Large-Scale Structure Prediction of Near-Stoichiometric Magnesium Oxide Based on a Machine-Learned Interatomic Potential

Published in Phys. Rev. Mater. 5, 083806, 2021

Recommended citation: H. Tahmasbi, S. Goedecker and S. A. Ghasemi. "Large-Scale Structure Prediction of Near-Stoichiometric Magnesium Oxide Based on a Machine-Learned Interatomic Potential: Crystalline Phases and Oxygen-Vacancy Ordering." Phys. Rev. Mater. 5, 083806 (2021).