Density functional theoretical study of Cun, Aln (n = 4-31) and copper doped aluminum clusters: Electronic properties and reactivity with atomic oxygen

Surface Science

Volumn 601, Issue 6, 2007, Pages 1544-1553

  Lacaze Dufaure, Corinne ^a   Blanc, Christine ^a   Mankowski, Georges ^a   Mijoule, Claude ^a  

^a INSTITUT CARNOT CIRIMAT   (France)

Author keywords

Aluminum; Bimetallic; Cluster; Copper; Density functional theory; Oxygen; Surface reactivity

Indexed keywords

CHEMICAL BONDS; COMPUTATION THEORY; COPPER; DENSITY FUNCTIONAL THEORY; DOPING (ADDITIVES); OXYGEN;

ALUMINUM CLUSTERS; SURFACE REACTIVITY; WORK FUNCTIONS;

ALUMINUM;

EID: 33847729886     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.susc.2007.01.015     Document Type: Article

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