REPLICA ORNSTEIN-ZERNIKE THEORY FOR CHEMICALLY ASSOCIATING FLUIDS WITH DIRECTIONAL FORCES IN DISORDERED POROUS-MEDIA - SMITH-NEZBEDA MODEL IN A HARD-SPHERE MATRIX

Citation
Ga. Orozco et al., REPLICA ORNSTEIN-ZERNIKE THEORY FOR CHEMICALLY ASSOCIATING FLUIDS WITH DIRECTIONAL FORCES IN DISORDERED POROUS-MEDIA - SMITH-NEZBEDA MODEL IN A HARD-SPHERE MATRIX, Molecular physics, 91(4), 1997, pp. 625-634
Citations number
36
Categorie Soggetti
Physics, Atomic, Molecular & Chemical
Journal title
ISSN journal
00268976
Volume
91
Issue
4
Year of publication
1997
Pages
625 - 634
Database
ISI
SICI code
0026-8976(1997)91:4<625:ROTFCA>2.0.ZU;2-X
Abstract
The associative replica Ornstein-Zernike equations, supplemented by th e associative hypernetted chain approximation are used to describe the Smith-Nezbeda model for an associating fluid adsorbed in a disordered hard sphere matrix. These equations have been developed by combining the replica Ornstein-Zernike equations with the Wertheim theory of ass ociation in fluids. The pair distribution functions and fraction of un bonded species are;calculated. Also investigated is the influence of t he association on the equation of state a nd the chemical potential of the absorbed fluid.