Characterization of the structure and dynamics of an aqueous Hg2+ solution by an ab initio molecular dynamics study

Journal article

Authors/Editors

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Publication Details

Author list: Vchirawongkwin, V; Kritayakornupong, C; Tongraar, A

Publisher: Elsevier

Publication year: 2011

Journal: Journal of Molecular Liquids (0167-7322)

Volume number: 163

Issue number: 3

Start page: 147

End page: 152

Number of pages: 6

ISSN: 0167-7322

eISSN: 1873-3166

Languages: English-Great Britain (EN-GB)

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Abstract

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Keywords

Dissociative interchange, MD, QMCF, Structure-making