Accuracy of distributed multipoles and polarizabilities: Comparison between the LoProp and MpProp models

Pär Söderhjelm, J. W. Krogh, Gunnar Karlström, Ulf Ryde, Ronald Lindh. Accuracy of distributed multipoles and polarizabilities: Comparison between the LoProp and MpProp models. Journal of Computational Chemistry, 28(6):1083-1090, 2007. [doi]

Abstract

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