Hard-sphere fluids inside spherical, hard pores. Grand canonical ensemble Monte Carlo calculations and integral equation approximations

Peter Sloth

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    Abstract

    Density profiles and partition coefficients are obtained for hard-sphere fluids inside hard, spherical pores of different sizes by grand canonical ensemble Monte Carlo calculations. The Monte Carlo results are compared to the results obtained by application of different kinds of integral equation approximations. Also, some exact, analytical results for the partition coefficients are given, which are valid in the case of (very) small pores or at low density, respectively. The Journal of Chemical Physics is copyrighted by The American Institute of Physics.
    Original languageEnglish
    JournalJournal of Chemical Physics
    Volume93
    Issue number2
    Pages (from-to)1292-1298
    ISSN0021-9606
    DOIs
    Publication statusPublished - 1990

    Bibliographical note

    Copyright (1990) American Institute of Physics. This article may be downloaded for personal use only. Any other use requires prior permission of the author and the American Institute of Physics

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