Equation of state for nonpolar, polar, chain, and associating fluids based on the dipolar Yukawa potential

被引:28
|
作者
Liu, ZP
Li, YG [1 ]
Chan, KY
机构
[1] Tsing Hua Univ, Dept Chem Engn, Beijing 100084, Peoples R China
[2] Univ Hong Kong, Dept Chem, Hong Kong, Hong Kong, Peoples R China
关键词
D O I
10.1021/ie000627q
中图分类号
TQ [化学工业];
学科分类号
0817 ;
摘要
An equation of state (EOS) based on Yukawa and dipolar Yukawa potentials is presented. It is extended to chainlike and associating fluids in the framework of statistical associating fluid theory (SAFT). The EOS is applied to 42 pure real fluids (including nonpolar, polar, and associating fluids) and has a good description of saturated pressures and coexistence curves for these fluids, except very near to the critical point. The parameters for each fluid are regressed from experimental data. Some comparisons among this work, the original SAFT, and the Lennard-Jones (LJ)-based SAFT are carried out. The performance for real polar fluids is also compared between the dipolar Yukawa fluids (DYF) and the Stockmayer fluids (STMF).
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页码:973 / 979
页数:7
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