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Monte Carlo study of the equimolar mixture of hard spheres and spherocylinders

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Czechoslovak Journal of Physics B Aims and scope

Abstract

Using the Monte Carlo simulation technique the behaviour of the equimolar mixture of hard spheres and prolate spherocylinders of the length-to-breadth ratio equal to two was studied for the case in which both components had the same breadth. The surface-to-surface and the center-to-center correlation functions and the compressibility factor were computed and the results compared with theoretical predictions. Effect of non-sphericity of one component is shortly discussed.

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Authors and Affiliations

  1. Institute of Chemical Process Fundamentals, Czechosl. Acad. Sci., Prague, Suchdol 2, 165 02, Praha 6, Czechoslovakia

    T. Boublík & I. Nezbeda

Authors
  1. T. Boublík
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  2. I. Nezbeda
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Boublík, T., Nezbeda, I. Monte Carlo study of the equimolar mixture of hard spheres and spherocylinders. Czech J Phys 30, 121–127 (1980). https://doi.org/10.1007/BF01595676

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  • DOI: https://doi.org/10.1007/BF01595676

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