Class of consistent fundamental-measure free energies for hard-sphere mixtures
Abstract
In fundamental-measure theories the bulk excess free-energy density of a hard-sphere fluid mixture is assumed to depend on the partial number densities only through the four scaled-particle-theory variables , i.e., . By imposing consistency conditions, it is proven here that such a dependence must necessarily have the form , where is a scaled variable and is an arbitrary dimensionless scaling function which can be determined from the free-energy density of the one-component system. Extension to the inhomogeneous case is achieved by standard replacements of the variables by the fundamental-measure (scalar, vector, and tensor) weighted densities . Comparison with computer simulations shows the superiority of this bulk free energy over the White Bear one.
Keywords
Cite
@article{arxiv.1208.3089,
title = {Class of consistent fundamental-measure free energies for hard-sphere mixtures},
author = {Andrés Santos},
journal= {arXiv preprint arXiv:1208.3089},
year = {2012}
}
Comments
5 pages; v2: substantial additions