Multiscale approach to computation of three-dimensional gas mixture flows in engineering microchannels

Abstract

A multiscale approach to computing real gas flows in engineering microchannels on high-performance computer systems in a wide range of Knudsen numbers is described. The numerical implementation of the approach combines the solution of quasigasdynamic equations and the molecular dynamics method. Following the approach, the parameters of the real gas equation of state are found at the molecular level, the kinetic gas properties are calculated, and the form of boundary conditions on the microchannel walls are determined. The technique is verified by computing several test problems. The results agree well with available theoretical and experimental data.