nonperiodic intensity + electron scattering

DanPorter / Dans_Diffraction

Reads crystallographic cif files and simulates diffraction

Apache License 2.0

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nonperiodic intensity + electron scattering #9

Closed Prestipino closed 1 year ago

Prestipino commented 1 year ago

In the commit 2 contributions:

electron scattering factors from : Peng, L. M.; Acta Crystallogr A 1996, 52 (2), 257–276. Peng, L.-M. Acta Cryst A 1998, 54 (4), 481–485.

-structure_factor also for non-integer hkl (used for diffuse scattering)

DanPorter commented 1 year ago

Thanks very much for this Prestipino! The changes look like very useful additions to the code. I'll try to review and merge the request later this weekend.