作者
Michael Heying, David S Corti
发表日期
2004/12/23
期刊
The Journal of Physical Chemistry B
卷号
108
期号
51
页码范围
19756-19768
出版商
American Chemical Society
简介
We revisit the successful scaled particle theory (SPT) of hard particle fluids, originally developed by Reiss, Frisch, and Lebowitz (J. Chem. Phys. 1959, 31, 369). In the initial formulation of SPT, five exact conditions were derived that constrained the form of the central function G. Only three of these conditions, however, were employed to generate an equation of state. Later, the number of relations used to determine G was increased to five (Mandell, M. J.; Reiss, H., J. Stat. Phys. 1975, 13, 113). The resulting equation of state was an improvement over the original formulation, although its accuracy was still limited at high densities. In an effort to increase the accuracy of SPT predictions, we propose two new formally exact conditions on the form of G. These sixth and seventh conditions relate exactly known derivatives of G to the slope and curvature of the hard sphere radial distribution function at contact, g‘(σ+) and g‘ ‘(σ …
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