Mechanical, optoelectronic and thermoelectric properties of the transition metal oxide perovskites YScO3 and LaScO3: First principle calculation
A. Haoui, Mokhtar Elchikh, S. Hiadsi
Topics & Concepts
Density functional theoryMaterials scienceBand gapOrthorhombic crystal systemCondensed matter physicsDirect and indirect band gapsLattice constantThermoelectric effectElectronic band structurePhononOxideDielectricOptoelectronicsCrystal structureDiffractionComputational chemistryChemistryThermodynamicsOpticsPhysicsCrystallographyMetallurgyHeusler alloys: electronic and magnetic propertiesZnO doping and propertiesChalcogenide Semiconductor Thin Films