Inversion in binary gas mixtures in rarefied flow conditions: Direct simulation Monte Carlo solution and comparison with the analytical solutions at free molecular regime

Abstract

This paper analyzes the mixing of gases in a plane channel at rarefied conditions. The direct simulation Monte Carlo method is employed to simulate gas mixing in parallel mixers working at different Knudsen numbers and having different values of wall accommodation coefficient. Results show that the normal-to-wall component of the mole fraction gradient may have the same sign as the corresponding component of the diffusive mass flux vector near the diffuse solid walls in contrast to the predictions of Fick's law for continuum conditions. This non-continuum behavior, which is called “inversion” in the present study, will become more pronounced at higher Knudsen numbers, whereas it will become less evident for smaller wall accommodation coefficients. To confirm that the observed phenomenon is consistent with the basic physical laws governing the rarefied gas dynamics and it is not an artifact of the numerical method, a new analytical model based on the kinetic theory of gases is developed for the parallel mixers that have diffuse walls and are working in the free-molecular regime. Excellent agreement is observed between the analytical and direct simulation Monte Carlo results in the free molecular flow regime. Both methods predict the occurrence of inversion near the diffuse walls at highly rarefied flow conditions.