Defects, Corrugation and Temperature Govern Rarefied-Air Drag on Graphene Coatings
arXiv:2602.00285 · doi:10.1063/5.0325392
Abstract
In rarefied atmospheric environments, where continuum fluid dynamics breaks down, aerodynamic drag is governed by gas-surface momentum exchange, making surface structure and chemistry key design knobs. Using molecular dynamics simulations, we show that coating the -Al2O3(0001) surface with graphene markedly reduces the tangential momentum accommodation coefficient (TMAC) of N2, shifting scattering toward more specular reflection and thereby lowering drag; we further benchmark this response against graphite. The reduction strengthens up to 900 K. While structural defects can increase TMAC via defect-induced corrugation and local atomic and electronic rearrangements, graphene retains its performance at experimentally relevant defect densities.
References in corpus (6)
- Quantum ESPRESSO: a modular and open-source software project for quantum simulations of materials
- Advanced capabilities for materials modelling with Quantum ESPRESSO
- Quantum ESPRESSO toward the exascale
- Stoichiometric reconstruction of the AlO(0001) surface
- Defects induce phase transition from dynamic to static rippling in graphene
- Determination of Thermal Accommodation Coefficients on CaSiO3 and SiO2 using Molecular Dynamics and Experiments