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Figure 13
Hydrogen atomic displacement extended for structures derived with expHAR(n) as a function of n. Average ratio of equivalent isotropic ADPs from expHAR(n) and neutron measurement ([U_{\rm eq}^{\rm X}/U_{\rm eq}^{\rm N}]) for (a) polar and (b) non-polar hydrogen atoms. Average ratio of equivalent isotropic ADPs from expHAR(n) and HAR ([U_{\rm eq}^{\rm expHAR}/U_{\rm eq}^{\rm HAR}]) for (c) polar and (d) non-polar hydrogen atoms.

IUCrJ
Volume 12| Part 1| January 2025| Pages 74-87
ISSN: 2052-2525
https://doi.org/10.1107/S2052252524011242