T. Takahashi et T. Munakata, SOLVENT EFFECTS ON POLYMER CONFORMATION - DENSITY-FUNCTIONAL-THEORY APPROACH, Physical review. E, Statistical physics, plasmas, fluids, and related interdisciplinary topics, 56(4), 1997, pp. 4344-4350
Conformation properties of a polymer in a solvent are studied based on
density-functional theory. Instead of integrating out the solvent den
sity field in order to reduce the whole problem to that of one polymer
with medium-induced effective interactions, we consider the solvent d
ensity profile and the polymer conformation self-consistently on equal
footing. A mio-dimensional model system is considered for which some
numerical results art, shown, with emphasis placed on solvents effects
.