Fluxionality of Au clusters at ceria surfaces during CO oxidation: Relationships among reactivity, size, cohesion, and surface defects from DFT simulations

Journal of Physical Chemistry Letters

Volumn 4, Issue 14, 2013, Pages 2256-2263

  Ghosh, Prasenjit ^a   Farnesi Camellone, Matteo ^b   Fabris, Stefano ^c,d  

^a INDIAN INSTITUTE OF SCIENCE EDUCATION AND RESEARCH   (India)

^b RUHR UNIVERSITY BOCHUM   (Germany)

^c IOM CNR LABORATORIO TASC   (Italy)

^d SISSA   (Italy)

Author keywords

Au clusters; CeO2(111); density functional theory; Mars van Krevelen pathway

Indexed keywords

AU CLUSTERS; CEO2(111); CLUSTER DISSOCIATION; LOW-ACTIVATION ENERGY; MARS-VAN KREVELEN; METAL OXIDE INTERFACE; MOLECULAR ADSORPTION; STRUCTURAL STABILITIES;

ACTIVATION ENERGY; ADHESION; CARBON DIOXIDE; CATALYTIC OXIDATION; DENSITY FUNCTIONAL THEORY; MORPHOLOGY; STABILITY;

GOLD;

EID: 84880557714     PISSN: None     EISSN: 19487185     Source Type: Journal    
DOI: 10.1021/jz4009079     Document Type: Article

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