Phase behaviour of a Lennard-Jones fluid in a pore with permeable walls ofa finite thickness: a density functional approach

Citation
P. Bryk et al., Phase behaviour of a Lennard-Jones fluid in a pore with permeable walls ofa finite thickness: a density functional approach, MOLEC PHYS, 96(10), 1999, pp. 1509-1516
Citations number
34
Categorie Soggetti
Physical Chemistry/Chemical Physics
Journal title
MOLECULAR PHYSICS
ISSN journal
00268976 → ACNP
Volume
96
Issue
10
Year of publication
1999
Pages
1509 - 1516
Database
ISI
SICI code
0026-8976(19990520)96:10<1509:PBOALF>2.0.ZU;2-6
Abstract
A confinement of a Lennard-Jones fluid in a system of slitlike pores separa ted by semipermeable walls of a finite width is studied. The walls are mode lled by square-well repulsive potential wells. The structure of the confine d fluid is investigated by means of a density functional method. For high p otential barriers separating the pores, the phase behaviour of the system i s similar to that for a single slitlike pore with impenetrable walls. For i ntermediate and low potential barriers the system shows different phase beh aviour. Within some temperature range the isotherms exhibit two hysteresis loops, which characterize the condensation of the fluid in different parts of the system, namely in the pore and inside the semipermeable walls. The s ystems characterized by low and intermediate potential barriers exhibit the triple point, such that at temperatures below that triple point the conden sation instantaneously takes place in both the pore and inside the permeabl e wall.