Journal
JOURNAL OF PHYSICS-CONDENSED MATTER
Volume 14, Issue 46, Pages 12063-12078Publisher
IOP PUBLISHING LTD
DOI: 10.1088/0953-8984/14/46/313
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We develop a density functional for hard-sphere mixtures which keeps the structure of Rosenfeld's fundamental measure theory (FMT) whilst inputting the Mansoori-Camahan-Starling-Leland bulk equation of state. Density profiles for the pure hard-sphere fluid and for some binary mixtures adsorbed at a planar hard wall obtained from the present functional exhibit some improvement over those from the original FMT. The pair direct correlation function c((2))(r) of the pure hard-sphere fluid, obtained from functional differentiation, is also improved. When a tensor weight function is incorporated for the pure system our functional yields a good description of fluid-solid coexistence and of the properties of the solid phase.
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