######################################### ### Really important parameters ## to be set to discover what the geometry conventions ## really are maxima_file = "maxima.p" orientation_codes=7 # 8 possibilities look at analyse_maxima_fourier.py theta = 0.0 theta_offset = 0.0 alpha = 50.0 beta = 0.0 angular_step = +0.1 det_origin_X = 1242.06 det_origin_Y = 1258.6 dist = 299.987 pixel_size = 0.172 kappa = 0 omega = 90 # lmbda is not so important in the desperate phase. It just expand the size of the lattice lmbda = 0.6968 ##################################################### ### Other parameters that are generally small or that can ## be refined later like r1,r2,r3 beam_tilt_angle = -0.05118 d1 = 0.04845 d2 = 0.1531 omega_offset = 0 phi = 0 ################################## # AA,BB,CC r1,r2,r3 : settint r1,r2,r3 to zero # triggers Fourier estimation of r1,r2,r3,AA,BB,CC # and also aAA,aBB,aCC ############################" ## r1 = 0 r2 = 0 r3 = 0 AA = 4.98 BB = 4.98 CC = 17.0 ## this gives some constraint for the cell angles aAA = 90 aBB = 90 aCC = 120 ################################################ ###### peaks positions are read from this file maxima_file = "maxima.p"