Investigation of the structural, electronic, magnetic, and optical properties of the double perovskite oxide semiconductor La2NiMnO6: Ab initio calculations by using GGA-PBE and GGA + mBJ approximations
M. Jerrari, R. Masrour, T. Sahdane
Topics & Concepts
ChemistryPerovskite (structure)Ab initioSemiconductorAb initio quantum chemistry methodsCondensed matter physicsOxideElectronic structureComputational chemistryChemical physicsQuantum mechanicsCrystallographyMoleculeOrganic chemistryPhysicsMagnetic and transport properties of perovskites and related materialsHeusler alloys: electronic and magnetic propertiesAdvanced Condensed Matter Physics