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Figure 4
Ex situ PDF refinements. The observed PDF, Gobs, is shown as blue circles, the calculated PDF, Gcalc, is shown as a red line, and the difference between the observed and calculated PDFs, Gdiff, is shown as a green line. The reduced atomic PDF, G, in Å−2 is shown as a function of the interatomic distance, r, in Å. The sample label and the weighted residual value, Rw, are displayed to the right in each subplot.

Journal logoJOURNAL OF
APPLIED
CRYSTALLOGRAPHY
ISSN: 1600-5767
Volume 57| Part 4| August 2024| Pages 1171-1183
https://doi.org/10.1107/S1600576724005624
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