A neural network interatomic potential trained on ab initio molecular dynamics data is used to compute ambient and high-pressure melting temperatures of CaO along with the pressure dependence of its overheating ratio.
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Melting Behavior and Phase Stability of CaO from Neural Network Potentials: a Molecular Dynamics Study
A neural network interatomic potential trained on ab initio molecular dynamics data is used to compute ambient and high-pressure melting temperatures of CaO along with the pressure dependence of its overheating ratio.