NPT ENSEMBLE MONTE-CARLO SIMULATION OF ETHANOL IN WATER

被引：0

作者：

LILLY, AC ^{[1
]}

BEERS, FJ ^{[1
]}

SCHUG, JC ^{[1
]}

机构：

[1] VIRGINIA POLYTECH INST & STATE UNIV, DEPT CHEM, BLACKSBURG, VA 24061 USA

来源：

JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM | 1990年 / 68卷 / 1-2期

关键词：

D O I：

暂无

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

页码：69 / 75

页数：7

共 26 条

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[8] THERMODYNAMIC PROPERTIES OF AQUEOUS ORGANIC SOLUTES IN RELATION TO THEIR STRUCTURE .3. APPARENT MOLAL VOLUMES AND HEAT-CAPACITIES OF LOW-MOLECULAR WEIGHT ALCOHOLS AND POLYOLS AT 25DEGREESC [J].

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[9] QUANTUM AND STATISTICAL STUDIES OF LIQUIDS .25. SOLVATION AND CONFORMATION OF METHANOL IN WATER [J].

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[10] COMPARISON OF SIMPLE POTENTIAL FUNCTIONS FOR SIMULATING LIQUID WATER [J].

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CHANDRASEKHAR, J ;

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JOURNAL OF CHEMICAL PHYSICS, 1983, 79 (02) :926-935

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