TRIPLET DISTRIBUTION FUNCTIONS FOR HARD SPHERES AND HARD DISKS

被引:45
作者
UEHARA, Y
LEE, YT
REE, T
REE, FH
机构
[1] KOREA INST ELECTR TECHNOL,SEOUL,SOUTH KOREA
[2] KOREA ADV INST SCI,DEPT CHEM SCI,SEOUL,SOUTH KOREA
[3] UNIV UTAH,SALT LAKE CITY,UT 84112
[4] UNIV CALIF,LAWRENCE LIVERMORE LAB,LIVERMORE,CA 94550
关键词
D O I
10.1063/1.437667
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
The hard-sphere and hard-disk triplet correlation functions are computed from the Born-Green-Yvon 2 (BGY2) theory at several different densities for triplet geometries in which two particles are held fixed at contact. The same quantities are generated for hard spheres by means of a Monte Carlo method. Both the BGY2 and the Monte Carlo data agree satisfactorily. Next, the Kirkwood superposition approximation and the one-dimensional" approximation introduced earlier are examined to determine the regions of their applicability. © 1979 American Institute of Physics."
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页码:1884 / 1892
页数:9
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