Liquid/vapor coexistence and surface tension of the Sutherland fluid with a variable range of interaction: Computer simulation and perturbation theory studies

被引:18
作者
Melnyk, Roman [1 ]
Orea, Pedro [5 ]
Nezbeda, Ivo [3 ,4 ]
Trokhymchuk, Andrij [1 ,2 ]
机构
[1] Natl Acad Sci Ukraine, Inst Condensed Matter Phys, UA-79011 Lvov, Ukraine
[2] Brigham Young Univ, Dept Chem & Biochem, Provo, UT 84602 USA
[3] Acad Sci Czech Republic, Inst Chem Proc Fundamentals, E Hala Lab, CR-16502 Prague, Czech Republic
[4] Univ JE Purkyne, Fac Sci, Usti Nad Labem 40096, Czech Republic
[5] Inst Mexicano Petr, Programa Ingn Mol, Mexico City 07730, DF, Mexico
关键词
liquid-vapour transformations; meson field theory; Monte Carlo methods; phase diagrams; surface tension; van der Waals forces; CORE YUKAWA FLUID; THERMODYNAMIC PROPERTIES; INTEGRAL-EQUATION; PHASE-EQUILIBRIA; POTENTIALS; INTERFACE; BEHAVIOR; SPHERES; SYSTEM; STATE;
D O I
10.1063/1.3371710
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 liquid-vapor phase diagram and surface tension for the Sutherland fluids with a variable range of interaction have been determined by canonical Monte Carlo simulations and compared with the augmented van der Waals analytic theory. The theory, based on a short-range Yukawa reference, performs well for medium-range models but its accuracy deteriorates with the shortening range due to deteriorating accuracy of the underlined analytic mean spherical approximation solution for the reference Yukawa potential. The simulation results are also analyzed from the point of the extended principle of corresponding states and it is shown that the surface tension and also, to a certain degree of accuracy, the vapor-liquid coexistence curve satisfy the principle.
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页数:8
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