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Effect of oxygen vacancy concentration on the photocatalytic hydrogen evolution performance of anatase TiO2: DFT and experimental studies

Shufang Jia, Jiaqi Gao, Qianqian Shen, Jinbo Xue, Zhuxia Zhang, Xuguang Liu, Husheng Jia

2021Journal of Materials Science Materials in Electronics20 citationsDOI

Topics & Concepts

AnataseDensity functional theoryMaterials scienceVacancy defectHybrid functionalWater splittingElectronic structureMulliken population analysisWork functionChemical physicsPhotocatalysisAcceptorComputational chemistryChemistryNanotechnologyCondensed matter physicsCrystallographyCatalysisPhysicsLayer (electronics)BiochemistryAdvanced Photocatalysis TechniquesTiO2 Photocatalysis and Solar CellsCatalytic Processes in Materials Science
Effect of oxygen vacancy concentration on the photocatalytic hydrogen evolution performance of anatase TiO2: DFT and experimental studies | Litcius