Can Polymer Coils Be Modeled as “Soft Colloids”?

Ard A. Louis(University of Cambridge), Peter G. Bolhuis(University of Cambridge), J. P. Hansen(University of Cambridge), Evert Jan Meijer(University of Amsterdam)
Physical Review Letters
September 18, 2000
Cited by 415Open Access
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Abstract

We map dilute or semidilute solutions of nonintersecting polymer chains onto a fluid of "soft" particles interacting via a concentration dependent effective pair potential, by inverting the pair distribution function of the centers of mass of the initial polymer chains. A similar inversion is used to derive an effective wall-polymer potential; these potentials are combined to successfully reproduce the calculated exact depletion interaction induced by nonintersecting polymers between two walls. The mapping opens up the possibility of large-scale simulations of polymer solutions in complex geometries.


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