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Perturbation theory for non-spherical fluids based on discretization of the interactions
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10.1063/1.4794783
/content/aip/journal/jcp/138/12/10.1063/1.4794783
http://aip.metastore.ingenta.com/content/aip/journal/jcp/138/12/10.1063/1.4794783
View: Figures

Figures

Image of FIG. 1.
FIG. 1.

Vapour-liquid equilibrium of the square well spherocylinders of prolate shape. Symbols are Gibbs ensemble simulation results from Ref. 33 , for the elongations values indicated in the figure. Continuous lines are the predictions of the shape corrected EOS employing the SW-EOS of Ref. 38 and dashed lines are the results obtained in Ref. 32 with an old SW-EOS.

Image of FIG. 2.
FIG. 2.

Example of a discrete version of a continuous Kihara potential. Main parameters are defined in the text.

Image of FIG. 3.
FIG. 3.

Vapour-liquid equilibrium of prolate Kihara spherocylinders. Symbols are Gibbs ensemble simulation results from Ref. 52 for the elongations values indicated in the figure. Continuous lines are the predictions of the shape-corrected DPT-EOS.

Image of FIG. 4.
FIG. 4.

Vapour-liquid equilibrium of oblate Kihara spherocylinders. Symbols are Gibbs ensemble simulation results from Ref. 52 for the core diameter values indicated in the figure. Continuous lines are the predictions of the shape-corrected DPT-EOS.

Image of FIG. 5.
FIG. 5.

Vapour-liquid equilibrium the angular Kihara model considered in Ref. 56 . Symbols are Gibbs ensemble simulation results from Ref. 56 . Continuous lines are the predictions of the size corrected DPT-EOS.

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/content/aip/journal/jcp/138/12/10.1063/1.4794783
2013-03-22
2014-04-16
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752b84549af89a08dbdd7fdb8b9568b5 journal.articlezxybnytfddd
Scitation: Perturbation theory for non-spherical fluids based on discretization of the interactions
http://aip.metastore.ingenta.com/content/aip/journal/jcp/138/12/10.1063/1.4794783
10.1063/1.4794783
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