File: make_sxrd_data.py

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'''Making sxrd data for simulations
P4mm symmetry k<h
'''
from numpy import c_, r_, array, arange, ones, savetxt

outfile = 'rods.dat'

h_min = 0
h_max = 3
k_min = 0
k_max = 3
l_min = 0.1
l_max = 3.5
l_step = 0.05

l = arange(l_min, l_max + l_step, l_step)

rods = array([[0,0,0,0,0]])[0:0]

for h in range(h_min, h_max + 1):
    for k in range(k_min, h+1):
        rods = r_[rods, c_[h*ones(l.shape), k*ones(l.shape), l, l*0, l*0]]

savetxt(outfile, rods)