4.7 Article

Distributed dispersion: A new approach

Journal

JOURNAL OF CHEMICAL PHYSICS
Volume 119, Issue 9, Pages 4620-4628

Publisher

AMER INST PHYSICS
DOI: 10.1063/1.1594722

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Distributed polarizability and dispersion models can be constructed by analyzing the response, at each point in an array surrounding the molecule, to the field due to a point charge at each point of the array in turn, in an extension of the method described by Dehez [Chem. Phys. Lett. 338, 180 (2001)]. Anisotropic distributed polarizabilities and anisotropic distributed C-6 dispersion coefficients have been calculated for carbon dioxide, water, benzene and ethane. (C) 2003 American Institute of Physics.

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