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Liquid-gas phase behavior of an argon-like fluid modelled by the hard-core two-Yukawa potential

Authors :
Davide Pini
George Stell
Nigel B. Wilding
Source :
The Journal of Chemical Physics. 115:2702-2708
Publication Year :
2001
Publisher :
AIP Publishing, 2001.

Abstract

We study a model for an argon-like fluid parameterised in terms of a hard-core repulsion and a two-Yukawa potential. The liquid-gas phase behaviour of the model is obtained from the thermodynamically self-consistent Ornstein-Zernike approximation (SCOZA) of Hoye and Stell, the solution of which lends itself particularly well to a pair potential of this form. The predictions for the critical point and the coexistence curve are compared to new high resolution simulation data and to other liquid-state theories, including the hierarchical reference theory (HRT) of Parola and Reatto. Both SCOZA and HRT deliver results that are considerably more accurate than standard integral-equation approaches. Among the versions of SCOZA considered, the one yielding the best agreement with simulation successfully predicts the critical point parameters to within 1%.<br />Comment: 10 pages 6 figures

Details

ISSN :
10897690 and 00219606
Volume :
115
Database :
OpenAIRE
Journal :
The Journal of Chemical Physics
Accession number :
edsair.doi.dedup.....23c9273e304a6b849118cae100930dc4
Full Text :
https://doi.org/10.1063/1.1383796