Scaling with a fractional power: Overcoming the shortage of scaled-particle variables for the hard-disk fluid

被引:1
|
作者
Hansen-Goos, Hendrik [1 ]
机构
[1] Univ Tubingen, Inst Theoret Phys, Morgenstelle 14, D-72076 Tubingen, Germany
来源
JOURNAL OF CHEMICAL PHYSICS | 2019年 / 150卷 / 01期
关键词
DENSITY-FUNCTIONAL THEORY; EQUATION-OF-STATE; SPHERE MIXTURES;
D O I
10.1063/1.5084328
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
Within scaled-particle theory, we construct an equation of state (EOS) for hard-disk mixtures by making use of an additional scaled-particle variable which weighs the densities of the different components by its radii to the power chi. This allows us to simultaneously respect exact results pertaining to the cases of a large particle or a point particle being added to the mixture. In the limit chi -> 2, the mixture EOS of Santos et al. [Mol. Phys. 96, 1 (1999)] is recovered, while the limit chi -> 0 yields the accurate expression for the interfacial free energy of Martin et al. [J. Chem. Phys. 149, 084701 (2018)]. From the low-density limit of the EOS, the value chi approximate to 0.8 is extracted, which is shown to yield a mixture EOS that is significantly more accurate than the expressions due to Santos et al. and Martin et al. In particular, the systematic deviation inherent to these prior results is remedied. Published under license by AIP Publishing.
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页数:6
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