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Gaussian Induced Dipole Polarization Model

A new induced dipole polarization model based on interacting Gaussian charge densities is presented. In contrast to the original induced point dipole model, the Gaussian polarization model is capable of finite interactions at short distances. Aspects of convergence related to the Gaussian model will...

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Detalhes bibliográficos
Main Authors: ELKING, DENNIS, DARDEN, TOM, WOODS, ROBERT J.
Formato: Artigo
Idioma:Inglês
Publicado em: 2007
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC2176076/
https://ncbi.nlm.nih.gov/pubmed/17299773
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/jcc.20574
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