Multiscale computational modeling techniques in study and design of 2D materials: recent advances, challenges, and opportunities
This article provides an overview of recent advances, challenges, and opportunities in
multiscale computational modeling techniques for study and design of two-dimensional (2D) …
multiscale computational modeling techniques for study and design of two-dimensional (2D) …
Heat transport across graphene/hexagonal-BN tilted grain boundaries from phase-field crystal model and molecular dynamics simulations
We study the interfacial thermal conductance of grain boundaries (GBs) between monolayer
graphene and hexagonal boron nitride (h-BN) sheets using a combined atomistic approach …
graphene and hexagonal boron nitride (h-BN) sheets using a combined atomistic approach …