TRIPLE-DIPOLE POTENTIALS IN CLASSICAL NONPOLAR FLUIDS

被引:19
作者
GRABEN, HW
FOWLER, R
机构
[1] Department of Physics, Clemson University, Clemson
[2] Computing Technology Center, Nuclear Division, Union Carbide Corporation, Oak Ridge
[3] Union Carbide Corporation, Oak Ridge, TN
来源
PHYSICAL REVIEW | 1969年 / 177卷 / 01期
关键词
D O I
10.1103/PhysRev.177.288
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
Formulas which express the triple-dipole contribution to the pressure, internal energy, effective pair potential, and density expansion of the radial distribution function appropriate to classical nonpolar fluids are evaluated. A rational approximation to tabulated theoretical values of the radial distribution function for argon based on the Lennard-Jones (12, 6) model is used to facilitate the numerical evaluation of the two- and three-fold integrals involved. The nonadditive contribution to the pressure and internal energy of argon is several percent over the temperature-density range considered which includes the critical region. It is found that the triple-dipole energy cannot account for the observed variation with density of the effective pair potential for argon reported by Mikolaj and Pings. © 1969 The American Physical Society.
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页码:288 / &
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