THERMODYNAMIC PERTURBATION-THEORY OF CHARGED HARD-SPHERES IN A UNIFORM NEUTRALIZING BACKGROUND

Citation
Jw. Lee et al., THERMODYNAMIC PERTURBATION-THEORY OF CHARGED HARD-SPHERES IN A UNIFORM NEUTRALIZING BACKGROUND, Chemical physics, 178(1-3), 1993, pp. 105-112
Citations number
21
Categorie Soggetti
Physics, Atomic, Molecular & Chemical
Journal title
ISSN journal
03010104
Volume
178
Issue
1-3
Year of publication
1993
Pages
105 - 112
Database
ISI
SICI code
0301-0104(1993)178:1-3<105:TPOCHI>2.0.ZU;2-U
Abstract
Thermodynamic quantities such as the excess Helmholtz free energy, exc ess internal energy, and compressibility factor of charged hard sphere s are calculated from the hard-sphere perturbation theory and the opti mized hard-sphere model which we have recently developed. The optimize d hard-sphere model gives thermodynamic properties in excellent agreem ent with Monte Carlo results. We compute the radial distribution funct ion and structure factor at several values of the Coulomb coupling con stant and the hard-sphere packing fraction. Our results predict the ra dial distribution function and the structure factor in reasonable agre ement with Monte Carlo results.