Environmental Science & Technology · 2025 · 20 citations · 46 references
Natural SciencesChemical EngineeringMaterials ScienceCatalysisInorganic ChemistryInterface ScienceCatalyst CharacterizationCatalytic MaterialsDensity Functional TheoryMetal Oxide NanomaterialsMetal OxidesSupported CatalystsCatalyst Active SitesDensity Functional Theory In CatalysisInterface StructureLocal Electronic StructureMetal Oxide CatalystsOxygen VacanciesOxygen Vacancies In Metal OxidesSoot Particles
The purification efficiency of autoexhaust carbon strongly depends on the heterogeneous interface structure between active metal and oxide, which can modulate the local electronic structure of defect sites to promote the activation of reactant molecules. Herein, the high-dispersion CuO clusters supported on the well-defined CeO 2 nanorods were prepared using the complex deposition slow method. The formation of heteroatomic Cu + -O v -Ce 3+ interfacial structural units as active sites can capture electrons to achieve activation of the NO and O 2 molecules. Among all of the synthesized catalysts, the Cu 10 /CeO 2 catalyst exhibits superior catalytic performance ( T 50 = 351 ° C) along with remarkable tolerance to H 2 O and SO 2 in the removal of soot particles. Through a combination of comprehensive characterizations and density functional theory calculations, it is proposed that the interfacial Cu + -O v -Ce 3+ site, acting as an electron enrichment center, can capture electrons from the Cu d-band and Ce d/f-band to obtain high delocalized electron density, and then enhance the oxidation of NO to NO 2, which plays a crucial role in the NO x -assisted catalytic mechanism for soot oxidation. This study presents a novel strategy for developing highly efficient catalysts that exhibit resistance to H 2 O and SO 2, aimed at enhancing the removal of soot particles.
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Structure of the catalytically active copper–ceria interfacial perimeter
Aling Chen, Xiaojuan Yu, Yan Zhou et al. · Nature Catalysis · 2019 · 642 citations
Ji Yang, Wengang Liu, Mingquan Xu et al. · Journal of the American Chemical Society · 2021 · 480 citations