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Journal article

Ligand effects in heterogeneous catalysis and electrochemistry

From

Department of Physics, Technical University of Denmark1

Center for Nanoteknologi, Centers, Technical University of Denmark2

Ligand effects in surface reactivity are discussed on the basis of extensive density functional theory calculations. The d-band model is reviewed and it is shown that it can be used to rationalize trends in reactivity in heterogeneous catalysis and electrochemistry.

Language: English
Year: 2007
Pages: 5512-5516
ISSN: 18733859 and 00134686
Types: Journal article
DOI: 10.1016/j.electacta.2007.02.041
ORCIDs: Pedersen, Thomas Bligaard and Nørskov, Jens Kehlet

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