Site-averaging in the integral equation theory of interaction site models of macromolecular fluids: An exact approach

Details Site-averaging in the integral equation theory of interaction site models of macromolecular fluids: An exact approach Site-averaging in the integral equation theory of interaction site models of macromolecular fluids: An exact approach

2003-01-27

arxiv.org/abs/cond-mat/0301514v1

J. Chem. Phys. 118, 6702 (2003)

Physics

Condensed Matter

Soft Condensed Matter

2 pages, revTeX 4

Scientific paper

10.1063/1.1560940

A simple "trick" is proposed, which allows to perform exactly the site-averaging procedure required when developing integral equation theories of interaction site models of macromolecular fluids. It shows that no approximation is involved when the number of Ornstein-Zernike equations coupling the site-site correlation functions is reduced to one. Its potential practical interest for future theoretical developments is illustrated with a rederivation of the so-called molecular closures.

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