Direct evaluation of the physical characteristics of Yukawa fluids based on a simple approximation for the radial distribution function

被引:18
|
作者
Fairushin, I. I. [1 ,2 ]
Khrapak, S. A. [2 ,3 ]
Mokshin, A. V. [1 ]
机构
[1] Kazan Fed Univ, Kazan 420008, Russia
[2] Russian Acad Sci, Joint Inst High Temp, Moscow 125412, Russia
[3] Deutsch Zentrum Luft & Raumfahrt DLR, Inst Mat Phys Weltraum, D-82234 Wessling, Germany
基金
俄罗斯科学基金会;
关键词
Yukawa fluid; Radial distribution function; Two-step approximation; Thermodynamic properties; Dispersion law of the longitudinal collective mode; LIQUIDS;
D O I
10.1016/j.rinp.2020.103359
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
We propose a simple analytical approximation for the radial distribution function (RDF) in a single-component Yukawa fluid. The proposed RDF depends on the two input parameters - the non-ideality parameter and the structure (screening) parameter, which determine the thermodynamic state of Yukawa systems. We demonstrate that various physical properties can be directly calculated using the proposed RDF. In particular, the internal energy and pressure, the excess entropy in the pair approximation, and the dispersion relation of longitudinal acoustic-like collective excitations are calculated. These theoretical results are compared with the results from molecular dynamics simulations and good overall agreement is observed in the investigated regime of screening and coupling parameters.
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页数:5
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