Percus Yevick
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If one defines a class of diagrams by the linear combination (Eq. 5.18 Ref.1) (See G. Stell in Ref. 2)
one has the exact integral equation
The Percus-Yevick integral equation sets D(r)=0. Percus-Yevick (PY) proposed in 1958 Ref. 3
The Percus-Yevick closure relation can be written as (Ref. 3 Eq. 61)
or
or (Eq. 10 in Ref. 4)
or (Eq. 2 of Ref. 5)
where is the intermolecular pair potential.
In terms of the bridge function
Note: the restriction arising from the logarithmic term Ref. 6.
A critical look at the PY was undertaken by Zhou and Stell in Ref. 7.
See also[edit]
References[edit]
- J. S. Rowlinson "The equation of state of dense systems", Reports on Progress in Physics 28 pp. 169-199 (1965)
- G. Stell "PERCUS-YEVICK EQUATION FOR RADIAL DISTRIBUTION FUNCTION OF A FLUID", Physica 29 pp. 517- (1963)
- Jerome K. Percus and George J. Yevick "Analysis of Classical Statistical Mechanics by Means of Collective Coordinates", Physical Review 110 pp. 1 - 13 (1958)
- G. A. Martynov and G. N. Sarkisov "Exact equations and the theory of liquids. V", Molecular Physics 49 pp. 1495-1504 (1983)
- Forrest J. Rogers and David A. Young "New, thermodynamically consistent, integral equation for simple fluids", Physical Review A 30 pp. 999 - 1007 (1984)
- Niharendu Choudhury and Swapan K. Ghosh "Integral equation theory of Lennard-Jones fluids: A modified Verlet bridge function approach", Journal of Chemical Physics, 116 pp. 8517-8522 (2002)
- Yaoqi Zhou and George Stell "The hard-sphere fluid: New exact results with applications", Journal of Statistical Physics 52 1389-1412 (1988)