Machine-Learning Accelerated First-Principles Accurate Modeling of the Solid–Liquid Phase Transition in MgO under Mantle Conditions
Wisesa, P., Andolina, C.M., and Saidi, W.A., (2023). Machine-Learning Accelerated First-Principles Accurate Modeling of the Solid–Liquid Phase Transition in MgO under Mantle Conditions, The Journal of Physical Chemistry Letters, 14 (39), 8741-8748. DOI: 10.1021/acs.jpclett.3c02424