def exercise_Rietveld_Refinery_SinglePhase():
RietveldPhases.global_params_from_string(global_input_string,
tst_two_theta, tst_y)
RR = RietveldRefinery(Rt,
minimizer_input_string,
store_intermediate_state=True)
RR.display(RR.minimize_Scale_Offset)
RR.display(RR.minimize_All)
RietveldPhases.empty_x()
def exercise_Rietveld_Refinery_Multiphase():
RietveldPhases.global_params_from_string(global_input_string,
tst_two_theta, tst_y)
Rt = []
for cif, input_string in zip(cifs, input_strings):
Rt.append(
RietveldPhases(r"..//data//cifs//" + cif,
d_min,
d_max,
input_string_or_file_name=input_string,
delta_theta=2.0,
Intensity_Cutoff=0.005))
RR = RietveldRefinery(Rt,
minimizer_input_string,
store_intermediate_state=True)
RR.display(RR.minimize_Scale_Offset)
RR.display(RR.minimize_All)
RietveldPhases.empty_x()