134 citations · 1.1k across the 14 of their papers we have counts for
Showing 2023Show all
2 papers · 1 filter
cond-mat.mtrl-sci2023★ 21 cited
Electron-phonon coupling from GW perturbation theory: Practical workflow combining BerkeleyGW, ABINIT, and EPW
Zhenglu Li, Gabriel Antonius, Yang-Hao Chan +1
We present a workflow of practical calculations of electron-phonon (e-ph) coupling with many-electron correlation effects included using the GW perturbation theory (GWPT). This wor…
cond-mat.mtrl-sci2023
Electronic transport in titanium carbide MXenes from first principles
Nesrine Boussadoune, Olivier Nadeau, Gabriel Antonius
We compute from first principles the electronic, vibrational, and transport properties of four known MXenes compound : Ti3C2, Ti3C2F2, Ti3C2(OH)2, and Ti2CF2. We study the effect o…