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Yizhi Xu

2 results in Authors: Yizhi Xu

Theoretical and Computational Chemistry

Experimentally-validated ab initio crystal structure prediction of novel metal-organic framework materials

Yizhi Xu, Joseph M. Marrett, Hatem M. Titi, James P. Darby, Andrew J. Morris, Tomislav Friščić, Mihails Arhangelskis

Version 1 posted 28 June 2022

337

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Materials Chemistry

Hirshfeld atom refinement of metal-organic frameworks for accurate positioning of hydrogen atoms and disorder analysis

Yizhi Xu, Michał L. Chodkiewicz, Damian Trzybiński, Ivana Brekalo, Filip Topić, Krzysztof Wożniak, Mihails Arhangelskis

Version 1 posted 20 March 2023

206

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