1 citations · 1 across the 2 of their papers we have counts for
2 papers
cond-mat.mtrl-sci2025★ 1 cited
Atomic scale structure and dynamical properties of (TeO)-(NaO) glasses through first-principles modeling and XRD measurements
Firas Shuaib, Assil Bouzid, Remi Piotrowski +10
We resort to first-principles molecular dynamics, in synergy with experiments, to study structural evolution and Na cation diffusion inside (TeO)-(NaO) (x…
cond-mat.mtrl-sci2022
Atomic structure of amorphous SiN: combining Car-Parrinello and Born-Oppenheimer first-principles molecular dynamics
Achille Lambrecht, Carlo Massobrio, Mauro Boero +2
First-principles molecular dynamics is employed to describe the atomic structure of amorphous SiN, a non-stoichiometric compound belonging to the SiN family. To produce t…