"Automated parameterization of intermolecular pair potentials using global ..."

Andreas Krämer et al. (2014)

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DOI: 10.1016/J.CPC.2014.08.022

access: closed

type: Journal Article

metadata version: 2020-02-21

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Andreas Krämer, Marco Hülsmann, Thorsten Köddermann, Dirk Reith:
Automated parameterization of intermolecular pair potentials using global optimization techniques. Comput. Phys. Commun. 185(12): 3228-3239 (2014)

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