Structural, electronic, magnetic and optical properties of CaO induced by oxygen incorporation effects: A first-principles study
Duy Khanh Nguyen, Võ Văn Ớn, D.M. Hoat, J.F. Rivas‐Silva, Gregorio H. Cocoletzi
Topics & Concepts
SpintronicsBand gapDensity functional theoryMagnetismParamagnetismElectronic structureCondensed matter physicsSolid oxygenMagnetic momentFerromagnetismGround stateMaterials scienceOxygenPhysicsAtomic physicsQuantum mechanicsZnO doping and propertiesMagnetic and transport properties of perovskites and related materialsHeusler alloys: electronic and magnetic properties