MONTE-CARLO STUDY OF A PHASE-SEPARATING LIQUID-MIXTURE BY UMBRELLA SAMPLING

被引:182
作者
TORRIE, GM [1 ]
VALLEAU, JP [1 ]
机构
[1] UNIV TORONTO,LASH MILLER CHEM LABS,TORONTO M5S 1A1,ONTARIO,CANADA
关键词
D O I
10.1063/1.434125
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
引用
收藏
页码:1402 / 1408
页数:7
相关论文
共 21 条
[1]   CORRECTIONS TO VANDERWAALS MODEL FOR MIXTURES AND FOR DIFFUSION-COEFFICIENT [J].
ALDER, BJ ;
ALLEY, WE ;
RIGBY, M .
PHYSICA, 1974, 73 (01) :143-155
[2]   PERTURBATION THEORY AND EQUATION OF STATE FOR FLUIDS .2. A SUCCESSFUL THEORY OF LIQUIDS [J].
BARKER, JA ;
HENDERSO.D .
JOURNAL OF CHEMICAL PHYSICS, 1967, 47 (11) :4714-&
[3]   THERMODYNAMIC PROPERTIES OF A RIGID-SPHERE FLUID [J].
CARNAHAN, NF ;
STARLING, KE .
JOURNAL OF CHEMICAL PHYSICS, 1970, 53 (02) :600-&
[4]   PERTURBATION-THEORY AND EXCESS PROPERTIES OF MIXTURES OF SIMPLE LIQUIDS [J].
GRUNDKE, EW ;
HENDERSON, D ;
BARKER, JA ;
LEONARD, PJ .
MOLECULAR PHYSICS, 1973, 25 (04) :883-896
[5]   THEORY OF SIMPLE MIXTURES [J].
HENDERSON, D .
ANNUAL REVIEW OF PHYSICAL CHEMISTRY, 1974, 25 :461-483
[6]   GIBBS-BOGOLIUBOV INEQUALITY [J].
ISIHARA, A .
JOURNAL OF PHYSICS PART A GENERAL, 1968, 1 (05) :539-+
[7]   PERTURBATION-THEORY FOR MIXTURES OF SIMPLE LIQUIDS [J].
LEE, LL ;
LEVESQUE, D .
MOLECULAR PHYSICS, 1973, 26 (06) :1351-1370
[8]   PERTURBATION THEORY AND EQUATION OF STATE FOR FLUIDS [J].
LEVESQUE, D ;
VERLET, L .
PHYSICAL REVIEW, 1969, 182 (01) :307-&
[9]   NPT-ENSEMBLE MONTE-CARLO CALCULATIONS FOR BINARY LIQUID MIXTURES [J].
MCDONALD, IR .
MOLECULAR PHYSICS, 1972, 23 (01) :41-&
[10]   EXCESS THERMODYNAMIC PROPERTIES OF MIXTURES OF LENNARD-JONES LIQUIDS [J].
MCDONALD, IR .
MOLECULAR PHYSICS, 1972, 24 (02) :391-&