Atomic scale insights into ethanol oxidation on Pt, Pd and Au metallic nanofilms: A DFT with van der Waals interactions

Applied Surface Science

Volumn 288, Issue , 2014, Pages 564-571

  Pereira, Aline O ^a   Miranda, Caetano R ^a  

^a UNIVERSIDADE FEDERAL DO ABC   (Brazil)

Author keywords

Chemisorption; Density functional calculations; Ethanol oxidation; Metallic nanofilms; van der Waals

Indexed keywords

ADSORPTION; CHEMISORPTION; DENSITY FUNCTIONAL THEORY; GEOMETRY; METALS; OXIDATION; REACTION INTERMEDIATES; VAN DER WAALS FORCES;

ADSORPTION GEOMETRIES; ADSORPTION OF ETHANOL; EQUILIBRIUM GEOMETRIES; ETHANOL DECOMPOSITION; ETHANOL OXIDATION; METALLIC NANOFILMS; VAN DER WAALS; VAN DER WAALS INTERACTIONS;

ETHANOL;

EID: 84888439613     PISSN: 01694332     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.apsusc.2013.10.074     Document Type: Article

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