The structure of lennard-jones dimerizing spheres near a hard wall from the nonuniform wertheim ornstein-zernike equation

摘要

A dimerizing model of Lennard-Jones particles near a hard wall is studied using the inhomogeneous or second order Wertheim Ornstein-Zernike equation and the inhomo- geneous associative Percus-Yevick closure. We investigated the influence of the degree of dimerization on the shape of the density profiles and on inhomogeneous pair correlation functions.