Off-the-shelf DFT-DISPersion methods:Are they now “on-trend” for organic molecular crystals?

Geatches, Dawn, Rosbottom, Ian, Marchese Robinson, RIchard et al. (6 more authors) (2019) Off-the-shelf DFT-DISPersion methods:Are they now “on-trend” for organic molecular crystals? Journal of Chemical Physics. 044106. ISSN 1089-7690

Abstract

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Item Type: Article
Authors/Creators:
Copyright, Publisher and Additional Information:

© 2019 Author(s). Published under license by AIP Publishing

Dates:
  • Published (online): 26 July 2019
  • Accepted: 20 June 2019
Institution: The University of York
Academic Units: The University of York > Faculty of Sciences (York) > Physics (York)
Funding Information:
Funder
Grant number
EPSRC
EP/P022561/1
Depositing User: Pure (York)
Date Deposited: 31 Jul 2019 08:30
Last Modified: 08 Feb 2025 00:34
Published Version: https://doi.org/10.1063/1.5108829
Status: Published online
Refereed: Yes
Identification Number: 10.1063/1.5108829
Open Archives Initiative ID (OAI ID):

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