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Benchmarking of Molecular Dynamics Force Fields for Solid-Liquid and Solid-Solid Phase Transitions in Alkanes. (2021)

First Author: Burrows SA

Attributed to: Tier 2 Hub in Materials and Molecular Modelling funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1021/acs.jpcb.0c07587

PubMed Identifier: 33724846

Publication URI: http://europepmc.org/abstract/MED/33724846

Type: Journal Article/Review

Volume: 125

Parent Publication: The journal of physical chemistry. B

Issue: 19

ISSN: 1520-5207