Equivalent potentials for equations of state for fluids of nonspherical molecules

作者: G. O. Williams , J. L. Lebowitz , J. K. Percus

DOI: 10.1063/1.447830

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摘要: We analyze the extent to which equation of state and other thermodynamic properties systems hard nonspherical molecules can be obtained from a density independent sphere reference system. conclude that median Barker–Henderson prescriptions effectively reproduce all data now available. discuss motivation for these two formulations in detail.

参考文章(19)
Peter A Egelstaff, An introduction to the liquid state ,(1967)
John D. Weeks, David Chandler, Hans C. Andersen, Perturbation Theory of the Thermodynamic Properties of Simple Liquids The Journal of Chemical Physics. ,vol. 55, pp. 5422- 5423 ,(1971) , 10.1063/1.1675700
M. S. Shaw, J. D. Johnson, B. L. Holian, Effective Spherical Potentials for Molecular Fluid Thermodynamics Physical Review Letters. ,vol. 50, pp. 1141- 1144 ,(1983) , 10.1103/PHYSREVLETT.50.1141
Tomá Boublík, Hard convex body equation of state The Journal of Chemical Physics. ,vol. 63, pp. 4084- 4084 ,(1975) , 10.1063/1.431882
Joel L. Lebowitz, Jerome K. Percus, Sphericalization of nonspherical interactions Journal of Chemical Physics. ,vol. 79, pp. 443- 444 ,(1983) , 10.1063/1.445542
I. R. Mcdonald, J.‐P. Hansen, Douglas Henderson, Theory of simple liquids ,(1976)
J.W. Perram, L.R. White, Perturbation theory for the angular correlation function Molecular Physics. ,vol. 28, pp. 527- 533 ,(1974) , 10.1080/00268977400103051
D. Frenkel, B. M. Mulder, J. P. McTague, Phase diagram of a system of hard ellipsoids Physical Review Letters. ,vol. 52, pp. 287- 290 ,(1984) , 10.1103/PHYSREVLETT.52.287
The Statistical Mechanics of Assemblies of Axially Symmetric Molecules. I. General Theory Proceedings of The Royal Society A: Mathematical, Physical and Engineering Sciences. ,vol. 221, pp. 498- 507 ,(1954) , 10.1098/RSPA.1954.0044
A. Bellemans, Free energy of an assembly of nonspherical molecules with a hard core Physical Review Letters. ,vol. 21, pp. 527- 529 ,(1968) , 10.1103/PHYSREVLETT.21.527