Non-metal atom modified SnS2 sheet for CO2 photoreduction with significant activity and selectivity improvements: A first-principles study
Yu Liu, Bo-Wen Tang, Bo Wen, Xi‐Bo Li, Daifeng Zou, Yi-Feng Chai, Ying Xu, Xiaolin Wei, Wen‐Jin Yin
Topics & Concepts
SelectivityDensity functional theoryMetalVacancy defectMonolayerAtom (system on chip)Band gapChemistryAdsorptionMaterials scienceGibbs free energyCrystallographyComputational chemistryPhotochemistryCatalysisPhysical chemistryNanotechnologyPhysicsThermodynamicsOrganic chemistryOptoelectronicsComputer scienceEmbedded systemAdvanced Photocatalysis TechniquesCO2 Reduction Techniques and CatalystsCopper-based nanomaterials and applications