Bayesian active machine learning for Cluster expansion construction
Hantong Chen, Sayan Samanta, Siya Zhu, Hagen Eckert, Jan Schroers, Stefano Curtarolo, Axel van de Walle
Topics & Concepts
Cluster expansionCluster (spacecraft)Computer scienceRange (aeronautics)Bayesian probabilityBayesian optimizationPhase diagramAlgorithmBayesian inferenceDiagramComputational scienceMathematical optimizationPhase (matter)Statistical physicsMachine learningArtificial intelligencePhysicsMathematicsThermodynamicsEngineeringAerospace engineeringDatabaseProgramming languageQuantum mechanicsMachine Learning in Materials ScienceAdvanced Materials Characterization TechniquesHydrogen embrittlement and corrosion behaviors in metals