Virial coefficients of the additive hard-sphere binary mixtures up to the eighth

被引：2

作者：

Labik, Stanislav ^{[1
]}

Malijevsky, Anatol ^{[1
]}

Kolafa, Jiri ^{[1
]}

机构：

[1] Univ Chem & Technol, Dept Phys Chem, Prague 16628 6, Czech Republic

来源：

MOLECULAR PHYSICS | 2017年 / 115卷 / 9-12期

关键词：

Hard spheres; binary mixture; virial coefficients; Monte Carlo;

D O I：

10.1080/00268976.2016.1226441

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

The fifth to eighth virial coefficients of the additive hard-sphere binary mixtures are accurately calculated in the whole range of sphere diameter ratios. Calculations are based on an extension of the technique for topological analysis of the Ree-Hoover diagrams and the standard Metropolis Monte Carlo algorithm. The results for the fifth to the seventh partial virial coefficients are compared with literature data. The eighth virial coefficients are new. The results are also compared with a semi-empirical analytical equation due to Wheatley and discussed. [GRAPHICS] .

引用

页码：1051 / 1056

页数：6

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