Integral equations for the density profiles of infinitely polydisperse fluids at a hard wall

Citation
P. Bryk et al., Integral equations for the density profiles of infinitely polydisperse fluids at a hard wall, J CHEM PHYS, 111(13), 1999, pp. 6047-6052
Citations number
23
Categorie Soggetti
Physical Chemistry/Chemical Physics
Journal title
JOURNAL OF CHEMICAL PHYSICS
ISSN journal
00219606 → ACNP
Volume
111
Issue
13
Year of publication
1999
Pages
6047 - 6052
Database
ISI
SICI code
0021-9606(19991001)111:13<6047:IEFTDP>2.0.ZU;2-T
Abstract
An extension of the singlet-level equations for the density profile to the case of adsorption of polydisperse fluids on solid surfaces is presented. E xplicit calculations and comparisons with canonical ensemble Monte Carlo da ta have been performed for a polydisperse hard sphere fluid in contact with a hard wall by using the Percus-Yevick, hypernetted chain, and a modified Verlet approximation. A numerical solution of the density profile equations makes use of the orthonormal polynomials with the weight function correspo nding to the distribution function of the diameters of fluid particles. (C) 1999 American Institute of Physics. [S0021-9606(99)50933-1].