Electronic structure and defect state calculations for undoped and (Nb, Ta)-doped anatase using density functional theory

Panda, EmilaRaghav, AbhishekAbhishekRaghav2025-09-042025-09-042019-01-01http://repository.iitgn.ac.in/handle/IITG2025/32411ill.; 30 cm.17210004Material science and EngineeringElectronic StructureDensity Functional TheoryNative DefectsEffective MassFormation Energy | DopantsElectronic structure and defect state calculations for undoped and (Nb, Ta)-doped anatase using density functional theoryM.Techx, 46p.123456789/580