ON THE USE OF COMPUTER-SIMULATION TO DETERMINE THE EXCESS FREE-ENERGY IN FLUID MIXTURES

被引:75
作者
HAILE, JM
机构
[1] Clemson Univ, Clemson, SC, USA, Clemson Univ, Clemson, SC, USA
关键词
D O I
10.1016/0378-3812(86)90001-4
中图分类号
O414.1 [热力学];
学科分类号
摘要
LIQUIDS
引用
收藏
页码:103 / 127
页数:25
相关论文
共 38 条
[1]   STUDIES IN MOLECULAR DYNAMICS .3. MIXTURE OF HARD SPHERES [J].
ALDER, BJ .
JOURNAL OF CHEMICAL PHYSICS, 1964, 40 (09) :2724-&
[2]   MOLECULAR-DYNAMICS SIMULATIONS AT CONSTANT PRESSURE AND-OR TEMPERATURE [J].
ANDERSEN, HC .
JOURNAL OF CHEMICAL PHYSICS, 1980, 72 (04) :2384-2393
[3]   WHAT IS LIQUID - UNDERSTANDING STATES OF MATTER [J].
BARKER, JA ;
HENDERSON, D .
REVIEWS OF MODERN PHYSICS, 1976, 48 (04) :587-671
[4]  
Ben-Naim A., 1974, WATER AQUEOUS SOLUTI
[5]   A COMPARISON OF CONSTANT ENERGY, CONSTANT TEMPERATURE AND CONSTANT PRESSURE ENSEMBLES IN MOLECULAR-DYNAMICS SIMULATIONS OF ATOMIC LIQUIDS [J].
BROWN, D ;
CLARKE, JHR .
MOLECULAR PHYSICS, 1984, 51 (05) :1243-1252
[6]   COMPUTER EXPERIMENT FOR NON-LINEAR THERMODYNAMICS OF COUETTE-FLOW [J].
EVANS, DJ .
JOURNAL OF CHEMICAL PHYSICS, 1983, 78 (06) :3297-3302
[7]   CONSTANT PRESSURE-CONSTANT TEMPERATURE MOLECULAR-DYNAMICS FOR RIGID AND PARTIALLY RIGID MOLECULAR-SYSTEMS [J].
FERRARIO, M ;
RYCKAERT, JP .
MOLECULAR PHYSICS, 1985, 54 (03) :587-603
[8]   THERMODYNAMIC PERTURBATION-THEORY FOR MOLECULAR LIQUID-MIXTURES [J].
FISCHER, J ;
LAGO, S .
JOURNAL OF CHEMICAL PHYSICS, 1983, 78 (09) :5750-5758
[9]  
FRENKEL D, 1985, P E FERMI INT SCH PH
[10]  
Gear CW., 1971, NUMERICAL INITIAL VA