Exploring the necessary complexity of interatomic potentials
Joshua A. Vita, Dallas R. Trinkle
Topics & Concepts
InterpretabilityInteratomic potentialLeverage (statistics)Computer scienceMetadynamicsMachine learningComputational complexity theorySpline (mechanical)Artificial intelligenceAlgorithmStatistical physicsMolecular dynamicsComputational chemistryChemistryPhysicsThermodynamicsMachine Learning in Materials ScienceHydrogen embrittlement and corrosion behaviors in metalsX-ray Diffraction in Crystallography