Structure and Stability of Molecular Crystals with Many-Body Dispersion-Inclusive Density Functional Tight Binding

Journal: The Journal of Physical Chemistry Letters

Published: 2018-01-03

DOI: 10.1021/acs.jpclett.7b03234

Affiliations: 7

Authors: 4

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Institutions FC
Fritz Haber Institute of the Max Planck Society (FHI), Germany 0.38
Warwick Centre for Scientific Computing (CSC), United Kingdom (UK) 0.13
Warwick Department of Chemistry (Warwick Chemistry), United Kingdom (UK) 0.13
Physics and Materials Science Research Unit, University of Luxembourg, Luxembourg 0.13
UCL Department of Chemistry, United Kingdom (UK) 0.08
London Centre for Nanotechnology (LCN), United Kingdom (UK) 0.08
Thomas Young Centre (TYC) - The London Centre for the Theory and Simulation of Materials, United Kingdom (UK) 0.08