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PDFgetX3: A rapid and highly automatable program for processing powder diffraction data into total scattering pair distribution functions
Pavol Juhas, Timur Davis, Christopher L. Farrow +1
PDFgetX3 is a new software application for converting X-ray powder diffraction data to atomic pair distribution function (PDF). PDFgetX3 has been designed for ease of use, speed an…
Towards a robust ad-hoc data correction approach that yields reliable atomic pair distribution functions from powder diffraction data
Christopher L. Farrow, Simon J. L. Billinge
We examine the equations to obtain atomic pair distribution functions (PDFs) from x-ray, neutron and electron powder diffraction data with a view to obtaining reliable and accurate…
Local structure of ReO at ambient pressure from neutron total scattering study
Emil S. Bozin, T. Chatterji, Simon J. L. Billinge
A hypothesis that the local rotations of ReO octahedra persist in the crystallographically untilted ambient phase of ReO is examined by the high-resolution neutron time-of-…