A generating equation for mixing rules and two new mixing rules for interatomic potential energy parameters
Author:
Publisher
Wiley
Subject
Computational Mathematics,General Chemistry
Reference27 articles.
1. Inadequacy of the Lorentz-Berthelot combining rules for accurate predictions of equilibrium properties by molecular simulation
2. A New Intermolecular Potential Model for the n-Alkane Homologous Series
3. ; preprint, Springer-Verlag: Heidelberg, 1999.
4. Mapping of Explicit Atom onto United Atom Potentials
5. ; ; ; Intermolecular Forces: Their Origin and Determination; Clarendon Press: Oxford, UK, 1981.
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