✦ LIBER ✦

Monte Carlo simulations of single ion chemical potentials. Results for the unrestricted primitive model

✍ Scribed by Peter Sloth; Torben Smith Sørensen

Publisher: Elsevier Science
Year: 1988
Tongue: English
Weight: 268 KB
Volume: 146
Category: Article
ISSN: 0009-2614
DOI: 10.1016/0009-2614(88)87477-3

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✦ Synopsis

Widom's formula has been used to calculate single-ion activity coefficients for the primitive model of electrolyte systems, with unequal ionic radii, in Monte Carlo simulations based on the Metropolis sampling procedure. The results are found to be in reasonable agreement with values obtained by the MSA theory.