Automated parameterization of intermolecular pair...

Computer Physics Communications 2014 / 12 Vol. 185; Iss. 12

Automated parameterization of intermolecular pair potentials using global optimization techniques

Krämer, Andreas, Hülsmann, Marco, Köddermann, Thorsten, Reith, Dirk
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Volume:
185
Language:
english
Journal:
Computer Physics Communications
DOI:
10.1016/j.cpc.2014.08.022
Date:
December, 2014
File:
PDF, 928 KB
english, 2014
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