Machine-learning interatomic potentials for materials science
Y. Mishin
Topics & Concepts
TransferabilityInteratomic potentialField (mathematics)Class (philosophy)Statistical physicsComputer scienceMaterials sciencePhysicsArtificial intelligenceMachine learningMolecular dynamicsQuantum mechanicsMathematicsPure mathematicsLogitMachine Learning in Materials ScienceX-ray Diffraction in CrystallographyComputational Drug Discovery Methods