Second virial coefficient of a generalized Lennard-Jones potential

作者：Gonzalez Calderon Alfredo^*; Rocha Ichante Adrian

来源：Journal of Chemical Physics, 2015, 142(3): 034305.

DOI：10.1063/1.4905663

We present an exact analytical solution for the second virial coefficient of a generalized Lennard-Jones type of pair potential model. The potential can be reduced to the Lennard-Jones, hard-sphere, and sticky hard-sphere models by tuning the potential parameters corresponding to the width and depth of the well. Thus, the second virial solution can also regain the aforementioned cases. Moreover, the obtained expression strongly resembles the one corresponding to the Kihara potential. In fact, the F-k functions are the same. Furthermore, for these functions, the complete expansions at low and high temperature are given. Additionally, we propose an alternative stickiness parameter based on the obtained second virial coefficient.

• 出版日期2015-1-21