"A modern workflow for force-field development - Bridging quantum mechanics ..."

Dirk Reith, Karl N. Kirschner (2011)

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DOI: 10.1016/J.CPC.2011.05.018

access: closed

type: Journal Article

metadata version: 2020-02-21

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Dirk Reith, Karl N. Kirschner:
A modern workflow for force-field development - Bridging quantum mechanics and atomistic computational models. Comput. Phys. Commun. 182(10): 2184-2191 (2011)

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