Molecular thermodynamic models for the vapor-liquid equilibrium of nonpolar fluids

Citation
Ca. Faundez et al., Molecular thermodynamic models for the vapor-liquid equilibrium of nonpolar fluids, J PH EQUIL, 21(4), 2000, pp. 364-370
Citations number
26
Categorie Soggetti
Apllied Physucs/Condensed Matter/Materiales Science
Journal title
JOURNAL OF PHASE EQUILIBRIA
ISSN journal
10549714 → ACNP
Volume
21
Issue
4
Year of publication
2000
Pages
364 - 370
Database
ISI
SICI code
1054-9714(200008)21:4<364:MTMFTV>2.0.ZU;2-G
Abstract
We propose simple expressions giving the main vapor-liquid properties for 4 2 nonpolar fluids. These expressions are molecular models based on a pertur bative procedure, where the Lennard-Jones (LJ) system is taken as reference , the perturbed expressions being simple polynomial functions of the temper ature for a given substance. The molecular parameters used, which are the only input needed in the molec ular models, are the two LJ parameters, related to molecular size and the m olecular interaction intensity, and the acentric factor, related to the mol ecular shape, The proposed molecular models are extrapolatable outside the temperature ra nge used in the fit and seem to be easily applicable to other nonpolar flui ds.