FREEZING OF MIXTURES - THE DENSITY FUNCTIONAL THEORY

被引:15
作者
RICK, SW [1 ]
HAYMET, ADJ [1 ]
机构
[1] UNIV UTAH,DEPT CHEM,SALT LAKE CITY,UT 84112
关键词
D O I
10.1021/j100376a007
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
We present the density functional theory for the freezing of several different kinds of mixtures. The phase diagrams of Lennard-Jones binary systems are presented, including models of real binary mixtures of argon, krypton, and methane. The phase diagrams of binary mixtures of (a) hard spheres and (b) charged hard spheres are also presented. The freezing of polydisperse mixtures is also discussed. © 1990 American Chemical Society.
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页码:5212 / 5220
页数:9
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