A general scheme for the estimation of oxygen binding energies on binary transition metal surface alloys

Surface Science

Volumn 592, Issue 1-3, 2005, Pages 104-111

  Greeley, Jeff ^a   Nørskov, Jens K ^a  

^a TECHNICAL UNIVERSITY OF DENMARK   (Denmark)

Author keywords

Binding energy; d Band center; Density functional theory; Oxygen; Surface alloy; Transition metal

Indexed keywords

BINDING ENERGY; COMPOSITION; MATHEMATICAL MODELS; PARAMETER ESTIMATION; PROBABILITY DENSITY FUNCTION; STRAIN; TRANSITION METALS;

D-BAND CENTER; DENSITY FUNCTIONAL THEORY; LIGANDS; SURFACE ALLOY;

OXYGEN;

EID: 25444522598     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.susc.2005.07.018     Document Type: Article

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