SIMPLE ESTIMATION OF BULK THERMODYNAMIC PROPERTIES AND SURFACE-TENSION OF POLAR FLUIDS

被引:10
作者
ABBAS, S
NORDHOLM, S
机构
[1] Department of Physical Chemistry, Göteborg University, Chalmers University of Technology
关键词
D O I
10.1006/jcis.1995.1390
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
An effective pair potential reduces the dipole-dipole interactions in a polar fluid to spherically symmetric form. In this way it is shown that the Stockmayer model of polar fluids can be reduced for weak to moderately strong polar interactions to a Lennard-Jones form wherein the potential parameters are temperature dependent, Bulk properties and surface tension can then be obtained by standard simple fluid methods. The generalized van der Waals theory is used to calculate the surface tension of hydrogen halide single-component fluids (HCl, HBr, and HI). (C) 1995 Academic Press, Inc.
引用
收藏
页码:264 / 267
页数:4
相关论文
共 21 条
[1]   SIMPLE ESTIMATION OF SURFACE-TENSION OF SINGLE-COMPONENT FLUIDS [J].
ABBAS, S ;
NORDHOLM, S .
JOURNAL OF COLLOID AND INTERFACE SCIENCE, 1994, 166 (02) :481-489
[2]   MOLECULAR-DYNAMICS SIMULATION OF SURFACE-TENSION FOR POLAR-MOLECULES - CORRECTION FOR LONG-RANGE INTERACTION BY GENERALIZED VAN-DER-WAALS THEORY [J].
ABBAS, S ;
AHLSTROM, P ;
NORDHOLM, S .
ACTA CHEMICA SCANDINAVICA, 1995, 49 (03) :182-188
[3]  
[Anonymous], 1982, MOL THEORY CAPILLARI
[4]   THE LIQUID VAPOR INTERFACE OF SIMPLE POLAR FLUIDS .1. INTEGRAL-EQUATION AND PERTURBATION THEORIES [J].
EGGEBRECHT, J ;
GUBBINS, KE ;
THOMPSON, SM .
JOURNAL OF CHEMICAL PHYSICS, 1987, 86 (04) :2286-2298
[5]   THE LIQUID VAPOR INTERFACE OF SIMPLE POLAR FLUIDS .2. COMPUTER-SIMULATION [J].
EGGEBRECHT, J ;
THOMPSON, SM ;
GUBBINS, KE .
JOURNAL OF CHEMICAL PHYSICS, 1987, 86 (04) :2299-2308
[6]   GENERALIZED VANDERWAALS THEORY OF HARD-SPHERE OSCILLATORY STRUCTURE [J].
FREASIER, BC ;
WOODWARD, CE ;
NORDHOLM, S .
JOURNAL OF CHEMICAL PHYSICS, 1989, 90 (10) :5657-5663
[7]   THERMAL AND STRUCTURAL-PROPERTIES OF THE LIQUID-VAPOR INTERFACE IN DIPOLAR FLUIDS [J].
FRODL, P ;
DIETRICH, S .
PHYSICAL REVIEW E, 1993, 48 (05) :3741-3759
[8]   BULK AND INTERFACIAL PROPERTIES OF POLAR AND MOLECULAR FLUIDS [J].
FRODL, P ;
DIETRICH, S .
PHYSICAL REVIEW A, 1992, 45 (10) :7330-7354
[9]   GENERALIZED VANDERWAALS THEORY .2. QUANTUM EFFECTS ON THE EQUATION OF STATE [J].
HOOPER, MA ;
NORDHOLM, S .
AUSTRALIAN JOURNAL OF CHEMISTRY, 1980, 33 (09) :2029-2035
[10]   GENERALIZED VANDERWAALS THEORY .4. VARIATIONAL DETERMINATION OF THE HARD-SPHERE DIAMETER [J].
HOOPER, MA ;
NORDHOLM, S .
AUSTRALIAN JOURNAL OF CHEMISTRY, 1981, 34 (09) :1809-1818