Prediction of the melting curve and phase diagram for CaO using newly developed interatomic potentials
Xin-Wei Wang, Xiaowei Sun, Ting Song, Jun-Hong Tian, Zi‐Jiang Liu
Topics & Concepts
Phase diagramThermodynamicsMelting curve analysisThermal expansionPhase boundaryInteratomic potentialMolecular dynamicsPhase transitionMaterials sciencePhase (matter)ChemistryPhysicsComputational chemistryOrganic chemistryBiochemistryGenePolymerase chain reactionHigh-pressure geophysics and materialsX-ray Diffraction in CrystallographyMetallurgical Processes and Thermodynamics