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A continuum solvent model of the partial molar volumes and entropies of ionic solvation

Duignan, Timothy; Parsons, Drew; Ninham, Barry


Continuum solvent models of electrolyte solutions are extremely useful. However, before we can use them with confidence, it is important to test them by comparison with a range of experimental properties. Here, we have adapted our recently developed1,2 simple continuum solvent model of ionic solvation free energies to calculate the solvation entropies and partial molar volumes of a group of monovalent and monatomic ions. This procedure gives good quantitative agreement for larger ions, and...[Show more]

CollectionsANU Research Publications
Date published: 2014
Type: Journal article
Source: Journal of Physical Chemistry B
DOI: 10.1021/jp410956m


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