E-05  5.8035700047E-04  8.3553139704E-05
 -2.3847314742E-05 -4.4496995311E-05  9.0144394590E-04 -8.1964590076E-05 -2.9887505937E-04  6.6086384253E-05
  5.8035700047E-04  8.3553139704E-05 -2.9887505937E-04  6.6086384253E-05 -9.8599147687E-04  6.6308409374E-06

 Tensor_qq(ke,je,1,1), prototypical atom
  7.6418233380E-04  0.0000000000E+00 -5.8973510378E-04  1.2753231014E-06  2.1030272231E-04  2.1145253514E-05
 -5.8973510378E-04  1.2753231014E-06 -5.5970518212E-04  5.0008425973E-05  1.9522382444E-04 -2.2328007033E-05
  2.1030272231E-04  2.1145253514E-05  1.9522382444E-04 -2.2328007033E-05 -1.9937778977E-04 -5.5405376593E-05

 Tensor_qq(ke,je,2,1), prototypical atom
 -5.8973510378E-04 -1.2753231014E-06  7.2818432731E-04  1.3374211362E-21  3.9372471854E-05 -9.7358393184E-06
  7.2818432731E-04  1.5617687732E-22  3.0744574325E-04 -3.5613925072E-05  2.6048497262E-05  1.9224823649E-05
  3.9372471854E-05 -9.7358393184E-06  2.6048497262E-05  1.9224823649E-05  2.8925767860E-04  4.0598731282E-05

 Tensor_qq(ke,je,3,1), prototypical atom
  2.1030272231E-04 -2.1145253514E-05  3.9372471854E-05  9.7358393184E-06  1.1203156659E-03  0.0000000000E+00
  3.9372471854E-05  9.7358393184E-06 -2.6088476757E-04  7.5624844359E-05  5.9153746670E-04 -4.2672602259E-05
  1.1203156659E-03  1.3374211362E-21  5.9153746670E-04 -4.2672602259E-05 -3.3831488198E-05 -5.7949780971E-05

 Tensor_qq(ke,je,1,2), prototypical atom
 -5.8973510378E-04 -1.2753231014E-06  7.2818432731E-04  1.3374211362E-21  3.9372471854E-05 -9.7358393184E-06
  7.2818432731E-04  1.5617687732E-22  3.0744574325E-04 -3.5613925072E-05  2.6048497262E-05  1.9224823649E-05
  3.9372471854E-05 -9.7358393184E-06  2.6048497262E-05  1.9224823649E-05  2.8925767860E-04  4.0598731282E-05

 Tensor_qq(ke,je,2,2), prototypical atom
 -5.5970518212E-04 -5.0008425973E-05  3.0744574325E-04  3.5613925072E-05 -2.6088476757E-04 -7.5624844359E-05
  3.0744574325E-04  3.5613925072E-05  1.1598331790E-03  2.2272536086E-37 -5.9895302379E-04 -1.9451151963E-05
 -2.6088476757E-04 -7.5624844359E-05 -5.9895302379E-04 -1.9451151963E-05 -6.2541890614E-04  5.8591692866E-05

 Tensor_qq(ke,je,3,2), prototypical atom
  1.9522382444E-04  2.2328007033E-05  2.6048497262E-05 -1.9224823649E-05  5.9153746670E-04  4.2672602259E-05
  2.6048497262E-05 -1.9224823649E-05 -5.9895302379E-04  1.9451151963E-05  7.1253392906E-04 -1.2134505774E-21
  5.9153746670E-04  4.2672602259E-05  7.1253392906E-04 -1.3374211362E-21  3.9173187558E-04 -4.7126950067E-05

 Tensor_qq(ke,je,1,3), prototypical atom
  2.1030272231E-04 -2.1145253514E-05  3.9372471854E-05  9.7358393184E-06  1.1203156659E-03  0.0000000000E+00
  3.9372471854E-05  9.7358393184E-06 -2.6088476757E-04  7.5624844359E-05  5.9153746670E-04 -4.2672602259E-05
  1.1203156659E-03  1.3374211362E-21  5.9153746670E-04 -4.2672602259E-05 -3.3831488198E-05 -5.7949780971E-05

 Tensor_qq(ke,je,2,3), prototypical atom
  1.9522382444E-04  2.2328007033E-05  2.6048497262E-05 -1.9224823649E-05  5.9153746670E-04  4.2672602259E-05
  2.6048497262E-05 -1.9224823649E-05 -5.9895302379E-04  1.9451151963E-05  7.1253392906E-04 -1.2134505774E-21
  5.9153746670E-04  4.2672602259E-05  7.1253392906E-04 -1.3374211362E-21  3.9173187558E-04 -4.7126950067E-05

 Tensor_qq(ke,je,3,3), prototypical atom
 -1.9937778977E-04  5.5405376593E-05  2.8925767860E-04 -4.0598731282E-05 -3.3831488198E-05  5.7949780971E-05
  2.8925767860E-04 -4.0598731282E-05 -6.2541890614E-04 -5.8591692866E-05  3.9173187558E-04  4.7126950067E-05
 -3.3831488198E-05  5.7949780971E-05  3.9173187558E-04  4.7126950067E-05  9.0824423264E-04 -5.3496845449E-21

 Crystal Tensor_dd(ke,ks) (Mbarn)
  6.2655657529E-02  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20 -8.1503202711E-03  0.0000000000E+00
  0.0000000000E+00 -1.3552527156E-20  3.4117904645E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -8.1503202711E-03  0.0000000000E+00  0.0000000000E+00  2.7105054312E-20  3.8460054511E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  6.1134586704E-03  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22  1.6824217785E-03  0.0000000000E+00
  0.0000000000E+00  4.2351647363E-22 -4.4776414570E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.6824217785E-03  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21 -1.5950223182E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00 -4.2351647363E-22  5.8254746185E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
  5.8254746185E-03  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20  2.0838797810E-04  0.0000000000E+00
  0.0000000000E+00  3.3881317890E-21  2.0838797810E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,1)
  1.6824217785E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  8.9625253271E-03  0.0000000000E+00
  0.0000000000E+00  3.3881317890E-21 -2.0870781406E-03  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20
  8.9625253271E-03  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20 -2.7065190559E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00 -4.2351647363E-22  5.8254746185E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
  5.8254746185E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  2.0838797810E-04  0.0000000000E+00
  0.0000000000E+00  3.3881317890E-21  2.0838797810E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,2)
 -4.4776414570E-03  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20 -2.0870781406E-03  0.0000000000E+00
  0.0000000000E+00 -1.3552527156E-20  9.2786654324E-03  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21
 -2.0870781406E-03  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21 -5.0033512491E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  6.7762635780E-21  2.0838797810E-04  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20
  2.0838797810E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  5.7002714325E-03  0.0000000000E+00
  0.0000000000E+00  1.3552527156E-20  5.7002714325E-03  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20

 Crystal Tensor_qq(ke,je,1,3)
  1.6824217785E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  8.9625253271E-03  0.0000000000E+00
  0.0000000000E+00  3.3881317890E-21 -2.0870781406E-03  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20
  8.9625253271E-03  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20 -2.7065190559E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  6.7762635780E-21  2.0838797810E-04  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20
  2.0838797810E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  5.7002714325E-03  0.0000000000E+00
  0.0000000000E+00  1.3552527156E-20  5.7002714325E-03  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20

 Crystal Tensor_qq(ke,je,3,3)
 -1.5950223182E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -2.7065190559E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -5.0033512491E-03  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20
 -2.7065190559E-04  0.0000000000E+00  0.0000000000E+00 -1.3552527156E-20  7.2659538611E-03  0.0000000000E+00

 Convertion factor =  78.04820 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -11.300  6.61526E-02  5.33844E-02  4.00760E-02  4.62028E-02  4.51197E-02  4.84794E-02  5.14245E-02
   dip-dip  6.05850E-02  4.73515E-02  3.41179E-02  3.73243E-02  4.05307E-02  3.99635E-02  4.50779E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  5.56760E-03  6.03296E-03  5.95814E-03  8.87849E-03  4.58899E-03  8.51590E-03  6.34659E-03

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -9.19556E-17  4.36975E-03 -1.59644E-16  2.34718E-03  1.05999E-17 -4.04386E-03 -3.83824E-17  1.34465E-02
   dip-dip -7.72812E-17  1.21546E-16 -1.43572E-16  2.12790E-16  5.40240E-18  1.19780E-03 -2.99339E-17  8.10330E-03
   dip-qua -4.02200E-18 -7.28903E-18 -9.50816E-18 -2.17260E-17  8.09588E-18  1.37216E-17 -9.28106E-18 -1.28495E-17
   qua-qua -1.06525E-17  4.36975E-03 -6.56423E-18  2.34718E-03 -2.89835E-18 -5.24165E-03  8.32615E-19  5.34316E-03

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -11.20000 eV

 Vmoy = -20.21731 eV, Vmftabs(up) = -25.37087 eV, Vmftabs(dn) = -25.06621 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 3

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -1.521E-05   8.052E-03   1.242E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.213E-05   6.418E-03   9.901E-04
  1 -1    1  1    -7.426E-03   2.245E-01   2.140E-02
  1 -1    1  2     8.124E-04  -2.423E-02  -2.275E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -2.587E-03   7.867E-02   7.548E-03
  1  0    1  1    -6.170E-03   1.870E-01   1.788E-02
  1  0    1  2     7.310E-04  -2.180E-02  -2.047E-03
  1  0    2  1     8.048E-04  -2.354E-02  -2.160E-03
  1  0    2  2    -2.873E-03   8.704E-02   8.316E-03
  1  1    1  1    -5.142E-03   1.564E-01   1.500E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     7.242E-04  -2.118E-02  -1.943E-03
  1  1    2  2    -3.102E-03   9.374E-02   8.931E-03
  2 -2    1  1     3.831E-04  -1.902E-02  -3.064E-03
  2 -2    1  2    -2.266E-06   1.007E-04   1.485E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     3.551E-04  -1.765E-02  -2.847E-03
  2 -1    1  1     3.819E-04  -1.896E-02  -3.056E-03
  2 -1    1  2    -2.775E-06   1.234E-04   1.819E-05
  2 -1    2  1    -2.302E-06   1.018E-04   1.493E-05
  2 -1    2  2     3.562E-04  -1.770E-02  -2.854E-03
  2  0    1  1     3.807E-04  -1.891E-02  -3.048E-03
  2  0    1  2    -2.774E-06   1.233E-04   1.819E-05
  2  0    2  1    -2.819E-06   1.246E-04   1.829E-05
  2  0    2  2     3.573E-04  -1.774E-02  -2.861E-03
  2  1    1  1     3.795E-04  -1.885E-02  -3.040E-03
  2  1    1  2    -2.265E-06   1.007E-04   1.485E-05
  2  1    2  1    -2.819E-06   1.246E-04   1.828E-05
  2  1    2  2     3.583E-04  -1.779E-02  -2.868E-03
  2  2    1  1     3.783E-04  -1.880E-02  -3.032E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -2.301E-06   1.017E-04   1.493E-05
  2  2    2  2     3.594E-04  -1.784E-02  -2.875E-03
  3 -3    1  1     2.186E-05  -1.433E-03  -2.966E-04
  3 -3    1  2    -2.595E-08   1.320E-06   2.172E-07
  3 -3    2  1     0.000E+00   0.000E+00   0.000E+00
  3 -3    2  2     2.243E-05  -1.472E-03  -3.048E-04
  3 -2    1  1     2.185E-05  -1.432E-03  -2.965E-04
  3 -2    1  2    -3.350E-08   1.705E-06   2.804E-07
  3 -2    2  1    -2.517E-08   1.280E-06   2.104E-07
  3 -2    2  2     2.244E-05  -1.472E-03  -3.049E-04
  3 -1    1  1     2.184E-05  -1.432E-03  -2.964E-04
  3 -1    1  2    -3.670E-08   1.867E-06   3.071E-07
  3 -1    2  1    -3.250E-08   1.653E-06   2.717E-07
  3 -1    2  2     2.245E-05  -1.473E-03  -3.050E-04
  3  0    1  1     2.183E-05  -1.431E-03  -2.963E-04
  3  0    1  2    -3.670E-08   1.867E-06   3.071E-07
  3  0    2  1    -3.560E-08   1.811E-06   2.976E-07
  3  0    2  2     2.246E-05  -1.473E-03  -3.051E-04
  3  1    1  1     2.181E-05  -1.431E-03  -2.963E-04
  3  1    1  2    -3.350E-08   1.705E-06   2.804E-07
  3  1    2  1    -3.560E-08   1.811E-06   2.976E-07
  3  1    2  2     2.247E-05  -1.474E-03  -3.052E-04
  3  2    1  1     2.180E-05  -1.430E-03  -2.962E-04
  3  2    1  2    -2.595E-08   1.320E-06   2.172E-07
  3  2    2  1    -3.250E-08   1.653E-06   2.717E-07
  3  2    2  2     2.248E-05  -1.474E-03  -3.053E-04
  3  3    1  1     2.179E-05  -1.430E-03  -2.961E-04
  3  3    1  2     0.000E+00   0.000E+00   0.000E+00
  3  3    2  1    -2.517E-08   1.280E-06   2.104E-07
  3  3    2  2     2.250E-05  -1.475E-03  -3.054E-04

 iapr =  1, Z = 23, lmax = 3

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  6.4641819063E-03  1.0699565275E-20  5.9715359903E-04  3.8762717078E-05 -6.4917859721E-04  8.0898507480E-05
  5.9715359903E-04 -3.8762717078E-05  4.1634961436E-03  6.5890794083E-37  7.7273503431E-05  3.1772538056E-05
 -6.4917859721E-04 -8.0898507480E-05  7.7273503431E-05 -3.1772538056E-05  4.1972727943E-03  1.0699565275E-20

 Tensor_dq(1,ks,j2), prototypical atom
 -3.4121680714E-04 -2.6450858156E-05 -4.5177148117E-05  1.4299861836E-05 -1.2108034166E-03  5.8660270827E-07
 -4.5177148117E-05  1.4299861836E-05  2.9370566965E-04  7.6837136260E-05 -7.3153586645E-04 -3.9279953364E-05
 -1.2108034166E-03  5.8660270827E-07 -7.3153586645E-04 -3.9279953364E-05  1.8196331004E-04 -5.3619046000E-05

 Tensor_dq(2,ks,j2), prototypical atom
 -4.6341037140E-04  2.6107806894E-06  3.3236270039E-04  1.4727704777E-06 -2.5320875701E-04  1.0099759240E-05
  3.3236270039E-04  1.4727704777E-06  4.7262566324E-04  1.5153952562E-05 -9.5657815518E-05 -6.1067005631E-06
 -2.5320875701E-04  1.0099759240E-05 -9.5657815518E-05 -6.1067005631E-06  6.9765179978E-06 -2.0196027344E-05

 Tensor_dq(3,ks,j2), prototypical atom
 -5.3444237966E-05  3.4622029788E-05 -3.2173167866E-05 -2.4696696339E-05  4.2196492822E-04  4.1026499473E-05
 -3.2173167866E-05 -2.4696696339E-05  5.7024354692E-04 -3.9075481971E-05 -1.9085073508E-04  3.4225557117E-05
  4.2196492822E-04  4.1026499473E-05 -1.9085073508E-04  3.4225557117E-05 -6.5741554016E-04  1.4114409333E-06

 Tensor_qq(ke,je,1,1), prototypical atom
  4.8281411160E-04 -1.3374456594E-21 -3.1934712376E-04 -6.0752321717E-07  1.2065950154E-04  1.2271525493E-05
 -3.1934712376E-04 -6.0752321717E-07 -3.3921088786E-04  2.4775814137E-05  9.9617982527E-05 -9.4465847895E-06
  1.2065950154E-04  1.2271525493E-05  9.9617982527E-05 -9.4465847895E-06 -1.3098544981E-04 -2.7790081408E-05

 Tensor_qq(ke,je,2,1), prototypical atom
 -3.1934712376E-04  6.0752321717E-07  4.5796265750E-04  6.6872282970E-22  2.8250536332E-05 -7.6587874217E-06
  4.5796265750E-04 -7.4397679184E-23  1.7213037173E-04 -1.8828822974E-05  1.5304518851E-05  8.4519506031E-06
  2.8250536332E-05 -7.6587874217E-06  1.5304518851E-05  8.4519506031E-06  1.5091765867E-04  2.0430824377E-05

 Tensor_qq(ke,je,3,1), prototypical atom
  1.2065950154E-04 -1.2271525493E-05  2.8250536332E-05  7.6587874217E-06  7.0266782054E-04 -2.6748913188E-21
  2.8250536332E-05  7.6587874217E-06 -9.4878416823E-05  3.7228270671E-05  2.9133858346E-04 -2.1673052819E-05
  7.0266782054E-04  0.0000000000E+00  2.9133858346E-04 -2.1673052819E-05 -8.8256966809E-05 -2.7023656766E-05

 Tensor_qq(ke,je,1,2), prototypical atom
 -3.1934712376E-04  6.0752321717E-07  4.5796265750E-04  6.6872282970E-22  2.8250536332E-05 -7.6587874217E-06
  4.5796265750E-04 -7.4312050889E-22  1.7213037173E-04 -1.8828822974E-05  1.5304518851E-05  8.4519506031E-06
  2.8250536332E-05 -7.6587874217E-06  1.5304518851E-05  8.4519506031E-06  1.5091765867E-04  2.0430824377E-05

 Tensor_qq(ke,je,2,2), prototypical atom
 -3.3921088786E-04 -2.4775814137E-05  1.7213037173E-04  1.8828822974E-05 -9.4878416823E-05 -3.7228270671E-05
  1.7213037173E-04  1.8828822974E-05  7.2120214849E-04  2.2272944479E-37 -2.9790028818E-04 -1.2404429809E-05
 -9.4878416823E-05 -3.7228270671E-05 -2.9790028818E-04 -1.2404429809E-05 -4.0422644592E-04  2.9229231770E-05

 Tensor_qq(ke,je,3,2), prototypical atom
  9.9617982527E-05  9.4465847895E-06  1.5304518851E-05 -8.4519506031E-06  2.9133858346E-04  2.1673052819E-05
  1.5304518851E-05 -8.4519506031E-06 -2.9790028818E-04  1.2404429809E-05  4.0935951496E-04  6.8951832965E-22
  2.9133858346E-04  2.1673052819E-05  4.0935951496E-04  6.6872282970E-22  1.9416037923E-04 -2.5021177899E-05

 Tensor_qq(ke,je,1,3), prototypical atom
  1.2065950154E-04 -1.2271525493E-05  2.8250536332E-05  7.6587874217E-06  7.0266782054E-04  0.0000000000E+00
  2.8250536332E-05  7.6587874217E-06 -9.4878416823E-05  3.7228270671E-05  2.9133858346E-04 -2.1673052819E-05
  7.0266782054E-04  1.3374456594E-21  2.9133858346E-04 -2.1673052819E-05 -8.8256966809E-05 -2.7023656766E-05

 Tensor_qq(ke,je,2,3), prototypical atom
  9.9617982527E-05  9.4465847895E-06  1.5304518851E-05 -8.4519506031E-06  2.9133858346E-04  2.1673052819E-05
  1.5304518851E-05 -8.4519506031E-06 -2.9790028818E-04  1.2404429809E-05  4.0935951496E-04 -1.3166501595E-21
  2.9133858346E-04  2.1673052819E-05  4.0935951496E-04 -1.3374456594E-21  1.9416037923E-04 -2.5021177899E-05

 Tensor_qq(ke,je,3,3), prototypical atom
 -1.3098544981E-04  2.7790081408E-05  1.5091765867E-04 -2.0430824377E-05 -8.8256966809E-05  2.7023656766E-05
  1.5091765867E-04 -2.0430824377E-05 -4.0422644592E-04 -2.9229231770E-05  1.9416037923E-04  2.5021177899E-05
 -8.8256966809E-05  2.7023656766E-05  1.9416037923E-04  2.5021177899E-05  6.0929598433E-04 -2.6748913188E-21

 Crystal Tensor_dd(ke,ks) (Mbarn)
  5.1713455251E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -5.1934287776E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  3.3307969149E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -5.1934287776E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  3.3578182354E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  3.8625128928E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  9.6527601234E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -2.7136871029E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
  9.6527601234E-04  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21 -1.0478835985E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  0.0000000000E+00  3.6637012600E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
  3.6637012600E-03  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21  1.2243615081E-04  0.0000000000E+00
  0.0000000000E+00  3.3881317890E-21  1.2243615081E-04  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21

 Crystal Tensor_qq(ke,je,3,1)
  9.6527601234E-04  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21  5.6213425644E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -7.5902733458E-04  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21
  5.6213425644E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -7.0605573448E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  2.1175823681E-22  3.6637012600E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.6637012600E-03  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21  1.2243615081E-04  0.0000000000E+00
  0.0000000000E+00  3.3881317890E-21  1.2243615081E-04  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21

 Crystal Tensor_qq(ke,je,2,2)
 -2.7136871029E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -7.5902733458E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  5.7696171879E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
 -7.5902733458E-04  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21 -3.2338115673E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  0.0000000000E+00  1.2243615081E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.2243615081E-04  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21  3.2748761197E-03  0.0000000000E+00
  0.0000000000E+00 -6.7762635780E-21  3.2748761197E-03  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21

 Crystal Tensor_qq(ke,je,1,3)
  9.6527601234E-04  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21  5.6213425644E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -7.5902733458E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  5.6213425644E-03  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21 -7.0605573448E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  3.3881317890E-21  1.2243615081E-04  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21
  1.2243615081E-04  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21  3.2748761197E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  3.2748761197E-03  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21

 Crystal Tensor_qq(ke,je,3,3)
 -1.0478835985E-03  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21 -7.0605573448E-04  0.0000000000E+00
  0.0000000000E+00  6.7762635780E-21 -3.2338115673E-03  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21
 -7.0605573448E-04  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21  4.8743678747E-03  0.0000000000E+00

 Convertion factor =  78.04963 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -11.200  5.26389E-02  4.54651E-02  3.68661E-02  3.98133E-02  3.90909E-02  3.98265E-02  4.34786E-02
   dip-dip  4.92584E-02  4.12832E-02  3.33080E-02  3.46706E-02  3.60332E-02  3.45546E-02  3.95332E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  3.38046E-03  4.18189E-03  3.55812E-03  5.14274E-03  3.05765E-03  5.27185E-03  3.94544E-03

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -7.62986E-17  2.10975E-03 -1.35389E-16  1.22846E-03  3.61274E-18 -1.92485E-03 -2.10243E-17  6.84221E-03
   dip-dip -6.59464E-17  1.11784E-16 -1.23574E-16  1.50841E-16 -1.77044E-18  6.38909E-04 -2.50655E-17  4.28351E-03
   dip-qua -2.37513E-18 -3.42860E-18 -6.16331E-18 -1.19136E-17  4.84492E-18  7.29066E-18  2.72494E-18 -6.68217E-18
   qua-qua -7.97706E-18  2.10975E-03 -5.65127E-18  1.22846E-03  5.38256E-19 -2.56375E-03  1.31628E-18  2.55870E-03

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -11.10000 eV

 Vmoy = -20.21928 eV, Vmftabs(up) = -25.37107 eV, Vmftabs(dn) = -25.06641 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 3

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -1.502E-05   7.950E-03   1.226E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.201E-05   6.353E-03   9.801E-04
  1 -1    1  1    -7.281E-03   2.201E-01   2.098E-02
  1 -1    1  2     7.937E-04  -2.367E-02  -2.222E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -2.551E-03   7.757E-02   7.442E-03
  1  0    1  1    -6.058E-03   1.836E-01   1.756E-02
  1  0    1  2     7.150E-04  -2.133E-02  -2.002E-03
  1  0    2  1     7.864E-04  -2.300E-02  -2.110E-03
  1  0    2  2    -2.831E-03   8.577E-02   8.194E-03
  1  1    1  1    -5.056E-03   1.537E-01   1.475E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     7.084E-04  -2.072E-02  -1.900E-03
  1  1    2  2    -3.056E-03   9.235E-02   8.798E-03
  2 -2    1  1     3.763E-04  -1.867E-02  -3.009E-03
  2 -2    1  2    -2.228E-06   9.905E-05   1.461E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     3.486E-04  -1.733E-02  -2.795E-03
  2 -1    1  1     3.751E-04  -1.862E-02  -3.001E-03
  2 -1    1  2    -2.728E-06   1.213E-04   1.789E-05
  2 -1    2  1    -2.264E-06   1.001E-04   1.469E-05
  2 -1    2  2     3.497E-04  -1.737E-02  -2.802E-03
  2  0    1  1     3.739E-04  -1.857E-02  -2.993E-03
  2  0    1  2    -2.728E-06   1.213E-04   1.789E-05
  2  0    2  1    -2.772E-06   1.225E-04   1.798E-05
  2  0    2  2     3.508E-04  -1.742E-02  -2.808E-03
  2  1    1  1     3.727E-04  -1.852E-02  -2.985E-03
  2  1    1  2    -2.227E-06   9.900E-05   1.460E-05
  2  1    2  1    -2.772E-06   1.225E-04   1.798E-05
  2  1    2  2     3.518E-04  -1.747E-02  -2.815E-03
  2  2    1  1     3.715E-04  -1.846E-02  -2.978E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -2.263E-06   1.000E-04   1.468E-05
  2  2    2  2     3.529E-04  -1.752E-02  -2.822E-03
  3 -3    1  1     2.121E-05  -1.391E-03  -2.879E-04
  3 -3    1  2    -2.519E-08   1.282E-06   2.108E-07
  3 -3    2  1     0.000E+00   0.000E+00   0.000E+00
  3 -3    2  2     2.177E-05  -1.428E-03  -2.958E-04
  3 -2    1  1     2.120E-05  -1.390E-03  -2.878E-04
  3 -2    1  2    -3.252E-08   1.655E-06   2.721E-07
  3 -2    2  1    -2.443E-08   1.243E-06   2.043E-07
  3 -2    2  2     2.178E-05  -1.429E-03  -2.959E-04
  3 -1    1  1     2.119E-05  -1.390E-03  -2.877E-04
  3 -1    1  2    -3.562E-08   1.813E-06   2.981E-07
  3 -1    2  1    -3.154E-08   1.604E-06   2.637E-07
  3 -1    2  2     2.179E-05  -1.429E-03  -2.960E-04
  3  0    1  1     2.118E-05  -1.389E-03  -2.876E-04
  3  0    1  2    -3.562E-08   1.813E-06   2.981E-07
  3  0    2  1    -3.455E-08   1.757E-06   2.889E-07
  3  0    2  2     2.180E-05  -1.430E-03  -2.961E-04
  3  1    1  1     2.117E-05  -1.389E-03  -2.875E-04
  3  1    1  2    -3.252E-08   1.655E-06   2.721E-07
  3  1    2  1    -3.455E-08   1.757E-06   2.889E-07
  3  1    2  2     2.181E-05  -1.430E-03  -2.962E-04
  3  2    1  1     2.116E-05  -1.388E-03  -2.874E-04
  3  2    1  2    -2.519E-08   1.282E-06   2.108E-07
  3  2    2  1    -3.154E-08   1.604E-06   2.637E-07
  3  2    2  2     2.182E-05  -1.431E-03  -2.963E-04
  3  3    1  1     2.115E-05  -1.388E-03  -2.874E-04
  3  3    1  2     0.000E+00   0.000E+00   0.000E+00
  3  3    2  1    -2.443E-08   1.243E-06   2.043E-07
  3  3    2  2     2.183E-05  -1.431E-03  -2.964E-04

 iapr =  1, Z = 23, lmax = 3

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  5.7316580934E-03  0.0000000000E+00  4.4248589813E-04  2.7820402817E-05 -4.3351520738E-04  4.1463154923E-05
  4.4248589813E-04 -2.7820402817E-05  4.1830787389E-03  5.9395607658E-37  2.1910820857E-05  7.5815889308E-06
 -4.3351520738E-04 -4.1463154923E-05  2.1910820857E-05 -7.5815889308E-06  3.9285539431E-03 -2.6749403652E-21

 Tensor_dq(1,ks,j2), prototypical atom
 -2.2526108541E-04 -1.6355700722E-05 -9.4714146039E-05  8.5940708593E-06 -8.1996312153E-04 -8.2947290977E-07
 -9.4714146039E-05  8.5940708593E-06  1.2801952121E-04  4.2166936493E-05 -4.8652672522E-04 -2.1232588788E-05
 -8.1996312153E-04 -8.2947290977E-07 -4.8652672522E-04 -2.1232588788E-05  2.1091390249E-04 -2.7349016703E-05

 Tensor_dq(2,ks,j2), prototypical atom
 -3.7848283465E-04  1.9576885614E-06  2.3688833623E-04  1.4834285490E-06 -2.1871899330E-04  8.8415115891E-07
  2.3688833623E-04  1.4834285490E-06  3.8221979733E-04  2.0292225010E-06 -6.0063661509E-06 -1.0073137269E-06
 -2.1871899330E-04  8.8415115891E-07 -6.0063661509E-06 -1.0073137269E-06  1.2538017741E-05 -4.5107144242E-06

 Tensor_dq(3,ks,j2), prototypical atom
 -3.4271824832E-05  1.8062856507E-05 -4.3133708785E-05 -1.6261216117E-05  3.7440740837E-04  1.9966944724E-05
 -4.3133708785E-05 -1.6261216117E-05  4.2963208584E-04 -1.9199498461E-05 -1.5645307977E-04  2.0523549554E-05
  3.7440740837E-04  1.9966944724E-05 -1.5645307977E-04  2.0523549554E-05 -5.3467608322E-04 -6.7978230269E-07

 Tensor_qq(ke,je,1,1), prototypical atom
  3.6369149085E-04  6.6873509130E-22 -1.9306720307E-04 -1.3949286724E-06  7.8925434895E-05  7.9076576907E-06
 -1.9306720307E-04 -1.3949286724E-06 -2.3822015646E-04  1.4099183858E-05  4.9852741726E-05 -4.3773600159E-06
  7.8925434895E-05  7.9076576907E-06  4.9852741726E-05 -4.3773600159E-06 -1.0806921211E-04 -1.5804429844E-05

 Tensor_qq(ke,je,2,1), prototypical atom
 -1.9306720307E-04  1.3949286724E-06  3.4086812510E-04  0.0000000000E+00  3.0927059310E-05 -6.5403911331E-06
  3.4086812510E-04 -1.7082385154E-22  1.0554360841E-04 -1.1563138693E-05  1.6426139316E-05  4.2845506376E-06
  3.0927059310E-05 -6.5403911331E-06  1.6426139316E-05  4.2845506376E-06  8.9594919276E-05  1.1579150550E-05

 Tensor_qq(ke,je,3,1), prototypical atom
  7.8925434895E-05 -7.9076576907E-06  3.0927059310E-05  6.5403911331E-06  5.3171401012E-04  0.0000000000E+00
  3.0927059310E-05  6.5403911331E-06 -1.0017764536E-05  1.9628621997E-05  1.4812183519E-04 -1.2847903845E-05
  5.3171401012E-04 -6.6873509130E-22  1.4812183519E-04 -1.2847903845E-05 -1.2645407694E-04 -1.3077714011E-05

 Tensor_qq(ke,je,1,2), prototypical atom
 -1.9306720307E-04  1.3949286724E-06  3.4086812510E-04  0.0000000000E+00  3.0927059310E-05 -6.5403911331E-06
  3.4086812510E-04 -1.7082385154E-22  1.0554360841E-04 -1.1563138693E-05  1.6426139316E-05  4.2845506376E-06
  3.0927059310E-05 -6.5403911331E-06  1.6426139316E-05  4.2845506376E-06  8.9594919276E-05  1.1579150550E-05

 Tensor_qq(ke,je,2,2), prototypical atom
 -2.3822015646E-04 -1.4099183858E-05  1.0554360841E-04  1.1563138693E-05 -1.0017764536E-05 -1.9628621997E-05
  1.0554360841E-04  1.1563138693E-05  5.3447592122E-04  2.3201409242E-37 -1.6249855864E-04 -9.2860688558E-06
 -1.0017764536E-05 -1.9628621997E-05 -1.6249855864E-04 -9.2860688558E-06 -3.2261277940E-04  1.6293550374E-05

 Tensor_qq(ke,je,3,2), prototypical atom
  4.9852741726E-05  4.3773600159E-06  1.6426139316E-05 -4.2845506376E-06  1.4812183519E-04  1.2847903845E-05
  1.6426139316E-05 -4.2845506376E-06 -1.6249855864E-04  9.2860688558E-06  2.8174326778E-04  4.3284280565E-22
  1.4812183519E-04  1.2847903845E-05  2.8174326778E-04  3.3436754565E-22  1.1447192655E-04 -1.5886891317E-05

 Tensor_qq(ke,je,1,3), prototypical atom
  7.8925434895E-05 -7.9076576907E-06  3.0927059310E-05  6.5403911331E-06  5.3171401012E-04 -1.3374701826E-21
  3.0927059310E-05  6.5403911331E-06 -1.0017764536E-05  1.9628621997E-05  1.4812183519E-04 -1.2847903845E-05
  5.3171401012E-04 -6.6873509130E-22  1.4812183519E-04 -1.2847903845E-05 -1.2645407694E-04 -1.3077714011E-05

 Tensor_qq(ke,je,2,3), prototypical atom
  4.9852741726E-05  4.3773600159E-06  1.6426139316E-05 -4.2845506376E-06  1.4812183519E-04  1.2847903845E-05
  1.6426139316E-05 -4.2845506376E-06 -1.6249855864E-04  9.2860688558E-06  2.8174326778E-04 -2.3589228565E-22
  1.4812183519E-04  1.2847903845E-05  2.8174326778E-04  0.0000000000E+00  1.1447192655E-04 -1.5886891317E-05

 Tensor_qq(ke,je,3,3), prototypical atom
 -1.0806921211E-04  1.5804429844E-05  8.9594919276E-05 -1.1579150550E-05 -1.2645407694E-04  1.3077714011E-05
  8.9594919276E-05 -1.1579150550E-05 -3.2261277940E-04 -1.6293550374E-05  1.1447192655E-04  1.5886891317E-05
 -1.2645407694E-04  1.3077714011E-05  1.1447192655E-04  1.5886891317E-05  5.0910286532E-04  1.3374701826E-21

 Crystal Tensor_dd(ke,ks) (Mbarn)
  4.5853264747E-02  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21 -3.4681216590E-03  0.0000000000E+00
  0.0000000000E+00  6.7762635780E-21  3.3464629911E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -3.4681216590E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  3.1428431545E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  2.9095319268E-03  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22  6.3140347916E-04  0.0000000000E+00
  0.0000000000E+00  4.2351647363E-22 -1.9057612517E-03  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21
  6.3140347916E-04  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21 -8.6455369684E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00 -4.2351647363E-22  2.7269450008E-03  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21
  2.7269450008E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21  1.3140911453E-04  0.0000000000E+00
  0.0000000000E+00  1.6940658945E-21  1.3140911453E-04  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21

 Crystal Tensor_qq(ke,je,3,1)
  6.3140347916E-04  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21  4.2537120810E-03  0.0000000000E+00
  0.0000000000E+00  1.6940658945E-21 -8.0142116290E-05  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
  4.2537120810E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21 -1.0116326155E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  0.0000000000E+00  2.7269450008E-03  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21
  2.7269450008E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21  1.3140911453E-04  0.0000000000E+00
  0.0000000000E+00  1.6940658945E-21  1.3140911453E-04  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21

 Crystal Tensor_qq(ke,je,2,2)
 -1.9057612517E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21 -8.0142116290E-05  0.0000000000E+00
  0.0000000000E+00  3.3881317890E-21  4.2758073698E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -8.0142116290E-05  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -2.5809022352E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  1.6940658945E-21  1.3140911453E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.3140911453E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  2.2539461422E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.2539461422E-03  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21

 Crystal Tensor_qq(ke,je,1,3)
  6.3140347916E-04  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21  4.2537120810E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -8.0142116290E-05  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
  4.2537120810E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21 -1.0116326155E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  0.0000000000E+00  1.3140911453E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.3140911453E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  2.2539461422E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.2539461422E-03  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21

 Crystal Tensor_qq(ke,je,3,3)
 -8.6455369684E-04  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21 -1.0116326155E-03  0.0000000000E+00
  0.0000000000E+00 -3.3881317890E-21 -2.5809022352E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -1.0116326155E-03  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21  4.0728229226E-03  0.0000000000E+00

 Convertion factor =  78.05106 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -11.100  4.56465E-02  4.18601E-02  3.60458E-02  3.72489E-02  3.65351E-02  3.60276E-02  3.98697E-02
   dip-dip  4.32468E-02  3.83557E-02  3.34646E-02  3.37498E-02  3.40349E-02  3.20962E-02  3.69154E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  2.39968E-03  3.50442E-03  2.58121E-03  3.49918E-03  2.50017E-03  3.93141E-03  2.95421E-03

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -8.89438E-17  1.08797E-03 -8.69681E-17  7.12325E-04 -4.94392E-18 -1.01826E-03  1.43903E-17  3.51861E-03
   dip-dip -8.06427E-17  1.12165E-16 -7.80998E-17  1.65322E-16 -7.49883E-18  3.35267E-04  1.31572E-17  2.19187E-03
   dip-qua -2.97437E-18 -3.14720E-18 -4.14493E-18 -1.02854E-17  2.70065E-18  5.11237E-18  5.21064E-19 -4.39319E-18
   qua-qua -5.32671E-18  1.08797E-03 -4.72338E-18  7.12325E-04 -1.45743E-19 -1.35353E-03  7.11991E-19  1.32674E-03

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -11.00000 eV

 Vmoy = -20.22121 eV, Vmftabs(up) = -25.37127 eV, Vmftabs(dn) = -25.06661 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 3

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -1.483E-05   7.851E-03   1.211E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.189E-05   6.290E-03   9.703E-04
  1 -1    1  1    -7.140E-03   2.158E-01   2.057E-02
  1 -1    1  2     7.757E-04  -2.313E-02  -2.171E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -2.516E-03   7.650E-02   7.339E-03
  1  0    1  1    -5.950E-03   1.803E-01   1.724E-02
  1  0    1  2     6.996E-04  -2.086E-02  -1.958E-03
  1  0    2  1     7.686E-04  -2.247E-02  -2.061E-03
  1  0    2  2    -2.791E-03   8.454E-02   8.077E-03
  1  1    1  1    -4.972E-03   1.512E-01   1.451E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     6.932E-04  -2.027E-02  -1.859E-03
  1  1    2  2    -3.012E-03   9.100E-02   8.669E-03
  2 -2    1  1     3.697E-04  -1.835E-02  -2.956E-03
  2 -2    1  2    -2.191E-06   9.743E-05   1.437E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     3.424E-04  -1.702E-02  -2.745E-03
  2 -1    1  1     3.685E-04  -1.830E-02  -2.948E-03
  2 -1    1  2    -2.683E-06   1.193E-04   1.760E-05
  2 -1    2  1    -2.227E-06   9.845E-05   1.445E-05
  2 -1    2  2     3.435E-04  -1.707E-02  -2.752E-03
  2  0    1  1     3.673E-04  -1.824E-02  -2.941E-03
  2  0    1  2    -2.683E-06   1.193E-04   1.760E-05
  2  0    2  1    -2.727E-06   1.206E-04   1.769E-05
  2  0    2  2     3.445E-04  -1.711E-02  -2.759E-03
  2  1    1  1     3.662E-04  -1.819E-02  -2.933E-03
  2  1    1  2    -2.190E-06   9.739E-05   1.437E-05
  2  1    2  1    -2.726E-06   1.205E-04   1.769E-05
  2  1    2  2     3.456E-04  -1.716E-02  -2.765E-03
  2  2    1  1     3.650E-04  -1.814E-02  -2.925E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -2.226E-06   9.841E-05   1.444E-05
  2  2    2  2     3.466E-04  -1.720E-02  -2.772E-03
  3 -3    1  1     2.060E-05  -1.350E-03  -2.795E-04
  3 -3    1  2    -2.446E-08   1.245E-06   2.048E-07
  3 -3    2  1     0.000E+00   0.000E+00   0.000E+00
  3 -3    2  2     2.114E-05  -1.387E-03  -2.873E-04
  3 -2    1  1     2.059E-05  -1.350E-03  -2.795E-04
  3 -2    1  2    -3.158E-08   1.607E-06   2.643E-07
  3 -2    2  1    -2.373E-08   1.207E-06   1.984E-07
  3 -2    2  2     2.115E-05  -1.388E-03  -2.874E-04
  3 -1    1  1     2.058E-05  -1.350E-03  -2.794E-04
  3 -1    1  2    -3.460E-08   1.760E-06   2.896E-07
  3 -1    2  1    -3.064E-08   1.558E-06   2.561E-07
  3 -1    2  2     2.116E-05  -1.388E-03  -2.875E-04
  3  0    1  1     2.057E-05  -1.349E-03  -2.793E-04
  3  0    1  2    -3.460E-08   1.760E-06   2.896E-07
  3  0    2  1    -3.356E-08   1.707E-06   2.806E-07
  3  0    2  2     2.117E-05  -1.389E-03  -2.876E-04
  3  1    1  1     2.056E-05  -1.349E-03  -2.792E-04
  3  1    1  2    -3.158E-08   1.607E-06   2.643E-07
  3  1    2  1    -3.356E-08   1.707E-06   2.806E-07
  3  1    2  2     2.118E-05  -1.389E-03  -2.876E-04
  3  2    1  1     2.055E-05  -1.348E-03  -2.791E-04
  3  2    1  2    -2.446E-08   1.245E-06   2.048E-07
  3  2    2  1    -3.064E-08   1.558E-06   2.561E-07
  3  2    2  2     2.119E-05  -1.390E-03  -2.877E-04
  3  3    1  1     2.054E-05  -1.348E-03  -2.791E-04
  3  3    1  2     0.000E+00   0.000E+00   0.000E+00
  3  3    2  1    -2.373E-08   1.207E-06   1.984E-07
  3  3    2  2     2.120E-05  -1.390E-03  -2.878E-04

 iapr =  1, Z = 23, lmax = 3

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  5.3884092474E-03  0.0000000000E+00  3.4944974279E-04  2.5505124286E-05 -3.1939982575E-04  1.8850969474E-05
  3.4944974279E-04 -2.5505124286E-05  4.3193158894E-03  2.9698348353E-37 -7.2769728965E-05 -1.0135660243E-05
 -3.1939982575E-04 -1.8850969474E-05 -7.2769728965E-05  1.0135660243E-05  3.9415051336E-03 -1.3374947058E-21

 Tensor_dq(1,ks,j2), prototypical atom
 -1.7251084658E-04 -1.1953954148E-05 -1.3694977593E-04  5.3948031747E-06 -6.3548848671E-04 -3.5212347505E-06
 -1.3694977593E-04  5.3948031747E-06  3.1452819451E-05  2.5552578812E-05 -3.7298428625E-04 -1.2713783017E-05
 -6.3548848671E-04 -3.5212347505E-06 -3.7298428625E-04 -1.2713783017E-05  2.5149675217E-04 -1.3835315140E-05

 Tensor_dq(2,ks,j2), prototypical atom
 -3.6590680491E-04  3.9965559459E-07  2.0273060565E-04  3.2309668707E-06 -2.3114868796E-04 -5.9313785118E-06
  2.0273060565E-04  3.2309668707E-06  3.3191022659E-04 -4.5842728979E-06  6.7964290830E-05  1.6440019874E-06
 -2.3114868796E-04 -5.9313785118E-06  6.7964290830E-05  1.6440019874E-06  5.7493174153E-05  5.2196301093E-06

 Tensor_dq(3,ks,j2), prototypical atom
 -1.3519410605E-05  1.0709384416E-05 -5.9672870124E-05 -1.3599038714E-05  4.2927651818E-04  9.0193156920E-06
 -5.9672870124E-05 -1.3599038714E-05  4.0912628904E-04 -1.1192174833E-05 -1.6713983474E-04  1.6513994933E-05
  4.2927651818E-04  9.0193156920E-06 -1.6713983474E-04  1.6513994933E-05 -5.6620250922E-04 -6.9246906044E-07

 Tensor_qq(ke,je,1,1), prototypical atom
  3.2374553264E-04  0.0000000000E+00 -1.3196760954E-04 -1.5644657954E-06  6.5008967242E-05  6.4088330498E-06
 -1.3196760954E-04 -1.5644657954E-06 -1.9280556606E-04  9.9650231202E-06  2.1482488689E-05 -2.3927738155E-06
  6.5008967242E-05  6.4088330498E-06  2.1482488689E-05 -2.3927738155E-06 -1.1035900969E-04 -1.0932268742E-05

 Tensor_qq(ke,je,2,1), prototypical atom
 -1.3196760954E-04  1.5644657954E-06  2.9489606469E-04  0.0000000000E+00  3.7974681000E-05 -6.5354193277E-06
  2.9489606469E-04 -2.4398637114E-23  7.1599040888E-05 -8.0892801562E-06  2.2345767931E-05  2.7215079287E-06
  3.7974681000E-05 -6.5354193277E-06  2.2345767931E-05  2.7215079287E-06  6.2485929063E-05  7.5204821761E-06

 Tensor_qq(ke,je,3,1), prototypical atom
  6.5008967242E-05 -6.4088330498E-06  3.7974681000E-05  6.5354193277E-06  4.9907232778E-04 -6.6874735289E-22
  3.7974681000E-05  6.5354193277E-06  5.2300044307E-05  1.2359610498E-05  6.9730304551E-05 -9.7573539075E-06
  4.9907232778E-04  6.6874735289E-22  6.9730304551E-05 -9.7573539075E-06 -1.8615891994E-04 -7.0580505459E-06

 Tensor_qq(ke,je,1,2), prototypical atom
 -1.3196760954E-04  1.5644657954E-06  2.9489606469E-04  0.0000000000E+00  3.7974681000E-05 -6.5354193277E-06
  2.9489606469E-04 -2.4398637114E-23  7.1599040888E-05 -8.0892801562E-06  2.2345767931E-05  2.7215079287E-06
  3.7974681000E-05 -6.5354193277E-06  2.2345767931E-05  2.7215079287E-06  6.2485929063E-05  7.5204821761E-06

 Tensor_qq(ke,je,2,2), prototypical atom
 -1.9280556606E-04 -9.9650231202E-06  7.1599040888E-05  8.0892801562E-06  5.2300044307E-05 -1.2359610498E-05
  7.1599040888E-05  8.0892801562E-06  4.7252163149E-04  1.8561467721E-37 -1.0299178147E-04 -8.3908594739E-06
  5.2300044307E-05 -1.2359610498E-05 -1.0299178147E-04 -8.3908594739E-06 -3.1980901848E-04  1.0905459879E-05

 Tensor_qq(ke,je,3,2), prototypical atom
  2.1482488689E-05  2.3927738155E-06  2.2345767931E-05 -2.7215079287E-06  6.9730304551E-05  9.7573539075E-06
  2.2345767931E-05 -2.7215079287E-06 -1.0299178147E-04  8.3908594739E-06  2.3219732640E-04  3.0978978484E-22
  6.9730304551E-05  9.7573539075E-06  2.3219732640E-04 -1.6718683822E-22  9.0415043910E-05 -1.2866739583E-05

 Tensor_qq(ke,je,1,3), prototypical atom
  6.5008967242E-05 -6.4088330498E-06  3.7974681000E-05  6.5354193277E-06  4.9907232778E-04 -6.6874735289E-22
  3.7974681000E-05  6.5354193277E-06  5.2300044307E-05  1.2359610498E-05  6.9730304551E-05 -9.7573539075E-06
  4.9907232778E-04 -6.6874735289E-22  6.9730304551E-05 -9.7573539075E-06 -1.8615891994E-04 -7.0580505459E-06

 Tensor_qq(ke,je,2,3), prototypical atom
  2.1482488689E-05  2.3927738155E-06  2.2345767931E-05 -2.7215079287E-06  6.9730304551E-05  9.7573539075E-06
  2.2345767931E-05 -2.7215079287E-06 -1.0299178147E-04  8.3908594739E-06  2.3219732640E-04  1.4260294662E-22
  6.9730304551E-05  9.7573539075E-06  2.3219732640E-04  0.0000000000E+00  9.0415043910E-05 -1.2866739583E-05

 Tensor_qq(ke,je,3,3), prototypical atom
 -1.1035900969E-04  1.0932268742E-05  6.2485929063E-05 -7.5204821761E-06 -1.8615891994E-04  7.0580505459E-06
  6.2485929063E-05 -7.5204821761E-06 -3.1980901848E-04 -1.0905459879E-05  9.0415043910E-05  1.2866739583E-05
 -1.8615891994E-04  7.0580505459E-06  9.0415043910E-05  1.2866739583E-05  5.3028979825E-04  2.0062420587E-21

 Crystal Tensor_dd(ke,ks) (Mbarn)
  4.3107273979E-02  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21 -2.5551986060E-03  0.0000000000E+00
  0.0000000000E+00 -6.7762635780E-21  3.4554527116E-02  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
 -2.5551986060E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21  3.1532041069E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  2.5899642611E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  5.2007173793E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -1.5424445285E-03  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22
  5.2007173793E-04  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22 -8.8287207749E-04  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  4.2351647363E-22  2.3591685175E-03  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21
  2.3591685175E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21  1.7876614345E-04  0.0000000000E+00
  0.0000000000E+00 -1.6940658945E-21  1.7876614345E-04  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21

 Crystal Tensor_qq(ke,je,3,1)
  5.2007173793E-04  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21  3.9925786222E-03  0.0000000000E+00
  0.0000000000E+00 -1.6940658945E-21  4.1840035446E-04  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21
  3.9925786222E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21 -1.4892713595E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  4.2351647363E-22  2.3591685175E-03  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21
  2.3591685175E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21  1.7876614345E-04  0.0000000000E+00
  0.0000000000E+00 -1.6940658945E-21  1.7876614345E-04  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21

 Crystal Tensor_qq(ke,je,2,2)
 -1.5424445285E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.1840035446E-04  0.0000000000E+00
  0.0000000000E+00 -3.3881317890E-21  3.7801730519E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  4.1840035446E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -2.5584721478E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  0.0000000000E+00  1.7876614345E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.7876614345E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.8575786112E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.8575786112E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21

 Crystal Tensor_qq(ke,je,1,3)
  5.2007173793E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  3.9925786222E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  4.1840035446E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.9925786222E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -1.4892713595E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00 -8.4703294725E-22  1.7876614345E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  1.7876614345E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.8575786112E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.8575786112E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21

 Crystal Tensor_qq(ke,je,3,3)
 -8.8287207749E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -1.4892713595E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -2.5584721478E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
 -1.4892713595E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21  4.2423183860E-03  0.0000000000E+00

 Convertion factor =  78.05249 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -11.000  4.27642E-02  4.12337E-02  3.67980E-02  3.70230E-02  3.63732E-02  3.56477E-02  3.90796E-02
   dip-dip  4.07910E-02  3.76728E-02  3.45545E-02  3.42014E-02  3.38483E-02  3.20305E-02  3.63979E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  1.97324E-03  3.56093E-03  2.24351E-03  2.82153E-03  2.52489E-03  3.61719E-03  2.68161E-03

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -6.27431E-17  6.59647E-04 -1.00497E-16  5.05763E-04  7.65023E-18 -6.84850E-04 -2.04947E-17  1.81449E-03
   dip-dip -5.33406E-17  1.07095E-16 -9.27663E-17  1.30644E-16  1.12352E-18  1.64665E-04 -1.51456E-17  9.90615E-04
   dip-qua -3.51032E-18 -3.16149E-18 -2.80328E-18 -7.97550E-18  4.63060E-18  4.97229E-18 -4.83386E-18 -3.33971E-18
   qua-qua -5.89220E-18  6.59647E-04 -4.92745E-18  5.05763E-04  1.89611E-18 -8.49515E-04 -5.15273E-19  8.23871E-04

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -10.90000 eV

 Vmoy = -20.22310 eV, Vmftabs(up) = -25.37147 eV, Vmftabs(dn) = -25.06680 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 3

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -1.465E-05   7.754E-03   1.196E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.177E-05   6.228E-03   9.608E-04
  1 -1    1  1    -7.004E-03   2.117E-01   2.018E-02
  1 -1    1  2     7.582E-04  -2.261E-02  -2.122E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -2.482E-03   7.546E-02   7.239E-03
  1  0    1  1    -5.845E-03   1.772E-01   1.694E-02
  1  0    1  2     6.846E-04  -2.041E-02  -1.916E-03
  1  0    2  1     7.512E-04  -2.196E-02  -2.014E-03
  1  0    2  2    -2.751E-03   8.334E-02   7.962E-03
  1  1    1  1    -4.891E-03   1.487E-01   1.427E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     6.784E-04  -1.983E-02  -1.819E-03
  1  1    2  2    -2.968E-03   8.969E-02   8.544E-03
  2 -2    1  1     3.634E-04  -1.803E-02  -2.906E-03
  2 -2    1  2    -2.156E-06   9.589E-05   1.415E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     3.365E-04  -1.673E-02  -2.698E-03
  2 -1    1  1     3.622E-04  -1.798E-02  -2.898E-03
  2 -1    1  2    -2.640E-06   1.174E-04   1.732E-05
  2 -1    2  1    -2.191E-06   9.690E-05   1.422E-05
  2 -1    2  2     3.376E-04  -1.677E-02  -2.704E-03
  2  0    1  1     3.611E-04  -1.793E-02  -2.890E-03
  2  0    1  2    -2.640E-06   1.174E-04   1.732E-05
  2  0    2  1    -2.683E-06   1.187E-04   1.742E-05
  2  0    2  2     3.386E-04  -1.682E-02  -2.711E-03
  2  1    1  1     3.599E-04  -1.788E-02  -2.883E-03
  2  1    1  2    -2.155E-06   9.584E-05   1.414E-05
  2  1    2  1    -2.683E-06   1.186E-04   1.741E-05
  2  1    2  2     3.396E-04  -1.686E-02  -2.718E-03
  2  2    1  1     3.588E-04  -1.783E-02  -2.875E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -2.190E-06   9.685E-05   1.422E-05
  2  2    2  2     3.406E-04  -1.691E-02  -2.724E-03
  3 -3    1  1     2.002E-05  -1.312E-03  -2.717E-04
  3 -3    1  2    -2.377E-08   1.210E-06   1.990E-07
  3 -3    2  1     0.000E+00   0.000E+00   0.000E+00
  3 -3    2  2     2.054E-05  -1.348E-03  -2.792E-04
  3 -2    1  1     2.001E-05  -1.312E-03  -2.716E-04
  3 -2    1  2    -3.069E-08   1.562E-06   2.569E-07
  3 -2    2  1    -2.306E-08   1.173E-06   1.928E-07
  3 -2    2  2     2.055E-05  -1.348E-03  -2.793E-04
  3 -1    1  1     2.000E-05  -1.311E-03  -2.715E-04
  3 -1    1  2    -3.362E-08   1.711E-06   2.814E-07
  3 -1    2  1    -2.977E-08   1.514E-06   2.489E-07
  3 -1    2  2     2.056E-05  -1.349E-03  -2.793E-04
  3  0    1  1     1.999E-05  -1.311E-03  -2.714E-04
  3  0    1  2    -3.362E-08   1.711E-06   2.814E-07
  3  0    2  1    -3.262E-08   1.659E-06   2.727E-07
  3  0    2  2     2.057E-05  -1.349E-03  -2.794E-04
  3  1    1  1     1.998E-05  -1.310E-03  -2.713E-04
  3  1    1  2    -3.069E-08   1.562E-06   2.569E-07
  3  1    2  1    -3.262E-08   1.659E-06   2.727E-07
  3  1    2  2     2.058E-05  -1.350E-03  -2.795E-04
  3  2    1  1     1.997E-05  -1.310E-03  -2.713E-04
  3  2    1  2    -2.377E-08   1.210E-06   1.990E-07
  3  2    2  1    -2.977E-08   1.514E-06   2.489E-07
  3  2    2  2     2.059E-05  -1.350E-03  -2.796E-04
  3  3    1  1     1.996E-05  -1.309E-03  -2.712E-04
  3  3    1  2     0.000E+00   0.000E+00   0.000E+00
  3  3    2  1    -2.306E-08   1.173E-06   1.928E-07
  3  3    2  2     2.060E-05  -1.351E-03  -2.797E-04

 iapr =  1, Z = 23, lmax = 3

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  5.2788967261E-03 -1.6718990362E-22  2.7123907905E-04  3.1549210345E-05 -2.5199375841E-04  1.6071377764E-06
  2.7123907905E-04 -3.1549210345E-05  4.5990124150E-03  0.0000000000E+00 -2.5214239968E-04 -2.5972181288E-05
 -2.5199375841E-04 -1.6071377764E-06 -2.5214239968E-04  2.5972181288E-05  4.2919588651E-03  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
 -1.4834421225E-04 -1.0831195498E-05 -1.8221307083E-04  3.6870121634E-06 -5.5309953050E-04 -8.0734532490E-06
 -1.8221307083E-04  3.6870121634E-06 -2.9366987651E-05  1.6950453808E-05 -3.3374962155E-04 -7.6764378459E-06
 -5.5309953050E-04 -8.0734532490E-06 -3.3374962155E-04 -7.6764378459E-06  2.9448672254E-04 -4.9894405398E-06

 Tensor_dq(2,ks,j2), prototypical atom
 -4.0772925573E-04 -2.8814525548E-06  2.2593177136E-04  7.1887908469E-06 -2.7695015240E-04 -1.0922283103E-05
  2.2593177136E-04  7.1887908469E-06  2.8341852196E-04 -6.2902895585E-06  1.5202364013E-04  3.2301315089E-06
 -2.7695015240E-04 -1.0922283103E-05  1.5202364013E-04  3.2301315089E-06  1.6721364706E-04  1.1440523450E-05

 Tensor_dq(3,ks,j2), prototypical atom
  1.3571251144E-05  9.0235307366E-06 -8.7519221895E-05 -1.4408834964E-05  5.9935013722E-04  1.9649003511E-06
 -8.7519221895E-05 -1.4408834964E-05  5.0257309539E-04 -1.0987738064E-05 -2.2982221266E-04  1.8121619028E-05
  5.9935013722E-04  1.9649003511E-06 -2.2982221266E-04  1.8121619028E-05 -7.6840216290E-04  1.4791601190E-06

 Tensor_qq(ke,je,1,1), prototypical atom
  3.3559106236E-04  0.0000000000E+00 -1.0874704435E-04 -1.1564044420E-06  6.4257030865E-05  7.3875035870E-06
 -1.0874704435E-04 -1.1564044420E-06 -1.7682661076E-04  9.6209097354E-06  1.1993683282E-06 -1.8791633783E-06
  6.4257030865E-05  7.3875035870E-06  1.1993683282E-06 -1.8791633783E-06 -1.3483522272E-04 -1.0193871770E-05

 Tensor_qq(ke,je,2,1), prototypical atom
 -1.0874704435E-04  1.1564044420E-06  2.9359286125E-04  1.6718990362E-22  5.0166440859E-05 -7.6830288110E-06
  2.9359286125E-04  2.5575880890E-23  5.3652905858E-05 -6.1612347660E-06  3.5806074248E-05  2.3514540194E-06
  5.0166440859E-05 -7.6830288110E-06  3.5806074248E-05  2.3514540194E-06  5.9398950362E-05  5.8416284920E-06

 Tensor_qq(ke,je,3,1), prototypical atom
  6.4257030865E-05 -7.3875035870E-06  5.0166440859E-05  7.6830288110E-06  5.6139799028E-04  0.0000000000E+00
  5.0166440859E-05  7.6830288110E-06  1.2227638924E-04  1.1055896446E-05  1.4406479018E-05 -9.4324214917E-06
  5.6139799028E-04  0.0000000000E+00  1.4406479018E-05 -9.4324214917E-06 -2.8517222903E-04 -4.9457301751E-06

 Tensor_qq(ke,je,1,2), prototypical atom
 -1.0874704435E-04  1.1564044420E-06  2.9359286125E-04  1.6718990362E-22  5.0166440859E-05 -7.6830288110E-06
  2.9359286125E-04  2.5575880890E-23  5.3652905858E-05 -6.1612347660E-06  3.5806074248E-05  2.3514540194E-06
  5.0166440859E-05 -7.6830288110E-06  3.5806074248E-05  2.3514540194E-06  5.9398950362E-05  5.8416284920E-06

 Tensor_qq(ke,je,2,2), prototypical atom
 -1.7682661076E-04 -9.6209097354E-06  5.3652905858E-05  6.1612347660E-06  1.2227638924E-04 -1.1055896446E-05
  5.3652905858E-05  6.1612347660E-06  4.9092492494E-04  1.4849446439E-37 -8.8284999052E-05 -8.4542559332E-06
  1.2227638924E-04 -1.1055896446E-05 -8.8284999052E-05 -8.4542559332E-06 -3.8317126674E-04  9.7636906321E-06

 Tensor_qq(ke,je,3,2), prototypical atom
  1.1993683282E-06  1.8791633783E-06  3.5806074248E-05 -2.3514540194E-06  1.4406479018E-05  9.4324214917E-06
  3.5806074248E-05 -2.3514540194E-06 -8.8284999052E-05  8.4542559332E-06  2.2585559535E-04 -1.5196090734E-22
  1.4406479018E-05  9.4324214917E-06  2.2585559535E-04 -1.6718990362E-22  1.0866370858E-04 -1.2807503813E-05

 Tensor_qq(ke,je,1,3), prototypical atom
  6.4257030865E-05 -7.3875035870E-06  5.0166440859E-05  7.6830288110E-06  5.6139799028E-04 -6.6875961448E-22
  5.0166440859E-05  7.6830288110E-06  1.2227638924E-04  1.1055896446E-05  1.4406479018E-05 -9.4324214917E-06
  5.6139799028E-04  0.0000000000E+00  1.4406479018E-05 -9.4324214917E-06 -2.8517222903E-04 -4.9457301751E-06

 Tensor_qq(ke,je,2,3), prototypical atom
  1.1993683282E-06  1.8791633783E-06  3.5806074248E-05 -2.3514540194E-06  1.4406479018E-05  9.4324214917E-06
  3.5806074248E-05 -2.3514540194E-06 -8.8284999052E-05  8.4542559332E-06  2.2585559535E-04  1.8241889990E-22
  1.4406479018E-05  9.4324214917E-06  2.2585559535E-04  0.0000000000E+00  1.0866370858E-04 -1.2807503813E-05

 Tensor_qq(ke,je,3,3), prototypical atom
 -1.3483522272E-04  1.0193871770E-05  5.9398950362E-05 -5.8416284920E-06 -2.8517222903E-04  4.9457301751E-06
  5.9398950362E-05 -5.8416284920E-06 -3.8317126674E-04 -9.7636906321E-06  1.0866370858E-04  1.2807503813E-05
 -2.8517222903E-04  4.9457301751E-06  1.0866370858E-04  1.2807503813E-05  6.6541981919E-04  6.6875961448E-22

 Crystal Tensor_dd(ke,ks) (Mbarn)
  4.2231173809E-02  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20 -2.0159500673E-03  0.0000000000E+00
  0.0000000000E+00 -1.3552527156E-20  3.6792099320E-02  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21
 -2.0159500673E-03  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21  3.4335670921E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  2.6847284989E-03  0.0000000000E+00  0.0000000000E+00 -4.2351647363E-22  5.1405624692E-04  0.0000000000E+00
  0.0000000000E+00 -4.2351647363E-22 -1.4146128861E-03  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22
  5.1405624692E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -1.0786817818E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  0.0000000000E+00  2.3487428900E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
  2.3487428900E-03  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21  2.8644859399E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.8644859399E-04  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21

 Crystal Tensor_qq(ke,je,3,1)
  5.1405624692E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.4911839223E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  9.7821111392E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  4.4911839223E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -2.2813778322E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00 -4.2351647363E-22  2.3487428900E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  2.3487428900E-03  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21  2.8644859399E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.8644859399E-04  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21

 Crystal Tensor_qq(ke,je,2,2)
 -1.4146128861E-03  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21  9.7821111392E-04  0.0000000000E+00
  0.0000000000E+00  1.6940658945E-21  3.9273993995E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  9.7821111392E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -3.0653701339E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  4.2351647363E-22  2.8644859399E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  2.8644859399E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.8068447628E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.8068447628E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21

 Crystal Tensor_qq(ke,je,1,3)
  5.1405624692E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.4911839223E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  9.7821111392E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  4.4911839223E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -2.2813778322E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  4.2351647363E-22  2.8644859399E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  2.8644859399E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.8068447628E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.8068447628E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21

 Crystal Tensor_qq(ke,je,3,3)
 -1.0786817818E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -2.2813778322E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -3.0653701339E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
 -2.2813778322E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21  5.3233585535E-03  0.0000000000E+00

 Convertion factor =  78.05392 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -10.900  4.27603E-02  4.31165E-02  3.91079E-02  3.88868E-02  3.86933E-02  3.87060E-02  4.06819E-02
   dip-dip  4.09206E-02  3.88563E-02  3.67921E-02  3.62192E-02  3.56463E-02  3.47205E-02  3.77863E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  1.83975E-03  4.26019E-03  2.31584E-03  2.66760E-03  3.04702E-03  3.98552E-03  2.89563E-03

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -7.74627E-17  5.54153E-04 -1.04425E-16  5.02131E-04 -1.03848E-17 -7.02329E-04 -3.47456E-18  7.88289E-04
   dip-dip -6.77060E-17  1.17702E-16 -9.40741E-17  1.47377E-16 -1.49070E-17  3.74525E-05 -5.16183E-18  6.97156E-05
   dip-qua -1.46263E-18 -3.59092E-18 -3.12265E-18 -8.07324E-18  2.07069E-18  5.03364E-18  1.64187E-18 -3.51230E-18
   qua-qua -8.29408E-18  5.54153E-04 -7.22825E-18  5.02131E-04  2.45154E-18 -7.39782E-04  4.53942E-20  7.18573E-04

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -10.80000 eV

 Vmoy = -20.22500 eV, Vmftabs(up) = -25.37166 eV, Vmftabs(dn) = -25.06700 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 3

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -1.447E-05   7.660E-03   1.182E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.165E-05   6.167E-03   9.515E-04
  1 -1    1  1    -6.871E-03   2.077E-01   1.980E-02
  1 -1    1  2     7.411E-04  -2.209E-02  -2.073E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -2.448E-03   7.445E-02   7.142E-03
  1  0    1  1    -5.742E-03   1.741E-01   1.664E-02
  1  0    1  2     6.700E-04  -1.997E-02  -1.874E-03
  1  0    2  1     7.343E-04  -2.146E-02  -1.968E-03
  1  0    2  2    -2.713E-03   8.217E-02   7.851E-03
  1  1    1  1    -4.811E-03   1.463E-01   1.404E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     6.639E-04  -1.940E-02  -1.779E-03
  1  1    2  2    -2.926E-03   8.841E-02   8.423E-03
  2 -2    1  1     3.573E-04  -1.773E-02  -2.857E-03
  2 -2    1  2    -2.122E-06   9.441E-05   1.393E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     3.308E-04  -1.644E-02  -2.652E-03
  2 -1    1  1     3.562E-04  -1.768E-02  -2.850E-03
  2 -1    1  2    -2.599E-06   1.156E-04   1.706E-05
  2 -1    2  1    -2.157E-06   9.541E-05   1.401E-05
  2 -1    2  2     3.318E-04  -1.649E-02  -2.658E-03
  2  0    1  1     3.551E-04  -1.763E-02  -2.842E-03
  2  0    1  2    -2.599E-06   1.156E-04   1.705E-05
  2  0    2  1    -2.642E-06   1.168E-04   1.715E-05
  2  0    2  2     3.329E-04  -1.653E-02  -2.665E-03
  2  1    1  1     3.539E-04  -1.758E-02  -2.835E-03
  2  1    1  2    -2.121E-06   9.436E-05   1.392E-05
  2  1    2  1    -2.641E-06   1.168E-04   1.715E-05
  2  1    2  2     3.339E-04  -1.658E-02  -2.672E-03
  2  2    1  1     3.528E-04  -1.753E-02  -2.828E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -2.156E-06   9.537E-05   1.400E-05
  2  2    2  2     3.349E-04  -1.662E-02  -2.678E-03
  3 -3    1  1     1.946E-05  -1.276E-03  -2.641E-04
  3 -3    1  2    -2.312E-08   1.176E-06   1.935E-07
  3 -3    2  1     0.000E+00   0.000E+00   0.000E+00
  3 -3    2  2     1.998E-05  -1.311E-03  -2.715E-04
  3 -2    1  1     1.945E-05  -1.276E-03  -2.641E-04
  3 -2    1  2    -2.985E-08   1.519E-06   2.498E-07
  3 -2    2  1    -2.243E-08   1.141E-06   1.875E-07
  3 -2    2  2     1.999E-05  -1.311E-03  -2.715E-04
  3 -1    1  1     1.945E-05  -1.275E-03  -2.640E-04
  3 -1    1  2    -3.270E-08   1.664E-06   2.737E-07
  3 -1    2  1    -2.895E-08   1.473E-06   2.421E-07
  3 -1    2  2     1.999E-05  -1.312E-03  -2.716E-04
  3  0    1  1     1.944E-05  -1.275E-03  -2.639E-04
  3  0    1  2    -3.270E-08   1.664E-06   2.737E-07
  3  0    2  1    -3.172E-08   1.613E-06   2.652E-07
  3  0    2  2     2.000E-05  -1.312E-03  -2.717E-04
  3  1    1  1     1.943E-05  -1.274E-03  -2.638E-04
  3  1    1  2    -2.985E-08   1.519E-06   2.498E-07
  3  1    2  1    -3.172E-08   1.613E-06   2.652E-07
  3  1    2  2     2.001E-05  -1.312E-03  -2.718E-04
  3  2    1  1     1.942E-05  -1.274E-03  -2.637E-04
  3  2    1  2    -2.312E-08   1.176E-06   1.935E-07
  3  2    2  1    -2.895E-08   1.473E-06   2.421E-07
  3  2    2  2     2.002E-05  -1.313E-03  -2.718E-04
  3  3    1  1     1.941E-05  -1.273E-03  -2.637E-04
  3  3    1  2     0.000E+00   0.000E+00   0.000E+00
  3  3    2  1    -2.243E-08   1.141E-06   1.875E-07
  3  3    2  2     2.003E-05  -1.313E-03  -2.719E-04

 iapr =  1, Z = 23, lmax = 3

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  5.2908097590E-03  0.0000000000E+00  1.1655273588E-04  4.4559840588E-05 -1.3928789285E-05 -1.1335264163E-05
  1.1655273588E-04 -4.4559840588E-05  5.0864456945E-03  5.9398874804E-37 -4.8704810638E-04 -3.6133392579E-05
 -1.3928789285E-05  1.1335264163E-05 -4.8704810638E-04  3.6133392579E-05  4.7875011128E-03  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
 -1.0954409021E-04 -1.0063471398E-05 -2.4563788326E-04  2.1515439952E-06 -4.5145264161E-04 -1.3341206858E-05
 -2.4563788326E-04  2.1515439952E-06 -9.4752058841E-06  1.1122134140E-05 -3.7442957306E-04 -2.8985934551E-06
 -4.5145264161E-04 -1.3341206858E-05 -3.7442957306E-04 -2.8985934551E-06  2.1578076861E-04  8.6049061740E-07

 Tensor_dq(2,ks,j2), prototypical atom
 -4.9562784293E-04 -1.0501630601E-05  3.2610662263E-04  1.3357834249E-05 -2.8795699920E-04 -1.2383656000E-05
  3.2610662263E-04  1.3357834249E-05  2.2534286112E-04 -4.3027465710E-07  2.7129708234E-04  3.9354679584E-06
 -2.8795699920E-04 -1.2383656000E-05  2.7129708234E-04  3.9354679584E-06  3.3667778985E-04  1.2601956135E-05

 Tensor_dq(3,ks,j2), prototypical atom
  1.1454671641E-05  1.4841262015E-05 -1.1173374969E-04 -1.8065315297E-05  7.6510242159E-04 -2.3885113667E-06
 -1.1173374969E-04 -1.8065315297E-05  6.5077992055E-04 -1.9218343451E-05 -3.4961230786E-04  2.2128269463E-05
  7.6510242159E-04 -2.3885113667E-06 -3.4961230786E-04  2.2128269463E-05 -1.0166112657E-03  6.2570473815E-06

 Tensor_qq(ke,je,1,1), prototypical atom
  3.9839963858E-04  3.3438593804E-21 -1.1946073465E-04 -3.9645979804E-07  5.0022433768E-05  1.1674052239E-05
 -1.1946073465E-04 -3.9645979804E-07 -1.9402916955E-04  1.2744950764E-05 -1.2728677500E-05 -2.4748447400E-06
  5.0022433768E-05  1.1674052239E-05 -1.2728677500E-05 -2.4748447400E-06 -1.6703605572E-04 -1.3332013656E-05

 Tensor_qq(ke,je,2,1), prototypical atom
 -1.1946073465E-04  3.9645979804E-07  3.3350122721E-04 -5.0157890706E-22  8.0721901946E-05 -1.0031577302E-05
  3.3350122721E-04 -2.1574368779E-22  4.9568904779E-05 -5.3811378669E-06  6.1407737230E-05  2.5069224511E-06
  8.0721901946E-05 -1.0031577302E-05  6.1407737230E-05  2.5069224511E-06  7.4842099751E-05  5.9930554958E-06

 Tensor_qq(ke,je,3,1), prototypical atom
  5.0022433768E-05 -1.1674052239E-05  8.0721901946E-05  1.0031577302E-05  6.4557947048E-04 -1.3375437522E-21
  8.0721901946E-05  1.0031577302E-05  1.7483269560E-04  1.4894442524E-05 -2.2296371284E-05 -1.0165426634E-05
  6.4557947048E-04 -1.3375437522E-21 -2.2296371284E-05 -1.0165426634E-05 -3.5039391963E-04 -5.6434991705E-06

 Tensor_qq(ke,je,1,2), prototypical atom
 -1.1946073465E-04  3.9645979804E-07  3.3350122721E-04 -3.3438593804E-22  8.0721901946E-05 -1.0031577302E-05
  3.3350122721E-04 -4.8550718772E-23  4.9568904779E-05 -5.3811378669E-06  6.1407737230E-05  2.5069224511E-06
  8.0721901946E-05 -1.0031577302E-05  6.1407737230E-05  2.5069224511E-06  7.4842099751E-05  5.9930554958E-06

 Tensor_qq(ke,je,2,2), prototypical atom
 -1.9402916955E-04 -1.2744950764E-05  4.9568904779E-05  5.3811378669E-06  1.7483269560E-04 -1.4894442524E-05
  4.9568904779E-05  5.3811378669E-06  5.6187181136E-04  1.1137289026E-37 -1.1044474819E-04 -8.1251164433E-06
  1.7483269560E-04 -1.4894442524E-05 -1.1044474819E-04 -8.1251164433E-06 -4.7443107675E-04  1.1864966100E-05

 Tensor_qq(ke,je,3,2), prototypical atom
 -1.2728677500E-05  2.4748447400E-06  6.1407737230E-05 -2.5069224511E-06 -2.2296371284E-05  1.0165426634E-05
  6.1407737230E-05 -2.5069224511E-06 -1.1044474819E-04  8.1251164433E-06  2.5716814768E-04  2.5987211660E-22
 -2.2296371284E-05  1.0165426634E-05  2.5716814768E-04  0.0000000000E+00  1.6541359438E-04 -1.3342505284E-05

 Tensor_qq(ke,je,1,3), prototypical atom
  5.0022433768E-05 -1.1674052239E-05  8.0721901946E-05  1.0031577302E-05  6.4557947048E-04 -1.0031578141E-21
  8.0721901946E-05  1.0031577302E-05  1.7483269560E-04  1.4894442524E-05 -2.2296371284E-05 -1.0165426634E-05
  6.4557947048E-04 -1.3375437522E-21 -2.2296371284E-05 -1.0165426634E-05 -3.5039391963E-04 -5.6434991705E-06

 Tensor_qq(ke,je,2,3), prototypical atom
 -1.2728677500E-05  2.4748447400E-06  6.1407737230E-05 -2.5069224511E-06 -2.2296371284E-05  1.0165426634E-05
  6.1407737230E-05 -2.5069224511E-06 -1.1044474819E-04  8.1251164433E-06  2.5716814768E-04 -4.0889975948E-22
 -2.2296371284E-05  1.0165426634E-05  2.5716814768E-04 -5.0157890706E-22  1.6541359438E-04 -1.3342505284E-05

 Tensor_qq(ke,je,3,3), prototypical atom
 -1.6703605572E-04  1.3332013656E-05  7.4842099751E-05 -5.9930554958E-06 -3.5039391963E-04  5.6434991705E-06
  7.4842099751E-05 -5.9930554958E-06 -4.7443107675E-04 -1.1864966100E-05  1.6541359438E-04  1.3342505284E-05
 -3.5039391963E-04  5.6434991705E-06  1.6541359438E-04  1.3342505284E-05  8.4198584815E-04  3.3438593804E-22

 Crystal Tensor_dd(ke,ks) (Mbarn)
  4.2326478072E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -1.1143031428E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  4.0691565556E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
 -1.1143031428E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  3.8300008902E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  3.1871971086E-03  0.0000000000E+00  0.0000000000E+00  1.0587911841E-22  4.0017947014E-04  0.0000000000E+00
  0.0000000000E+00  1.0587911841E-22 -1.5522333564E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  4.0017947014E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -1.3362884458E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00 -1.0587911841E-22  2.6680098177E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
  2.6680098177E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.9126189784E-04  0.0000000000E+00
  0.0000000000E+00 -3.3881317890E-21  4.9126189784E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,1)
  4.0017947014E-04  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21  5.1646357638E-03  0.0000000000E+00
  0.0000000000E+00  3.3881317890E-21  1.3986615648E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  5.1646357638E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21 -2.8031513570E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00 -1.0587911841E-22  2.6680098177E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
  2.6680098177E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.9126189784E-04  0.0000000000E+00
  0.0000000000E+00 -3.3881317890E-21  4.9126189784E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,2)
 -1.5522333564E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.3986615648E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  4.4949744909E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
  1.3986615648E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21 -3.7954486140E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  8.4703294725E-22  4.9126189784E-04  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21
  4.9126189784E-04  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21  2.0573451815E-03  0.0000000000E+00
  0.0000000000E+00 -3.3881317890E-21  2.0573451815E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21

 Crystal Tensor_qq(ke,je,1,3)
  4.0017947014E-04  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21  5.1646357638E-03  0.0000000000E+00
  0.0000000000E+00 -3.3881317890E-21  1.3986615648E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21
  5.1646357638E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21 -2.8031513570E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  0.0000000000E+00  4.9126189784E-04  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21
  4.9126189784E-04  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21  2.0573451815E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.0573451815E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21

 Crystal Tensor_qq(ke,je,3,3)
 -1.3362884458E-03  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21 -2.8031513570E-03  0.0000000000E+00
  0.0000000000E+00 -1.6940658945E-21 -3.7954486140E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21
 -2.8031513570E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  6.7358867852E-03  0.0000000000E+00

 Convertion factor =  78.05535 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -10.800  4.26822E-02  4.59017E-02  4.34887E-02  4.32263E-02  4.35950E-02  4.29368E-02  4.38242E-02
   dip-dip  4.07539E-02  4.07227E-02  4.06916E-02  4.02821E-02  3.98726E-02  3.83457E-02  4.04394E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  1.92826E-03  5.17899E-03  2.79710E-03  2.94420E-03  3.72246E-03  4.59109E-03  3.38480E-03

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -9.02039E-17  7.10566E-04 -9.97170E-17  7.08857E-04  4.60911E-18 -1.02133E-03 -3.12245E-18  3.01240E-04
   dip-dip -7.97095E-17  1.39930E-16 -8.59268E-17  1.31575E-16 -4.65198E-18 -5.81511E-05 -1.46847E-18 -6.27566E-04
   dip-qua -1.52956E-18 -5.03883E-18 -3.83773E-18 -7.60695E-18  6.22699E-18  6.70175E-18 -6.74545E-19 -3.47116E-18
   qua-qua -8.96485E-18  7.10566E-04 -9.95248E-18  7.08857E-04  3.03410E-18 -9.63181E-04 -9.79434E-19  9.28805E-04

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -10.70000 eV

 Vmoy = -20.22690 eV, Vmftabs(up) = -25.37186 eV, Vmftabs(dn) = -25.06719 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 3

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -1.430E-05   7.568E-03   1.168E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.154E-05   6.108E-03   9.424E-04
  1 -1    1  1    -6.742E-03   2.038E-01   1.942E-02
  1 -1    1  2     7.246E-04  -2.160E-02  -2.026E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -2.416E-03   7.347E-02   7.048E-03
  1  0    1  1    -5.643E-03   1.710E-01   1.635E-02
  1  0    1  2     6.558E-04  -1.955E-02  -1.834E-03
  1  0    2  1     7.180E-04  -2.098E-02  -1.923E-03
  1  0    2  2    -2.675E-03   8.104E-02   7.742E-03
  1  1    1  1    -4.734E-03   1.439E-01   1.381E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     6.499E-04  -1.899E-02  -1.741E-03
  1  1    2  2    -2.885E-03   8.717E-02   8.305E-03
  2 -2    1  1     3.515E-04  -1.745E-02  -2.811E-03
  2 -2    1  2    -2.090E-06   9.299E-05   1.372E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     3.254E-04  -1.617E-02  -2.608E-03
  2 -1    1  1     3.504E-04  -1.740E-02  -2.803E-03
  2 -1    1  2    -2.560E-06   1.139E-04   1.680E-05
  2 -1    2  1    -2.125E-06   9.398E-05   1.380E-05
  2 -1    2  2     3.264E-04  -1.621E-02  -2.615E-03
  2  0    1  1     3.493E-04  -1.735E-02  -2.796E-03
  2  0    1  2    -2.559E-06   1.139E-04   1.680E-05
  2  0    2  1    -2.602E-06   1.151E-04   1.690E-05
  2  0    2  2     3.274E-04  -1.626E-02  -2.621E-03
  2  1    1  1     3.482E-04  -1.730E-02  -2.789E-03
  2  1    1  2    -2.089E-06   9.295E-05   1.372E-05
  2  1    2  1    -2.601E-06   1.151E-04   1.689E-05
  2  1    2  2     3.284E-04  -1.630E-02  -2.628E-03
  2  2    1  1     3.471E-04  -1.725E-02  -2.782E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -2.124E-06   9.394E-05   1.379E-05
  2  2    2  2     3.294E-04  -1.635E-02  -2.634E-03
  3 -3    1  1     1.894E-05  -1.241E-03  -2.570E-04
  3 -3    1  2    -2.249E-08   1.145E-06   1.883E-07
  3 -3    2  1     0.000E+00   0.000E+00   0.000E+00
  3 -3    2  2     1.943E-05  -1.275E-03  -2.641E-04
  3 -2    1  1     1.893E-05  -1.241E-03  -2.569E-04
  3 -2    1  2    -2.904E-08   1.478E-06   2.431E-07
  3 -2    2  1    -2.182E-08   1.110E-06   1.825E-07
  3 -2    2  2     1.944E-05  -1.275E-03  -2.642E-04
  3 -1    1  1     1.892E-05  -1.240E-03  -2.568E-04
  3 -1    1  2    -3.181E-08   1.619E-06   2.663E-07
  3 -1    2  1    -2.817E-08   1.433E-06   2.356E-07
  3 -1    2  2     1.945E-05  -1.276E-03  -2.642E-04
  3  0    1  1     1.891E-05  -1.240E-03  -2.567E-04
  3  0    1  2    -3.181E-08   1.619E-06   2.663E-07
  3  0    2  1    -3.086E-08   1.570E-06   2.580E-07
  3  0    2  2     1.946E-05  -1.276E-03  -2.643E-04
  3  1    1  1     1.890E-05  -1.240E-03  -2.567E-04
  3  1    1  2    -2.904E-08   1.478E-06   2.431E-07
  3  1    2  1    -3.086E-08   1.570E-06   2.580E-07
  3  1    2  2     1.947E-05  -1.277E-03  -2.644E-04
  3  2    1  1     1.889E-05  -1.239E-03  -2.566E-04
  3  2    1  2    -2.249E-08   1.145E-06   1.883E-07
  3  2    2  1    -2.817E-08   1.433E-06   2.356E-07
  3  2    2  2     1.948E-05  -1.277E-03  -2.645E-04
  3  3    1  1     1.888E-05  -1.239E-03  -2.565E-04
  3  3    1  2     0.000E+00   0.000E+00   0.000E+00
  3  3    2  1    -2.182E-08   1.110E-06   1.825E-07
  3  3    2  2     1.949E-05  -1.278E-03  -2.645E-04

 iapr =  1, Z = 23, lmax = 3

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  5.4513820881E-03  0.0000000000E+00 -7.3819694603E-05  5.0789737345E-05  5.5164416781E-04 -1.1302514459E-05
 -7.3819694603E-05 -5.0789737345E-05  5.7424754480E-03  0.0000000000E+00 -4.6333713543E-04 -2.7939382779E-05
  5.5164416781E-04  1.1302514459E-05 -4.6333713543E-04  2.7939382779E-05  4.8743316668E-03  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
 -7.9995089230E-06 -5.5487061064E-06 -2.8993638021E-04 -2.7272362200E-06 -2.4129485276E-04 -1.6370496167E-05
 -2.8993638021E-04 -2.7272362200E-06  1.1953117428E-04  5.4161862302E-06 -4.9502796584E-04 -4.1145925284E-07
 -2.4129485276E-04 -1.6370496167E-05 -4.9502796584E-04 -4.1145925284E-07 -8.2367299825E-05 -3.5495260809E-07

 Tensor_dq(2,ks,j2), prototypical atom
 -6.4863818949E-04 -2.3984212997E-05  4.9761369572E-04  2.0018737653E-05 -1.1348090749E-04 -7.7492866853E-06
  4.9761369572E-04  2.0018737653E-05  2.3745563676E-04  1.5140430619E-05  3.8257681660E-04  2.0914220411E-06
 -1.1348090749E-04 -7.7492866853E-06  3.8257681660E-04  2.0914220411E-06  4.5097986300E-04  6.9767273358E-06

 Tensor_dq(3,ks,j2), prototypical atom
 -6.9916544491E-05  2.7567809308E-05 -5.2547609584E-05 -2.5990440967E-05  7.3000091003E-04 -1.4590161389E-06
 -5.2547609584E-05 -2.5990440967E-05  7.0797772232E-04 -3.3062015772E-05 -4.5934442848E-04  2.5118256278E-05
  7.3000091003E-04 -1.4590161389E-06 -4.5934442848E-04  2.5118256278E-05 -1.0200775679E-03  1.1362246082E-05

 Tensor_qq(ke,je,1,1), prototypical atom
  5.1564887468E-04  0.0000000000E+00 -1.7544015440E-04 -1.3274679120E-06  9.4853357378E-06  1.5763375331E-05
 -1.7544015440E-04 -1.3274679120E-06 -2.6256839161E-04  1.6287232414E-05 -8.0212723406E-06 -3.3484671248E-06
  9.4853357378E-06  1.5763375331E-05 -8.0212723406E-06 -3.3484671248E-06 -1.7544000666E-04 -1.7009422516E-05

 Tensor_qq(ke,je,2,1), prototypical atom
 -1.7544015440E-04  1.3274679120E-06  4.0229657081E-04  1.6719603442E-22  1.4113644697E-04 -1.3491194347E-05
  4.0229657081E-04  1.7182950489E-22  8.1375591172E-05 -7.7565624475E-06  8.0431781274E-05  2.8219882836E-06
  1.4113644697E-04 -1.3491194347E-05  8.0431781274E-05  2.8219882836E-06  8.0273248628E-05  8.2299717581E-06

 Tensor_qq(ke,je,3,1), prototypical atom
  9.4853357378E-06 -1.5763375331E-05  1.4113644697E-04  1.3491194347E-05  6.7543124664E-04  0.0000000000E+00
  1.4113644697E-04  1.3491194347E-05  1.5659785394E-04  2.0515975082E-05 -1.9210522065E-05 -1.1124610116E-05
  6.7543124664E-04 -1.3375682753E-21 -1.9210522065E-05 -1.1124610116E-05 -2.8002048241E-04 -9.1322409030E-06

 Tensor_qq(ke,je,1,2), prototypical atom
 -1.7544015440E-04  1.3274679120E-06  4.0229657081E-04  1.6719603442E-22  1.4113644697E-04 -1.3491194347E-05
  4.0229657081E-04  1.7182950489E-22  8.1375591172E-05 -7.7565624475E-06  8.0431781274E-05  2.8219882836E-06
  1.4113644697E-04 -1.3491194347E-05  8.0431781274E-05  2.8219882836E-06  8.0273248628E-05  8.2299717581E-06

 Tensor_qq(ke,je,2,2), prototypical atom
 -2.6256839161E-04 -1.6287232414E-05  8.1375591172E-05  7.7565624475E-06  1.5659785394E-04 -2.0515975082E-05
  8.1375591172E-05  7.7565624475E-06  6.4443739616E-04  2.8307795273E-37 -1.4804414814E-04 -6.9632097548E-06
  1.5659785394E-04 -2.0515975082E-05 -1.4804414814E-04 -6.9632097548E-06 -5.1496355957E-04  1.3752600814E-05

 Tensor_qq(ke,je,3,2), prototypical atom
 -8.0212723406E-06  3.3484671248E-06  8.0431781274E-05 -2.8219882836E-06 -1.9210522065E-05  1.1124610116E-05
  8.0431781274E-05 -2.8219882836E-06 -1.4804414814E-04  6.9632097548E-06  3.0924443615E-04  1.4243748664E-22
 -1.9210522065E-05  1.1124610116E-05  3.0924443615E-04  0.0000000000E+00  2.1848899242E-04 -1.2851322493E-05

 Tensor_qq(ke,je,1,3), prototypical atom
  9.4853357378E-06 -1.5763375331E-05  1.4113644697E-04  1.3491194347E-05  6.7543124664E-04 -6.6878413767E-22
  1.4113644697E-04  1.3491194347E-05  1.5659785394E-04  2.0515975082E-05 -1.9210522065E-05 -1.1124610116E-05
  6.7543124664E-04 -1.3375682753E-21 -1.9210522065E-05 -1.1124610116E-05 -2.8002048241E-04 -9.1322409030E-06

 Tensor_qq(ke,je,2,3), prototypical atom
 -8.0212723406E-06  3.3484671248E-06  8.0431781274E-05 -2.8219882836E-06 -1.9210522065E-05  1.1124610116E-05
  8.0431781274E-05 -2.8219882836E-06 -1.4804414814E-04  6.9632097548E-06  3.0924443615E-04 -2.4758547782E-23
 -1.9210522065E-05  1.1124610116E-05  3.0924443615E-04 -3.3439206884E-22  2.1848899242E-04 -1.2851322493E-05

 Tensor_qq(ke,je,3,3), prototypical atom
 -1.7544000666E-04  1.7009422516E-05  8.0273248628E-05 -8.2299717581E-06 -2.8002048241E-04  9.1322409030E-06
  8.0273248628E-05 -8.2299717581E-06 -5.1496355957E-04 -1.3752600814E-05  2.1848899242E-04  1.2851322493E-05
 -2.8002048241E-04  9.1322409030E-06  2.1848899242E-04  1.2851322493E-05  9.0097899163E-04 -2.0063524130E-21

 Crystal Tensor_dd(ke,ks) (Mbarn)
  4.3611056705E-02  0.0000000000E+00  0.0000000000E+00  1.3552527156E-20  4.4131533425E-03  0.0000000000E+00
  0.0000000000E+00 -1.3552527156E-20  4.5939803584E-02  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21
  4.4131533425E-03  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21  3.8994653334E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  4.1251909974E-03  0.0000000000E+00  0.0000000000E+00  4.2351647363E-22  7.5882685903E-05  0.0000000000E+00
  0.0000000000E+00 -4.2351647363E-22 -2.1005471329E-03  0.0000000000E+00  0.0000000000E+00  8.4703294725E-22
  7.5882685903E-05  0.0000000000E+00  0.0000000000E+00 -8.4703294725E-22 -1.4035200533E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  0.0000000000E+00  3.2183725665E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.2183725665E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21  6.4345425019E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  6.4345425019E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,1)
  7.5882685903E-05  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21  5.4034499731E-03  0.0000000000E+00
  0.0000000000E+00 -3.3881317890E-21  1.2527828315E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21
  5.4034499731E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21 -2.2401638593E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  0.0000000000E+00  3.2183725665E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.2183725665E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21  6.4345425019E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  6.4345425019E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,2)
 -2.1005471329E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21  1.2527828315E-03  0.0000000000E+00
  0.0000000000E+00  3.3881317890E-21  5.1554991693E-03  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21
  1.2527828315E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -4.1197084765E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00  8.4703294725E-22  6.4345425019E-04  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
  6.4345425019E-04  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21  2.4739554892E-03  0.0000000000E+00
  0.0000000000E+00 -3.3881317890E-21  2.4739554892E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21

 Crystal Tensor_qq(ke,je,1,3)
  7.5882685903E-05  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21  5.4034499731E-03  0.0000000000E+00
  0.0000000000E+00 -3.3881317890E-21  1.2527828315E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21
  5.4034499731E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21 -2.2401638593E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  8.4703294725E-22  6.4345425019E-04  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
  6.4345425019E-04  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21  2.4739554892E-03  0.0000000000E+00
  0.0000000000E+00 -3.3881317890E-21  2.4739554892E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21

 Crystal Tensor_qq(ke,je,3,3)
 -1.4035200533E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21 -2.2401638593E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -4.1197084765E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
 -2.2401638593E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21  7.2078319330E-03  0.0000000000E+00

 Convertion factor =  78.05678 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -10.700  3.96015E-02  4.72609E-02  4.93595E-02  4.92242E-02  4.92376E-02  4.32786E-02  4.66751E-02
   dip-dip  3.73289E-02  4.16343E-02  4.59398E-02  4.56083E-02  4.52768E-02  3.83010E-02  4.28485E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  2.27260E-03  5.62659E-03  3.41972E-03  3.61587E-03  3.96079E-03  4.97768E-03  3.82664E-03

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -8.99408E-17  1.00004E-03 -7.21904E-17  9.28946E-04  7.31806E-18 -1.38668E-03  5.39319E-18  6.43667E-04
   dip-dip -7.75643E-17  1.41995E-16 -6.36631E-17  1.35618E-16 -2.18371E-18 -6.32840E-05  5.85219E-18 -6.31700E-04
   dip-qua -2.15120E-18 -5.13048E-18  2.63160E-19 -3.59511E-18  5.58864E-18  8.10527E-18 -6.02495E-19 -4.22132E-18
   qua-qua -1.02253E-17  1.00004E-03 -8.79046E-18  9.28946E-04  3.91314E-18 -1.32340E-03  1.43497E-19  1.27537E-03

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -10.60000 eV

 Vmoy = -20.22882 eV, Vmftabs(up) = -25.37205 eV, Vmftabs(dn) = -25.06738 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 3

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -1.413E-05   7.479E-03   1.154E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.143E-05   6.051E-03   9.334E-04
  1 -1    1  1    -6.616E-03   2.000E-01   1.906E-02
  1 -1    1  2     7.084E-04  -2.111E-02  -1.981E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -2.385E-03   7.251E-02   6.957E-03
  1  0    1  1    -5.546E-03   1.681E-01   1.607E-02
  1  0    1  2     6.420E-04  -1.913E-02  -1.795E-03
  1  0    2  1     7.020E-04  -2.051E-02  -1.880E-03
  1  0    2  2    -2.639E-03   7.994E-02   7.637E-03
  1  1    1  1    -4.659E-03   1.417E-01   1.359E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     6.362E-04  -1.859E-02  -1.704E-03
  1  1    2  2    -2.845E-03   8.597E-02   8.190E-03
  2 -2    1  1     3.460E-04  -1.717E-02  -2.766E-03
  2 -2    1  2    -2.059E-06   9.162E-05   1.352E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     3.201E-04  -1.591E-02  -2.566E-03
  2 -1    1  1     3.449E-04  -1.712E-02  -2.759E-03
  2 -1    1  2    -2.522E-06   1.122E-04   1.656E-05
  2 -1    2  1    -2.093E-06   9.261E-05   1.360E-05
  2 -1    2  2     3.211E-04  -1.595E-02  -2.572E-03
  2  0    1  1     3.438E-04  -1.707E-02  -2.752E-03
  2  0    1  2    -2.521E-06   1.122E-04   1.656E-05
  2  0    2  1    -2.564E-06   1.134E-04   1.665E-05
  2  0    2  2     3.221E-04  -1.600E-02  -2.579E-03
  2  1    1  1     3.427E-04  -1.702E-02  -2.745E-03
  2  1    1  2    -2.058E-06   9.158E-05   1.352E-05
  2  1    2  1    -2.563E-06   1.134E-04   1.665E-05
  2  1    2  2     3.231E-04  -1.604E-02  -2.585E-03
  2  2    1  1     3.416E-04  -1.697E-02  -2.737E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -2.093E-06   9.257E-05   1.359E-05
  2  2    2  2     3.241E-04  -1.608E-02  -2.592E-03
  3 -3    1  1     1.843E-05  -1.208E-03  -2.501E-04
  3 -3    1  2    -2.190E-08   1.114E-06   1.833E-07
  3 -3    2  1     0.000E+00   0.000E+00   0.000E+00
  3 -3    2  2     1.892E-05  -1.241E-03  -2.571E-04
  3 -2    1  1     1.842E-05  -1.208E-03  -2.501E-04
  3 -2    1  2    -2.827E-08   1.439E-06   2.367E-07
  3 -2    2  1    -2.124E-08   1.080E-06   1.776E-07
  3 -2    2  2     1.893E-05  -1.242E-03  -2.571E-04
  3 -1    1  1     1.842E-05  -1.208E-03  -2.500E-04
  3 -1    1  2    -3.097E-08   1.576E-06   2.593E-07
  3 -1    2  1    -2.743E-08   1.395E-06   2.293E-07
  3 -1    2  2     1.894E-05  -1.242E-03  -2.572E-04
  3  0    1  1     1.841E-05  -1.207E-03  -2.499E-04
  3  0    1  2    -3.097E-08   1.576E-06   2.593E-07
  3  0    2  1    -3.004E-08   1.528E-06   2.512E-07
  3  0    2  2     1.894E-05  -1.242E-03  -2.573E-04
  3  1    1  1     1.840E-05  -1.207E-03  -2.498E-04
  3  1    1  2    -2.827E-08   1.439E-06   2.367E-07
  3  1    2  1    -3.004E-08   1.528E-06   2.512E-07
  3  1    2  2     1.895E-05  -1.243E-03  -2.574E-04
  3  2    1  1     1.839E-05  -1.206E-03  -2.498E-04
  3  2    1  2    -2.190E-08   1.114E-06   1.833E-07
  3  2    2  1    -2.743E-08   1.395E-06   2.293E-07
  3  2    2  2     1.896E-05  -1.243E-03  -2.574E-04
  3  3    1  1     1.838E-05  -1.206E-03  -2.497E-04
  3  3    1  2     0.000E+00   0.000E+00   0.000E+00
  3  3    2  1    -2.124E-08   1.080E-06   1.776E-07
  3  3    2  2     1.897E-05  -1.244E-03  -2.575E-04

 iapr =  1, Z = 23, lmax = 3

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  6.0996159820E-03  2.6751855971E-21  5.8680774877E-05  9.0959392613E-06  1.4959180288E-03  2.9216769493E-05
  5.8680774877E-05 -9.0959392613E-06  6.3215847513E-03  1.4850263225E-37  1.0432000022E-04  2.0336124742E-05
  1.4959180288E-03 -2.9216769493E-05  1.0432000022E-04 -2.0336124742E-05  5.1093920519E-03  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
  6.9634919042E-05 -7.6566102144E-06 -1.6802677360E-04 -4.4201303745E-06  2.5386791130E-04  1.6793321291E-06
 -1.6802677360E-04 -4.4201303745E-06  3.4357306319E-04  1.6000240710E-05 -6.1822350421E-04 -1.2479398725E-05
  2.5386791130E-04  1.6793321291E-06 -6.1822350421E-04 -1.2479398725E-05 -4.7141082851E-04 -1.9700270139E-05

 Tensor_dq(2,ks,j2), prototypical atom
 -1.0327637963E-03 -1.5867090766E-05  6.9695202229E-04  1.3932770128E-05  1.7283839544E-04  1.2620283243E-05
  6.9695202229E-04  1.3932770128E-05  4.7043487591E-04  2.4786502615E-05  3.0792982683E-04 -3.9582118356E-06
  1.7283839544E-04  1.2620283243E-05  3.0792982683E-04 -3.9582118356E-06  4.6704539675E-04 -1.0262118647E-05

 Tensor_dq(3,ks,j2), prototypical atom
 -1.7577453867E-04  2.8237210352E-05  1.4786744168E-04 -3.6768007228E-05  8.2146601155E-04  6.1826435092E-06
  1.4786744168E-04 -3.6768007228E-05  8.0118294589E-04 -3.2684976533E-05 -5.5352690007E-04  2.3590316805E-05
  8.2146601155E-04  6.1826435092E-06 -5.5352690007E-04  2.3590316805E-05 -1.0445528510E-03  9.6997393351E-06

 Tensor_qq(ke,je,1,1), prototypical atom
  6.4120016290E-04  1.3375927985E-21 -2.9547042326E-04 -6.7703598248E-06 -1.5515299048E-05  9.8103797334E-06
 -2.9547042326E-04 -6.7703598248E-06 -3.5547888804E-04  1.5420340696E-05  1.0228289805E-05 -1.9548777965E-07
 -1.5515299048E-05  9.8103797334E-06  1.0228289805E-05 -1.9548777965E-07 -1.4375957083E-04 -1.6757270903E-05

 Tensor_qq(ke,je,2,1), prototypical atom
 -2.9547042326E-04  6.7703598248E-06  4.6317965973E-04 -6.6879639927E-22  1.6696663039E-04 -1.6100191054E-05
  4.6317965973E-04 -3.2750526646E-22  1.7335869712E-04 -1.5190666907E-05  3.7430747485E-05  2.3848199664E-06
  1.6696663039E-04 -1.6100191054E-05  3.7430747485E-05  2.3848199664E-06  4.8149472237E-05  1.1871903628E-05

 Tensor_qq(ke,je,3,1), prototypical atom
 -1.5515299048E-05 -9.8103797334E-06  1.6696663039E-04  1.6100191054E-05  7.5004175318E-04 -1.3375927985E-21
  1.6696663039E-04  1.6100191054E-05  1.6334063064E-04  1.9421736135E-05 -4.1495517972E-05 -1.0006753335E-05
  7.5004175318E-04 -6.6879639927E-22 -4.1495517972E-05 -1.0006753335E-05 -2.5839244683E-04 -1.5625722755E-05

 Tensor_qq(ke,je,1,2), prototypical atom
 -2.9547042326E-04  6.7703598248E-06  4.6317965973E-04 -1.6719909982E-22  1.6696663039E-04 -1.6100191054E-05
  4.6317965973E-04  6.8929331691E-24  1.7335869712E-04 -1.5190666907E-05  3.7430747485E-05  2.3848199664E-06
  1.6696663039E-04 -1.6100191054E-05  3.7430747485E-05  2.3848199664E-06  4.8149472237E-05  1.1871903628E-05

 Tensor_qq(ke,je,2,2), prototypical atom
 -3.5547888804E-04 -1.5420340696E-05  1.7335869712E-04  1.5190666907E-05  1.6334063064E-04 -1.9421736135E-05
  1.7335869712E-04  1.5190666907E-05  7.3804776659E-04  4.0838223869E-37 -1.7596704043E-04 -9.1304301764E-06
  1.6334063064E-04 -1.9421736135E-05 -1.7596704043E-04 -9.1304301764E-06 -5.6197785009E-04  1.2485628451E-05

 Tensor_qq(ke,je,3,2), prototypical atom
  1.0228289805E-05  1.9548777965E-07  3.7430747485E-05 -2.3848199664E-06 -4.1495517972E-05  1.0006753335E-05
  3.7430747485E-05 -2.3848199664E-06 -1.7596704043E-04  9.1304301764E-06  3.3144405307E-04 -2.2223877262E-22
 -4.1495517972E-05  1.0006753335E-05  3.3144405307E-04  1.6719909982E-22  2.4926817437E-04 -1.3829566621E-05

 Tensor_qq(ke,je,1,3), prototypical atom
 -1.5515299048E-05 -9.8103797334E-06  1.6696663039E-04  1.6100191054E-05  7.5004175318E-04 -1.3375927985E-21
  1.6696663039E-04  1.6100191054E-05  1.6334063064E-04  1.9421736135E-05 -4.1495517972E-05 -1.0006753335E-05
  7.5004175318E-04 -6.6879639927E-22 -4.1495517972E-05 -1.0006753335E-05 -2.5839244683E-04 -1.5625722755E-05

 Tensor_qq(ke,je,2,3), prototypical atom
  1.0228289805E-05  1.9548777965E-07  3.7430747485E-05 -2.3848199664E-06 -4.1495517972E-05  1.0006753335E-05
  3.7430747485E-05 -2.3848199664E-06 -1.7596704043E-04  9.1304301764E-06  3.3144405307E-04  1.1215942701E-22
 -4.1495517972E-05  1.0006753335E-05  3.3144405307E-04  5.0159729945E-22  2.4926817437E-04 -1.3829566621E-05

 Tensor_qq(ke,je,3,3), prototypical atom
 -1.4375957083E-04  1.6757270903E-05  4.8149472237E-05 -1.1871903628E-05 -2.5839244683E-04  1.5625722755E-05
  4.8149472237E-05 -1.1871903628E-05 -5.6197785009E-04 -1.2485628451E-05  2.4926817437E-04  1.3829566621E-05
 -2.5839244683E-04  1.5625722755E-05  2.4926817437E-04  1.3829566621E-05  9.3709856061E-04 -4.0127783956E-21

 Crystal Tensor_dd(ke,ks) (Mbarn)
  4.8796927856E-02  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21  1.1967344230E-02  0.0000000000E+00
  0.0000000000E+00  3.3881317890E-21  5.0572678010E-02  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21
  1.1967344230E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  4.0875136415E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  5.1296013032E-03  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21 -1.2412239238E-04  0.0000000000E+00
  0.0000000000E+00  1.6940658945E-21 -2.8438311044E-03  0.0000000000E+00  0.0000000000E+00  5.2939559203E-23
 -1.2412239238E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -1.1500765666E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00 -1.6940658945E-21  3.7054372778E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.7054372778E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21  2.9944597988E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.9944597988E-04  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21

 Crystal Tensor_qq(ke,je,3,1)
 -1.2412239238E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  6.0003340255E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.3067250451E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  6.0003340255E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -2.0671395746E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00 -1.6940658945E-21  3.7054372778E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  3.7054372778E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21  2.9944597988E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.9944597988E-04  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21

 Crystal Tensor_qq(ke,je,2,2)
 -2.8438311044E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  1.3067250451E-03  0.0000000000E+00
  0.0000000000E+00  3.3881317890E-21  5.9043821327E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21
  1.3067250451E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21 -4.4958228007E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00 -5.2939559203E-23  2.9944597988E-04  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
  2.9944597988E-04  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21  2.6515524245E-03  0.0000000000E+00
  0.0000000000E+00 -3.3881317890E-21  2.6515524245E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21

 Crystal Tensor_qq(ke,je,1,3)
 -1.2412239238E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  6.0003340255E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.3067250451E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  6.0003340255E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -2.0671395746E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  5.2939559203E-23  2.9944597988E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  2.9944597988E-04  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21  2.6515524245E-03  0.0000000000E+00
  0.0000000000E+00 -3.3881317890E-21  2.6515524245E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,3)
 -1.1500765666E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21 -2.0671395746E-03  0.0000000000E+00
  0.0000000000E+00  3.3881317890E-21 -4.4958228007E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
 -2.0671395746E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21  7.4967884849E-03  0.0000000000E+00

 Convertion factor =  78.05822 (numb. of electron/Mbarn)

   Total signal

    Energy (10-1,0-10)  (1-2-1,12-1) (0-10,-10-2)(-1-2-2,1-22) (-10-2,10-1)(10-16,-40-1)   <xanes>   
   -10.600  3.66517E-02  4.85582E-02  5.39600E-02  5.75754E-02  6.00978E-02  4.45870E-02  5.10211E-02
   dip-dip  3.36821E-02  4.21274E-02  5.05727E-02  5.32813E-02  5.59900E-02  3.89628E-02  4.67482E-02
   dip-qua  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00  0.00000E+00
   qua-qua  2.96969E-03  6.43084E-03  3.38730E-03  4.29406E-03  4.10776E-03  5.62421E-03  4.27283E-03

            r(111)ss_0   i(111)ss_0  r(111)ss_90  i(111)ss_90   r(111)sp_0   i(111)sp_0  r(111)sp_90  i(111)sp_90 
  Ampldafs -1.15912E-16  1.14824E-03 -8.69219E-17  7.59826E-04 -7.37943E-18 -1.20420E-03  3.38873E-18  2.84791E-03
   dip-dip -1.07347E-16  1.77291E-16 -7.82738E-17  1.26276E-16 -2.22703E-17  2.23280E-04  5.50400E-18  1.54869E-03
   dip-qua  5.32613E-19 -5.09250E-18  1.38394E-19  7.99597E-19  1.21996E-17  1.20483E-17 -3.31344E-19 -1.57137E-18
   qua-qua -9.09751E-18  1.14824E-03 -8.78653E-18  7.59826E-04  2.69130E-18 -1.42748E-03 -1.78393E-18  1.29922E-03

 ---- Potex ------------------------------------------------------------------------------------------------------------

 Energ = -10.50000 eV

 Vmoy = -20.23063 eV, Vmftabs(up) = -25.37225 eV, Vmftabs(dn) = -25.06757 eV

 ---- Sphere -----------------------------------------------------------------------------------------------------------

 iapr =  0, Z = 23, lmax = 3

 Radial integral
  l  m  isp isol    monopole    dipole    quadrupole     iseuil = 1
  0  0    1  1    -1.396E-05   7.392E-03   1.140E-03
  0  0    1  2     0.000E+00   0.000E+00   0.000E+00
  0  0    2  1     0.000E+00   0.000E+00   0.000E+00
  0  0    2  2    -1.133E-05   5.994E-03   9.247E-04
  1 -1    1  1    -6.495E-03   1.963E-01   1.871E-02
  1 -1    1  2     6.929E-04  -2.065E-02  -1.937E-03
  1 -1    2  1     0.000E+00   0.000E+00   0.000E+00
  1 -1    2  2    -2.354E-03   7.159E-02   6.868E-03
  1  0    1  1    -5.452E-03   1.653E-01   1.580E-02
  1  0    1  2     6.287E-04  -1.873E-02  -1.757E-03
  1  0    2  1     6.867E-04  -2.006E-02  -1.838E-03
  1  0    2  2    -2.604E-03   7.887E-02   7.535E-03
  1  1    1  1    -4.587E-03   1.395E-01   1.338E-02
  1  1    1  2     0.000E+00   0.000E+00   0.000E+00
  1  1    2  1     6.230E-04  -1.820E-02  -1.668E-03
  1  1    2  2    -2.807E-03   8.480E-02   8.079E-03
  2 -2    1  1     3.406E-04  -1.690E-02  -2.723E-03
  2 -2    1  2    -2.030E-06   9.032E-05   1.333E-05
  2 -2    2  1     0.000E+00   0.000E+00   0.000E+00
  2 -2    2  2     3.151E-04  -1.566E-02  -2.526E-03
  2 -1    1  1     3.395E-04  -1.686E-02  -2.716E-03
  2 -1    1  2    -2.485E-06   1.106E-04   1.632E-05
  2 -1    2  1    -2.064E-06   9.129E-05   1.341E-05
  2 -1    2  2     3.161E-04  -1.570E-02  -2.532E-03
  2  0    1  1     3.385E-04  -1.681E-02  -2.709E-03
  2  0    1  2    -2.485E-06   1.106E-04   1.632E-05
  2  0    2  1    -2.527E-06   1.118E-04   1.642E-05
  2  0    2  2     3.170E-04  -1.575E-02  -2.538E-03
  2  1    1  1     3.374E-04  -1.676E-02  -2.702E-03
  2  1    1  2    -2.029E-06   9.028E-05   1.333E-05
  2  1    2  1    -2.527E-06   1.118E-04   1.641E-05
  2  1    2  2     3.180E-04  -1.579E-02  -2.545E-03
  2  2    1  1     3.363E-04  -1.671E-02  -2.695E-03
  2  2    1  2     0.000E+00   0.000E+00   0.000E+00
  2  2    2  1    -2.063E-06   9.125E-05   1.340E-05
  2  2    2  2     3.190E-04  -1.583E-02  -2.551E-03
  3 -3    1  1     1.795E-05  -1.177E-03  -2.436E-04
  3 -3    1  2    -2.133E-08   1.085E-06   1.786E-07
  3 -3    2  1     0.000E+00   0.000E+00   0.000E+00
  3 -3    2  2     1.842E-05  -1.209E-03  -2.504E-04
  3 -2    1  1     1.794E-05  -1.176E-03  -2.435E-04
  3 -2    1  2    -2.754E-08   1.401E-06   2.305E-07
  3 -2    2  1    -2.069E-08   1.052E-06   1.730E-07
  3 -2    2  2     1.843E-05  -1.209E-03  -2.504E-04
  3 -1    1  1     1.794E-05  -1.176E-03  -2.435E-04
  3 -1    1  2    -3.017E-08   1.535E-06   2.525E-07
  3 -1    2  1    -2.671E-08   1.359E-06   2.234E-07
  3 -1    2  2     1.844E-05  -1.210E-03  -2.505E-04
  3  0    1  1     1.793E-05  -1.176E-03  -2.434E-04
  3  0    1  2    -3.017E-08   1.535E-06   2.525E-07
  3  0    2  1    -2.926E-08   1.488E-06   2.447E-07
  3  0    2  2     1.845E-05  -1.210E-03  -2.506E-04
  3  1    1  1     1.792E-05  -1.175E-03  -2.433E-04
  3  1    1  2    -2.754E-08   1.401E-06   2.305E-07
  3  1    2  1    -2.926E-08   1.488E-06   2.447E-07
  3  1    2  2     1.846E-05  -1.210E-03  -2.506E-04
  3  2    1  1     1.791E-05  -1.175E-03  -2.433E-04
  3  2    1  2    -2.133E-08   1.085E-06   1.786E-07
  3  2    2  1    -2.671E-08   1.359E-06   2.234E-07
  3  2    2  2     1.847E-05  -1.211E-03  -2.507E-04
  3  3    1  1     1.790E-05  -1.174E-03  -2.432E-04
  3  3    1  2     0.000E+00   0.000E+00   0.000E+00
  3  3    2  1    -2.069E-08   1.052E-06   1.730E-07
  3  3    2  2     1.848E-05  -1.211E-03  -2.508E-04

 iapr =  1, Z = 23, lmax = 3

 iapr =  2, Z =  8, lmax = 2

 iapr =  3, Z =  8, lmax = 2

 ---- Coabs ------------------------------------------------------------------------------------------------------------

 Threshold  K1

 Tensor_dd(ke,ks), prototypical atom (Mbarn)
  7.1136336576E-03 -5.3504692869E-21 -1.2579700046E-04 -1.0130815779E-04  2.8519586583E-03  9.3295872471E-05
 -1.2579700046E-04  1.0130815779E-04  7.5184356495E-03  2.3760856779E-36  3.7535260011E-04  9.4939365717E-05
  2.8519586583E-03 -9.3295872471E-05  3.7535260011E-04 -9.4939365717E-05  5.9915249105E-03  0.0000000000E+00

 Tensor_dq(1,ks,j2), prototypical atom
  5.3617625866E-05  1.8953072739E-06 -5.1479370159E-05  1.1150995171E-06  9.0467662606E-04  4.2669376280E-05
 -5.1479370159E-05  1.1150995171E-06  6.3495978087E-04  1.9342978308E-05 -7.8267659995E-04 -3.5236794198E-05
  9.0467662606E-04  4.2669376280E-05 -7.8267659995E-04 -3.5236794198E-05 -7.7987662969E-04 -3.9997863811E-05

 Tensor_dq(2,ks,j2), prototypical atom
 -1.5728939400E-03  1.1359503538E-05  1.0235895248E-03 -2.2433044177E-05  3.4348892985E-04  4.4694245004E-05
  1.0235895248E-03 -2.2433044177E-05  5.3135587759E-04  3.0205522355E-05  3.2560482545E-04 -1.3971980106E-05
  3.4348892985E-04  4.4694245004E-05  3.2560482545E-04 -1.3971980106E-05  8.3763017460E-04 -3.4471105859E-05

 Tensor_dq(3,ks,j2), prototypical atom
 -2.5280651051E-04  3.4537037156E-05  2.5513784497E-04 -3.4296185593E-05  1.1629521561E-03  2.5079195526E-05
  2.5513784497E-04 -3.4296185593E-05  9.9720420882E-04 -3.3612844923E-05 -7.1450637284E-04  1.2884177405E-05
  1.1629521561E-03  2.5079195526E-05 -7.1450637284E-04  1.2884177405E-05 -1.1684374953E-03  4.2055597520E-06

 Tensor_qq(ke,je,1,1), prototypical atom
  7.5482711624E-04  2.6752346434E-21 -4.0499822153E-04 -1.2901339050E-05 -6.0686616574E-05  1.0622530370E-05
 -4.0499822153E-04 -1.2901339050E-05 -3.9644294069E-04  1.7563829005E-05 -7.4667885687E-06 -4.7313228459E-08
 -6.0686616574E-05  1.0622530370E-05 -7.4667885687E-06 -4.7313228459E-08 -1.8113512722E-04 -1.8352043447E-05

 Tensor_qq(ke,je,2,1), prototypical atom
 -4.0499822153E-04  1.2901339050E-05  5.0626685340E-04 -1.5675202989E-23  1.4661324085E-04 -1.4017136019E-05
  5.0626685340E-04 -7.1608107858E-24  1.9442848178E-04 -1.9984055772E-05  2.3706828133E-05 -8.3107543407E-08
  1.4661324085E-04 -1.4017136019E-05  2.3706828133E-05 -8.3107543407E-08  1.0074353484E-04  9.9128098492E-06

 Tensor_qq(ke,je,3,1), prototypical atom
 -6.0686616574E-05 -1.0622530370E-05  1.4661324085E-04  1.4017136019E-05  9.1764474640E-04  0.0000000000E+00
  1.4661324085E-04  1.4017136019E-05  2.2956843229E-04  2.5999567864E-05 -9.4541760062E-05 -6.6764746353E-06
  9.1764474640E-04  6.6880866086E-22 -9.4541760062E-05 -6.6764746353E-06 -2.7661628318E-04 -2.3600383315E-05

 Tensor_qq(ke,je,1,2), prototypical atom
 -4.0499822153E-04  1.2901339050E-05  5.0626685340E-04 -1.0450135326E-23  1.4661324085E-04 -1.4017136019E-05
  5.0626685340E-04 -1.9357431228E-24  1.9442848178E-04 -1.9984055772E-05  2.3706828133E-05 -8.3107543407E-08
  1.4661324085E-04 -1.4017136019E-05  2.3706828133E-05 -8.3107543407E-08  1.0074353484E-04  9.9128098492E-06

 Tensor_qq(ke,je,2,2), prototypical atom
 -3.9644294069E-04 -1.7563829005E-05  1.9442848178E-04  1.9984055772E-05  2.2956843229E-04 -2.5999567864E-05
  1.9442848178E-04  1.9984055772E-05  8.1759068695E-04  1.4850535487E-37 -2.0851519319E-04 -7.7344899233E-06
  2.2956843229E-04 -2.5999567864E-05 -2.0851519319E-04 -7.7344899233E-06 -6.3052116478E-04  1.5254487223E-05

 Tensor_qq(ke,je,3,2), prototypical atom
 -7.4667885687E-06  4.7313228459E-08  2.3706828133E-05  8.3107543407E-08 -9.4541760062E-05  6.6764746353E-06
  2.3706828133E-05  8.3107543407E-08 -2.0851519319E-04  7.7344899233E-06  3.5750307817E-04 -7.7198381959E-24
 -9.4541760062E-05  6.6764746353E-06  3.5750307817E-04 -1.0450135326E-23  3.0091679973E-04 -1.2827018026E-05

 Tensor_qq(ke,je,1,3), prototypical atom
 -6.0686616574E-05 -1.0622530370E-05  1.4661324085E-04  1.4017136019E-05  9.1764474640E-04 -2.6752346434E-21
  1.4661324085E-04  1.4017136019E-05  2.2956843229E-04  2.5999567864E-05 -9.4541760062E-05 -6.6764746353E-06
  9.1764474640E-04  6.6880866086E-22 -9.4541760062E-05 -6.6764746353E-06 -2.7661628318E-04 -2.3600383315E-05

 Tensor_qq(ke,je,2,3), prototypical atom
 -7.4667885687E-06  4.7313228459E-08  2.3706828133E-05  8.3107543407E-08 -9.4541760062E-05  6.6764746353E-06
  2.3706828133E-05  8.3107543407E-08 -2.0851519319E-04  7.7344899233E-06  3.5750307817E-04 -7.7198381959E-24
 -9.4541760062E-05  6.6764746353E-06  3.5750307817E-04 -1.0450135326E-23  3.0091679973E-04 -1.2827018026E-05

 Tensor_qq(ke,je,3,3), prototypical atom
 -1.8113512722E-04  1.8352043447E-05  1.0074353484E-04 -9.9128098492E-06 -2.7661628318E-04  2.3600383315E-05
  1.0074353484E-04 -9.9128098492E-06 -6.3052116478E-04 -1.5254487223E-05  3.0091679973E-04  1.2827018026E-05
 -2.7661628318E-04  2.3600383315E-05  3.0091679973E-04  1.2827018026E-05  1.0574464008E-03 -2.6752346434E-21

 Crystal Tensor_dd(ke,ks) (Mbarn)
  5.6909069261E-02  0.0000000000E+00  0.0000000000E+00  2.7105054312E-20  2.2815669267E-02  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  6.0147485196E-02  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  2.2815669267E-02  0.0000000000E+00  0.0000000000E+00 -2.7105054312E-20  4.7932199284E-02  0.0000000000E+00

 Crystal Tensor_dq(1,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(2,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_dq(3,ks,j2)                    Non magnetic part                                                                                               Magnetic part
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00    0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,1)
  6.0386169299E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -4.8549293259E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -3.1715435255E-03  0.0000000000E+00  0.0000000000E+00 -1.3234889801E-23
 -4.8549293259E-04  0.0000000000E+00  0.0000000000E+00  1.3234889801E-23 -1.4490810177E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,1)
  0.0000000000E+00  0.0000000000E+00  4.0501348272E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  4.0501348272E-03  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21  1.8965462506E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.8965462506E-04  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21

 Crystal Tensor_qq(ke,je,3,1)
 -4.8549293259E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  7.3411579712E-03  0.0000000000E+00
  0.0000000000E+00  3.3881317890E-21  1.8365474583E-03  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21
  7.3411579712E-03  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21 -2.2129302655E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,1,2)
  0.0000000000E+00  0.0000000000E+00  4.0501348272E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00
  4.0501348272E-03  0.0000000000E+00  0.0000000000E+00  6.7762635780E-21  1.8965462506E-04  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  1.8965462506E-04  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21

 Crystal Tensor_qq(ke,je,2,2)
 -3.1715435255E-03  0.0000000000E+00  0.0000000000E+00 -6.7762635780E-21  1.8365474583E-03  0.0000000000E+00
  0.0000000000E+00 -6.7762635780E-21  6.5407254956E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
  1.8365474583E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21 -5.0441693182E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,3,2)
  0.0000000000E+00 -1.3234889801E-23  1.8965462506E-04  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21
  1.8965462506E-04  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21  2.8600246253E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.8600246253E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21

 Crystal Tensor_qq(ke,je,1,3)
 -4.8549293259E-04  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00  7.3411579712E-03  0.0000000000E+00
  0.0000000000E+00  3.3881317890E-21  1.8365474583E-03  0.0000000000E+00  0.0000000000E+00  1.6940658945E-21
  7.3411579712E-03  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21 -2.2129302655E-03  0.0000000000E+00

 Crystal Tensor_qq(ke,je,2,3)
  0.0000000000E+00  0.0000000000E+00  1.8965462506E-04  0.0000000000E+00  0.0000000000E+00 -1.6940658945E-21
  1.8965462506E-04  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21  2.8600246253E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00  2.8600246253E-03  0.0000000000E+00  0.0000000000E+00  3.3881317890E-21

 Crystal Tensor_qq(ke,je,3,3)
 -1.4490810177E-03  0.0000000000E+00  0.0000000000E+00  0.0000000000E+00 -2.2129302655E-03  0.0000000000E+00
  0.0000000000E+00  0.0000000000E+00 -5.0441693182E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21
 -2.2129302655E-03  0.0000000000E+00  0.0000000000E+00 -3.3881317890E-21  8.4595712067E-03  0.0000000000E+00
