Large-scale, density functional theory-based screening of alloys for hydrogen evolution

Surface Science

Volumn 601, Issue 6, 2007, Pages 1590-1598

  Greeley, Jeff ^a   Nørskov, Jens K ^a  

^a TECHNICAL UNIVERSITY OF DENMARK   (Denmark)

Author keywords

Combinatorial; Density functional calculations; Hydrogen evolution reaction; Metallic surfaces; Screening; Surface alloys; Surface chemical reaction

Indexed keywords

COMPUTATION THEORY; DATABASE SYSTEMS; DENSITY FUNCTIONAL THEORY; HYDROGEN;

HYDROGEN EVOLUTION REACTION; METALLIC SURFACES; SURFACE ALLOYS; SURFACE CHEMICAL REACTIONS;

CATALYSIS;

EID: 33847753064     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.susc.2007.01.037     Document Type: Article

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