Insights into the Impact of Yttrium Doping at the Ba and Ti Sites of BaTiO<sub>3</sub> on the Electronic Structures and Optical Properties: A First-Principles Study
Adil Alshoaibi, Mohammed Benali Kanoun, Bakhtiar Ul Haq, S. AlFaify, Souraya Goumri‐Said
Abstract
and increasing the permittivity with large dielectric loss.
Topics & Concepts
DopingDielectricMaterials scienceCondensed matter physicsDensity functional theoryElectronic structureFerroelectricityLattice constantPermittivityYttriumSemiconductorNanotechnologyComputational chemistryOptoelectronicsChemistryOpticsPhysicsOxideMetallurgyDiffractionFerroelectric and Piezoelectric MaterialsElectronic and Structural Properties of OxidesAcoustic Wave Resonator Technologies