A comprehensive first-principles computational study on the physical properties of lutetium aluminum perovskite LuAlO3
Samah Al‐Qaisi, R. Ahmed, Bakhtiar Ul Haq, P. Raics, Sofia Tahir
Topics & Concepts
Band gapMaterials scienceDensity functional theoryElectronic structureElectronic band structurePerovskite (structure)Direct and indirect band gapsLutetiumCondensed matter physicsDensity of statesComputational chemistryChemistryOptoelectronicsCrystallographyOxidePhysicsMetallurgyYttriumPerovskite Materials and ApplicationsThermal Expansion and Ionic ConductivityMicrowave Dielectric Ceramics Synthesis