A density functional theory for polymers: Application to hard chain–hard sphere mixtures in slitlike pores

Abstract

A density functional theory for polymer fluids is derived. The form of the theory is identical to a continuum self-consistent-field theory but we show that with the correct ‘‘mean field,’’ the theory is exact. We apply the theory to a polymer fluid made up of tangential hard spheres and borrow from a successful density functional theory for simple hard spheres to obtain a nonlocal functional expression for this mean field. The latter depends only upon the monomer density. This approximation is used to treat the problem of a mixture of such polymers and simple hard spheres, contained in slitlike pores. Comparison with simulations show that the theory, though simple in structure, and containing a single adjustable parameter, is surprisingly accurate.