Santos Andrés, Rohrmann René D
Departamento de Física, Universidad de Extremadura, Badajoz, E-06071, Spain.
Phys Rev E Stat Nonlin Soft Matter Phys. 2013 May;87(5):052138. doi: 10.1103/PhysRevE.87.052138. Epub 2013 May 29.
The chemical potentials of multicomponent fluids are derived in terms of the pair correlation functions for arbitrary number of components, interaction potentials, and dimensionality. The formally exact result is particularized to hard-sphere mixtures with zero or positive nonadditivity. As a simple application, the chemical potentials of three-dimensional additive hard-sphere mixtures are derived from the Percus-Yevick theory and the associated equation of state is obtained. This Percus-Yevick chemical-route equation of state is shown to be more accurate than the virial equation of state. An interpolation between the chemical-potential and compressibility routes exhibits a better performance than the well-known Boublík-Mansoori-Carnahan-Starling-Leland equation of state.
多组分流体的化学势是根据任意数量组分的对关联函数、相互作用势和维度推导出来的。形式上精确的结果被具体应用于具有零或正非加和性的硬球混合物。作为一个简单应用,从珀西-耶维克理论推导出三维加和硬球混合物的化学势,并得到相关的状态方程。结果表明,这个珀西-耶维克化学路径状态方程比维里状态方程更精确。化学势路径和压缩性路径之间的插值比著名的布布利克-曼苏里-卡纳汉-斯塔林-利兰状态方程表现更好。