MONTE CARLO SIMULATIONS OF Co (II) IN WATER INCLUDING THREE-BODY CORRECTION

MONTE CARLO SIMULATIONS OF Co (II) IN WATER INCLUDING THREE-BODY CORRECTION

In order to describe the cobalt-water interaction correctly, a new ab initio potential was developed consisting of pair interaction terms as well as three-body contributions. Within this approach, it was possible to correct for the well-known failures of pair potentials in describing solvation pheno...

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Bibliographic Details
Main Authors:	Cahyorini Kusumawardani, Harno Dwi Pranowo, Crys Fajar Partana, Mudasir Mudasir
Format:	Article
Language:	English
Published:	Department of Chemistry, Universitas Gadjah Mada 2010-06-01
Series:	Indonesian Journal of Chemistry
Online Access:	https://jurnal.ugm.ac.id/ijc/article/view/21732

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