A transferable force-field for alkali metal nitrates

Fantauzzo, V., Yeandel, S.R. orcid.org/0000-0002-6977-1677, Freeman, C.L. orcid.org/0000-0002-6326-1211 et al. (1 more author) (2022) A transferable force-field for alkali metal nitrates. Journal of Physics Communications, 6 (5). 055011. ISSN 2399-6528

Abstract

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Item Type: Article
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Copyright, Publisher and Additional Information:

© 2022 The Author(s). Published by IOP Publishing Ltd. Original content from this work may be used under the terms of the Creative Commons Attribution 4.0 licence. (http://creativecommons.org/licenses/by/4.0) Any further distribution of this work must maintain attribution to the author(s) and the title of the work, journal citation and DOI.

Keywords: crystallisation; forcefield; simulation; nitrates
Dates:
  • Published: May 2022
  • Published (online): 19 May 2022
  • Accepted: 9 May 2022
Institution: The University of Sheffield
Academic Units: The University of Sheffield > Faculty of Engineering (Sheffield) > Department of Materials Science and Engineering (Sheffield)
Funding Information:
Funder
Grant number
ENGINEERING AND PHYSICAL SCIENCE RESEARCH COUNCIL
EP/R018820/1
Engineering and Physical Sciences Research Council
EP/R029431/1
Depositing User: Symplectic Sheffield
Date Deposited: 23 May 2022 11:14
Last Modified: 23 May 2022 11:14
Status: Published
Publisher: IOP Publishing
Refereed: Yes
Identification Number: 10.1088/2399-6528/ac6e2b
Open Archives Initiative ID (OAI ID):

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