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Resolving the puzzle of single-atom silver dispersion on nanosized γ-Al2O3 surface for high catalytic performance

Fei Wang, Jinzhu Ma, Shaohui Xin, Qiang Wang, Jun Xu, Changbin Zhang, Hong He, Xiao Cheng Zeng

2020Nature Communications228 citationsDOIOpen Access PDF

Abstract

Abstract Ag/γ-Al 2 O 3 is widely used for catalyzing various reactions, and its performance depends on the valence state, morphology and dispersion of Ag species. However, detailed anchoring mechanism of Ag species on γ-Al 2 O 3 remains largely unknown. Herein, we reveal that the terminal hydroxyls on γ-Al 2 O 3 are responsible for anchoring Ag species. The abundant terminal hydroxyls existed on nanosized γ-Al 2 O 3 can lead to single-atom silver dispersion, thereby resulting in markedly enhanced performance than the Ag cluster on microsized γ-Al 2 O 3 . Density-functional-theory calculations confirm that Ag atom is mainly anchored by the terminal hydroxyls on (100) surface, forming a staple-like local structure with each Ag atom bonded with two or three terminal hydroxyls. Our finding resolves the puzzle on why the single-atom silver dispersion can be spontaneously achieved only on nanosized γ-Al 2 O 3 , but not on microsized γ-Al 2 O 3 . The obtained insight into the Ag species dispersion will benefit future design of more efficient supported Ag catalysts.

Topics & Concepts

CatalysisAtom (system on chip)Dispersion (optics)Cluster (spacecraft)Valence (chemistry)Materials scienceDensity functional theoryChemical physicsNanotechnologyChemical engineeringChemistryComputational chemistryOpticsOrganic chemistryPhysicsEmbedded systemEngineeringProgramming languageComputer scienceCatalytic Processes in Materials ScienceNanomaterials for catalytic reactionsCopper-based nanomaterials and applications