Accurate and Transferable Machine Learning Potential for Molecular Dynamics Simulation of Sodium Silicate Glasses.

Spoke: Spoke 6
Ambito: Ecological transition based on HPC & data technology

Autori: Marco Bertani, Thibault Charpentier, Francesco Faglioni, Alfonso Pedone.

Nome Rivista o serie: Journal of Chemical Theory and Computation
Editore: ACS
Accessibilità: Traditional publishing model

Leggi qui: doi.org/10.1021/acs.jctc.3c01115