The direct molecular simulation (DMS) method is used to obtain shear viscosity data for non-
reacting air and its components by simulating isothermal, plane Poiseuille subsonic flows …

Using the quasi-classical trajectory method, we systematically studied the state-to-state
vibrational relaxation process of N2 (v 1)+ N2 (v 2) collisions over a wide temperature range …

We present direct molecular simulations (DMSs) of rovibrational excitation and dissociation
of oxygen across normal shock waves. These are the first atomistic simulations of normal …

We present a Mach 15 air flow over a blunt two-dimensional wedge simulated using the
direct molecular simulation method. As electronically excited states are not modelled, the …

A large-scale, fully resolved direct simulation Monte Carlo (DSMC) computation of a non-
equilibrium, reactive flow of pure oxygen over a double cone is presented. Under the …

The high-temperature non-equilibrium effect is a novel and significant issue in the flows over
a high Mach number (above Mach 8) air-breathing vehicle. Thus, this study attempts to …

The atom-exchange and atomization dissociation dynamics for the N (4S)+ N2 (1Σg+)
reaction are studied using a reproducing kernel Hilbert space (RKHS)-based, global …

This article presents molecular-level analysis of a reactive, near-continuum, Mach 21
nitrogen flow over a blunt wedge using the direct molecular simulation (DMS) method. The …

The thermal conductivity and self-diffusion coefficients for molecular nitrogen and oxygen
are investigated with the direct molecular simulation (DMS) technique using high-fidelity, ab …

Transport collision integrals of interacting atoms or ions play a crucial role in modeling
transport properties of high-temperature gases and plasmas. Here, we obtained the …