Equations of state for hard spheres and hard-sphere chains

被引:13
作者
Kim, IH
Bae, YC [1 ]
机构
[1] Hanyang Univ, Coll Engn, Div Chem Engn, Seoul 133791, South Korea
[2] Hanyang Univ, Coll Engn, Mol Thermodynam Lab, Seoul 133791, South Korea
关键词
equation of state; hard spheres; chain connectivity;
D O I
10.1016/S0378-3812(99)00325-8
中图分类号
O414.1 [热力学];
学科分类号
摘要
Several well-known equations of state developed for hard spheres are reviewed and applied to describe the properties of hard-sphere chains. Two different types of bonding terms that account for chain connectivity are adapted for hard-sphere-chain equations. Each model is then compared with computer simulation data for hard spheres and hard-sphere chains. For hard spheres, the Carnahan-Starling and Kolafa models best describe the computer simulation data. For hard-sphere chains, the accuracy of predictions from each model strongly depends on the choice of bonding terms. (C) 2000 Elsevier Science B.V. All rights reserved.
引用
收藏
页码:187 / 206
页数:20
相关论文
共 40 条
[1]   MONTE CARLO VALUES FOR RADIAL DISTRIBUTION FUNCTION OF A SYSTEM OF FLUID HARD SPHERES [J].
BARKER, JA ;
HENDERSON, D .
MOLECULAR PHYSICS, 1971, 21 (01) :187-+
[2]   HARD-SPHERE EQUATION OF STATE [J].
BOUBLIK, T .
JOURNAL OF CHEMICAL PHYSICS, 1970, 53 (01) :471-&
[3]   EQUATIONS OF STATE OF HARD BODY-FLUIDS [J].
BOUBLIK, T .
MOLECULAR PHYSICS, 1986, 59 (02) :371-380
[4]   EQUATION OF STATE FOR NONATTRACTING RIGID SPHERES [J].
CARNAHAN, NF ;
STARLING, KE .
JOURNAL OF CHEMICAL PHYSICS, 1969, 51 (02) :635-&
[5]   PHASE-EQUILIBRIA OF ASSOCIATING FLUIDS CHAIN MOLECULES WITH MULTIPLE BONDING SITES [J].
CHAPMAN, WG ;
JACKSON, G ;
GUBBINS, KE .
MOLECULAR PHYSICS, 1988, 65 (05) :1057-1079
[6]   PERCUS-YEVICK INTEGRAL-EQUATION THEORY FOR ATHERMAL HARD-SPHERE CHAINS .1. EQUATIONS OF STATE [J].
CHIEW, YC .
MOLECULAR PHYSICS, 1990, 70 (01) :129-143
[7]   FUSED HARD-SPHERE CHAIN MOLECULES - COMPARISON BETWEEN MONTE-CARLO SIMULATION FOR THE BULK PRESSURE AND GENERALIZED FLORY THEORIES [J].
COSTA, LA ;
ZHOU, YQ ;
HALL, CK ;
CARRA, S .
JOURNAL OF CHEMICAL PHYSICS, 1995, 102 (15) :6212-6223
[8]   EQUATION OF STATE FOR CHAIN MOLECULES - CONTINUOUS-SPACE ANALOG OF FLORY THEORY [J].
DICKMAN, R ;
HALL, CK .
JOURNAL OF CHEMICAL PHYSICS, 1986, 85 (07) :4108-4115
[9]   Thermodynamics of high polymer solutions [J].
Flory, PJ .
JOURNAL OF CHEMICAL PHYSICS, 1942, 10 (01) :51-61
[10]   CONTRIBUTION OF COVALENT BOND FORCE TO PRESSURE IN POLYMER MELTS [J].
GAO, J ;
WEINER, JH .
JOURNAL OF CHEMICAL PHYSICS, 1989, 91 (05) :3168-3173