A review on DFT + U scheme for structural, electronic, optical and magnetic properties of copper doped ZnO wurtzite structure
Elhadj Benrezgua, Abdelhalim Zoukel, B. Deghfel, A. Boukhari, Rabie Amari, Soorathep Kheawhom, Ahmad Azmin Mohamad
Topics & Concepts
Wurtzite crystal structureDensity functional theoryMaterials scienceFerromagnetismMagnetic momentCondensed matter physicsElectronic structureDopingLattice constantElectronic band structureBand gapCopperIonComputational chemistryPhysicsZincOpticsQuantum mechanicsOptoelectronicsChemistryDiffractionMetallurgyZnO doping and propertiesCopper-based nanomaterials and applicationsAdvanced Condensed Matter Physics