Elaboration of a neural-network interatomic potential for silica glass and melt

Salomé Trillot , Julien Lam (1, 2) , Simona Ispas (3) , Akshay Krishna Ammothum Kandy (1) , Mark Tuckerman (4) , Nathalie Tarrat (5) , Magali Benoit (5)

1 CEMES - Centre d'élaboration de matériaux et d'études structurales
2 UMET - Unité Matériaux et Transformations - UMR 8207
3 L2C - Laboratoire Charles Coulomb
4 Department of Chemistry, New York University
5 CEMES-SINanO - Surfaces, Interfaces et Nano-Objets

Domaines: Physique [physics]; Chimie

Salomé Trillot, Julien Lam, Simona Ispas, Akshay Krishna Ammothum Kandy, Mark Tuckerman, et al.. Elaboration of a neural-network interatomic potential for silica glass and melt. Computational Materials Science, 2024, 236, pp.112848. ⟨10.1016/j.commatsci.2024.112848⟩. ⟨hal-04489381⟩