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A non-empirical intermolecular force-field for trinitrobenzene and its application in crystal structure prediction. (2021)

First Author: Aina AA

Attributed to: Computationally Designed Templates for Exquisite Control of Polymorphic Form funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1063/5.0043746

PubMed Identifier: 33685142

Publication URI: http://europepmc.org/abstract/MED/33685142

Type: Journal Article/Review

Volume: 154

Parent Publication: The Journal of chemical physics

Issue: 9

ISSN: 0021-9606