A modern workflow for force-field development – Bridging quantum mechanics and atomistic computational models

Published 2011 View Full Article

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Title
A modern workflow for force-field development – Bridging quantum mechanics and atomistic computational models
Authors
Keywords
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Journal
COMPUTER PHYSICS COMMUNICATIONS
Volume 182, Issue 10, Pages 2184-2191
Publisher
Elsevier BV
Online
2011-06-26
DOI
10.1016/j.cpc.2011.05.018

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