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Parametrization of the radial distribution function and thermodynamic properties of the restricted primitive model of electrolyte solutions

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Czechoslovak Journal of Physics B Aims and scope

Abstract

Monte Carlo simulations for the restricted primitive model of 1-1 aqueous electrolyte solutions were performed on a minicomputer. The calculations covered the concentration range from 0·1 to 3 mol/dm3 and the ionic diameter varied from 2·0× ×10−10 to 4·75×10−10 m. On the basis of the Monte Carlo results a new analytical radial distribution function and excess internal energy parametrization were proposed for the restricted primitive model.

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Authors and Affiliations

  1. Department of Physical Chemistry, Institute of Chemical Technology, Suchbátarova 5, 166 28, Praha 6, Czechoslovakia

    J. Sýs, S. Labík & A. Malijevský

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  1. J. Sýs
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  2. S. Labík
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  3. A. Malijevský
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Sýs, J., Labík, S. & Malijevský, A. Parametrization of the radial distribution function and thermodynamic properties of the restricted primitive model of electrolyte solutions. Czech J Phys 33, 763–771 (1983). https://doi.org/10.1007/BF01589749

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  • DOI: https://doi.org/10.1007/BF01589749

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