TRIPLET CORRELATION-FUNCTION FOR HARD-SPHERE SYSTEMS

被引:40
|
作者
MULLER, EA
GUBBINS, KE
机构
[1] School of Chemical Engineering, Cornell University, Ithaca, NY, 14853
基金
美国国家科学基金会;
关键词
D O I
10.1080/00268979300102081
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
Monte Carlo simulation data are presented for the triplet correlation function g(3)(r, s, t), for a hard sphere system. Results are reported for reduced densities rhosigma3 between 0.3 and 0.88, and reduced distances r/sigma from 1.02 to 2.42 for all possible configurations. Comparisons with the PY3 theory show excellent agreement for all cases studied. A table of the complete simulation results is available separately.
引用
收藏
页码:91 / 101
页数:11
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