A comprehensive DFT study of physical and photocatalytic properties of Sr1-xCdxTiO3
Hafiz Muhammad Naeem Ullah, Muhammad Rizwan, Usama Zahid, Aleeza Imran, Chuanbao Cao
Topics & Concepts
Materials scienceBand gapPhotocatalysisSemiconductorWater splittingHybrid functionalValence (chemistry)Hydrogen productionDielectricOptoelectronicsHydrogenChemical physicsNanotechnologyDensity functional theoryComputational chemistryCatalysisPhysicsQuantum mechanicsChemistryBiochemistryOrganic chemistryElectronic and Structural Properties of OxidesAdvanced Photocatalysis TechniquesZnO doping and properties