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Predicting anisotropic displacement parameters using molecular dynamics: density functional theory plus dispersion modelling of thermal motion in benzophenone (2013)

First Author: Reilly A

Attributed to: EPSRC UK National Service for Computational Chemistry Software funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1107/s0021889813006225

Publication URI: http://dx.doi.org/10.1107/s0021889813006225

Type: Journal Article/Review

Parent Publication: Journal of Applied Crystallography

Issue: 3