On generalization of Van der Waals approach for isotropic-nematic fluid phase equilibria of anisotropic fluids in disordered porous medium
A generalized Van der Waals approach is developed for anisotropic fluids in disordered porous media. As the reference system a hard spherocylinder fluid in a disordered porous medium is considered and described in the framework of the scaled particle theory with the Carnahan-Starling and Parsons-Lee...
Main Authors: | , |
---|---|
Format: | Article |
Language: | English |
Published: |
Institute for Condensed Matter Physics
2020-03-01
|
Series: | Condensed Matter Physics |
Subjects: | |
Online Access: | https://doi.org/10.5488/CMP.23.13601 |
id |
doaj-6f054c76a56747c29a60a09b326b7f22 |
---|---|
record_format |
Article |
spelling |
doaj-6f054c76a56747c29a60a09b326b7f222020-11-25T01:38:28ZengInstitute for Condensed Matter PhysicsCondensed Matter Physics1607-324X2224-90792020-03-012311360110.5488/CMP.23.13601On generalization of Van der Waals approach for isotropic-nematic fluid phase equilibria of anisotropic fluids in disordered porous mediumM.F. HolovkoV.I. ShmotolokhaA generalized Van der Waals approach is developed for anisotropic fluids in disordered porous media. As the reference system a hard spherocylinder fluid in a disordered porous medium is considered and described in the framework of the scaled particle theory with the Carnahan-Starling and Parsons-Lee corrections. The attractive part of interaction is treated in the framework of the mean field approximation in which due to orientational dependence of the excluded volume of two spherocylinders, a coupling between attractive and repulsive contributions is found. We focus on spherocylinder fluids with sufficiently long particle lengths for which the nematic-nematic transition was established. It is shown that these two nematic phases have different densities and are characterized by different orientational ordering. Strong influence of the type of interparticle attraction on the phase behaviour of anisotropic fluids in disordered porous media is established. Three simple models for this purpose are considered, namely a model with the Lennard-Jones anisotropic attraction, a model with modified Lennard-Jones attraction and a model with anisotropic square-well potential. For all considered models, the phase diagram shifts to the region of lower densities and lower temperatures as the porosity decreases.https://doi.org/10.5488/CMP.23.13601hard spherocylinder fluidsdisordered porous mediascaled particle theorygeneralized van der waals equationisotropic-nematic equilibrianematic-nematic transition |
collection |
DOAJ |
language |
English |
format |
Article |
sources |
DOAJ |
author |
M.F. Holovko V.I. Shmotolokha |
spellingShingle |
M.F. Holovko V.I. Shmotolokha On generalization of Van der Waals approach for isotropic-nematic fluid phase equilibria of anisotropic fluids in disordered porous medium Condensed Matter Physics hard spherocylinder fluids disordered porous media scaled particle theory generalized van der waals equation isotropic-nematic equilibria nematic-nematic transition |
author_facet |
M.F. Holovko V.I. Shmotolokha |
author_sort |
M.F. Holovko |
title |
On generalization of Van der Waals approach for isotropic-nematic fluid phase equilibria of anisotropic fluids in disordered porous medium |
title_short |
On generalization of Van der Waals approach for isotropic-nematic fluid phase equilibria of anisotropic fluids in disordered porous medium |
title_full |
On generalization of Van der Waals approach for isotropic-nematic fluid phase equilibria of anisotropic fluids in disordered porous medium |
title_fullStr |
On generalization of Van der Waals approach for isotropic-nematic fluid phase equilibria of anisotropic fluids in disordered porous medium |
title_full_unstemmed |
On generalization of Van der Waals approach for isotropic-nematic fluid phase equilibria of anisotropic fluids in disordered porous medium |
title_sort |
on generalization of van der waals approach for isotropic-nematic fluid phase equilibria of anisotropic fluids in disordered porous medium |
publisher |
Institute for Condensed Matter Physics |
series |
Condensed Matter Physics |
issn |
1607-324X 2224-9079 |
publishDate |
2020-03-01 |
description |
A generalized Van der Waals approach is developed for anisotropic fluids in disordered porous media. As the reference system a hard spherocylinder fluid in a disordered porous medium is considered and described in the framework of the scaled particle theory with the Carnahan-Starling and Parsons-Lee corrections. The attractive part of interaction is treated in the framework of the mean field approximation in which due to orientational dependence of the excluded volume of two spherocylinders, a coupling between attractive and repulsive contributions is found. We focus on spherocylinder fluids with sufficiently long particle lengths for which the nematic-nematic transition was established. It is shown that these two nematic phases have different densities and are characterized by different orientational ordering. Strong influence of the type of interparticle attraction on the phase behaviour of anisotropic fluids in disordered porous media is established. Three simple models for this purpose are considered, namely a model with the Lennard-Jones anisotropic attraction, a model with modified Lennard-Jones attraction and a model with anisotropic square-well potential. For all considered models, the phase diagram shifts to the region of lower densities and lower temperatures as the porosity decreases. |
topic |
hard spherocylinder fluids disordered porous media scaled particle theory generalized van der waals equation isotropic-nematic equilibria nematic-nematic transition |
url |
https://doi.org/10.5488/CMP.23.13601 |
work_keys_str_mv |
AT mfholovko ongeneralizationofvanderwaalsapproachforisotropicnematicfluidphaseequilibriaofanisotropicfluidsindisorderedporousmedium AT vishmotolokha ongeneralizationofvanderwaalsapproachforisotropicnematicfluidphaseequilibriaofanisotropicfluidsindisorderedporousmedium |
_version_ |
1725053593653870592 |