Accurate prediction of semiconductor bandgaps based on machine learning and prediction of bandgaps for two-dimensional heterojunctions
Hang Liu, Liang Xu, Zongle Ma, Zhengquan Li, Haotian Li, Ying Zhang, Bo Zhang, Lingling Wang
Topics & Concepts
Band gapMaterials scienceSemiconductorWide-bandgap semiconductorHybrid functionalHeterojunctionWork (physics)OptoelectronicsMachine learningDensity functional theoryComputer scienceComputational chemistryThermodynamicsPhysicsChemistryMachine Learning in Materials ScienceX-ray Diffraction in CrystallographyElectronic and Structural Properties of Oxides