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Figure 9
Box-whisker plot analysis showing the difference in the ADPs between neutron diffraction and the model for single-crystal X-ray diffraction for xylitol: HAR [NoSpherA2/ORCA (version 5.0.3)/def2-TZVP/PBE] and ReCrystal/0.8 Å (def2-TZVP/PBE).

IUCrJ
Volume 12| Part 3| May 2025| Pages 322-333
ISSN: 2052-2525
https://doi.org/10.1107/S2052252525002040