A generalized force-modified potential energy surface for mechanochemical simulations

Journal article

Open access

Peer reviewed

The Journal of Chemical Physics, Vol.143(13), p.134109

10/07/2015

Abstract and subjects

Classical & Quantum Mechanics, General Physics(71)

Inorganic, Organic, Physical, & Analytical Chemistry(37)

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Title: A generalized force-modified potential energy surface for mechanochemical simulations
Authors/Creators - name: Gopinath Subramanian
Nithin Mathew
Jeffery Allen Leiding
Publication Details: The Journal of Chemical Physics, Vol.143(13), p.134109
Number of pages: 25 p.
Government Number: LA-UR-15-23906
Language: English
Resource Type: Journal article
DOI: https://doi.org/10.1063/1.4932103
Publication ISSN: 0021-9606
ISSN: 0021-9606