X-ray scattering simulator based on 3D fourier transform to accurately capture effects from paracrystallinity and orientational disorder. Inputs are .xyz or .pdb files (usually snapshots from molecular dynamics)
Scripts to analyze data from synchrotron X-ray scattering measurements
A software for processing and simulating grazing-incidence wide-angle X-ray scattering files
Command line based calculation of XAS/RIXS spectra via Quanty and Crispy.
Simulate and analyse surface probe small angle xray scattering experiments.
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