• Medientyp: E-Artikel
  • Titel: CO oxidation catalysed by Pd-based bimetallic nanoalloys
  • Beteiligte: Palagin, Dennis; Doye, Jonathan P. K.
  • Erschienen: Royal Society of Chemistry (RSC), 2015
  • Erschienen in: Physical Chemistry Chemical Physics, 17 (2015) 42, Seite 28010-28021
  • Sprache: Englisch
  • DOI: 10.1039/c5cp00889a
  • ISSN: 1463-9076; 1463-9084
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  • Beschreibung: Density functional theory based global geometry optimization has been used to demonstrate the crucial influence of the geometry of the catalytic cluster on the energy barriers for the CO oxidation reaction over Pd-based bimetallic nanoalloys.