Litcius/Paper detail

Artificial neural network potential for pure zinc

Mashroor S. Nitol, Doyl Dickel, Christopher D. Barrett

2020Computational Materials Science33 citationsDOI

Topics & Concepts

Rotation formalisms in three dimensionsInteratomic potentialDensity functional theoryComputer scienceMolecular dynamicsArtificial neural networkAtom (system on chip)Multilayer perceptronFeed forwardAlgorithmStatistical physicsChemistryArtificial intelligencePhysicsComputational chemistryMathematicsParallel computingControl engineeringGeometryEngineeringMachine Learning in Materials ScienceX-ray Diffraction in CrystallographySurface and Thin Film Phenomena