Catalytic properties of Au electrodes modified by an underlayer of Pd
| Autor: | Germán Soldano, Elizabeth Santos, Hazar Guesmi, M.F. Juarez, Frederik Tielens |
|---|---|
| Přispěvatelé: | Institut Charles Gerhardt Montpellier - Institut de Chimie Moléculaire et des Matériaux de Montpellier (ICGM), Ecole Nationale Supérieure de Chimie de Montpellier (ENSCM)-Institut de Chimie du CNRS (INC)-Université de Montpellier (UM)-Centre National de la Recherche Scientifique (CNRS), Laboratoire de Chimie de la Matière Condensée de Paris (LCMCP), Université Pierre et Marie Curie - Paris 6 (UPMC)-Collège de France (CdF (institution))-Institut de Chimie du CNRS (INC)-Centre National de la Recherche Scientifique (CNRS), Instituto de Fisica Enrique Gaviola (IFEG), Universidad Nacional de Córdoba [Argentina], Institut für Theoretische Chemie, Universität Ulm - Ulm University [Ulm, Allemagne], Institut Charles Gerhardt Montpellier - Institut de Chimie Moléculaire et des Matériaux de Montpellier (ICGM ICMMM), Ecole Nationale Supérieure de Chimie de Montpellier (ENSCM)-Centre National de la Recherche Scientifique (CNRS)-Université de Montpellier (UM)-Université Montpellier 1 (UM1)-Université Montpellier 2 - Sciences et Techniques (UM2)-Institut de Chimie du CNRS (INC), Université Pierre et Marie Curie - Paris 6 (UPMC)-Centre National de la Recherche Scientifique (CNRS)-Collège de France (CdF (institution))-Institut de Chimie du CNRS (INC) |
| Jazyk: | angličtina |
| Rok vydání: | 2015 |
| Předmět: |
Hydrogen
Inorganic chemistry ELECTRONIC STRUCTURE chemistry.chemical_element Electrocatalyst 7. Clean energy Catalysis Monolayer Materials Chemistry Reactivity (chemistry) [CHIM.COOR]Chemical Sciences/Coordination chemistry Surface layer DENSITY FUNCTIONAL THEORY Bimetallic strip GOLD-PALLADIUM ALLOYS Otras Ciencias Químicas Ciencias Químicas Surfaces and Interfaces Condensed Matter Physics Surfaces Coatings and Films HYDROGEN ADSORPTION-ABSORPTION-STORAGE chemistry Chemical engineering ELECTROCATALYSIS Density functional theory CIENCIAS NATURALES Y EXACTAS |
| Zdroj: | Surface Science : A Journal Devoted to the Physics and Chemistry of Interfaces Surface Science : A Journal Devoted to the Physics and Chemistry of Interfaces, 2015, Surface Science and Electrochemistry-20 years later, 631, pp.235-247. ⟨10.1016/j.susc.2014.06.015⟩ Surface Science Surface Science, Elsevier, 2015, Surface Science and Electrochemistry-20 years later, 631, pp.235-247. ⟨10.1016/j.susc.2014.06.015⟩ |
| ISSN: | 0039-6028 1879-2758 |
| DOI: | 10.1016/j.susc.2014.06.015⟩ |
| Popis: | Bimetallic catalysts have manifold technological applications; their reactivity can greatly exceed that of the original single metals. In this work, we investigate an ideal model-system consisting of a complete monolayer of Pd underneath the surface of Au(111). First, we investigate the stability of this system, and then its interaction with hydrogen. We analyze in detail the energetics and the electronic interactions for the Volmer step of the hydrogen evolution reaction (HER), and the further absorption below the surface layer of gold. We combine Density Functional Theory based on computational techniques with the theory of electrocatalysis. Fil: Juarez, Maria Fernanda. Universitat Ulm; Alemania. Consejo Nacional de Investigaciones Científicas y Técnicas; Argentina Fil: Soldano, Germán. Universitat Ulm; Alemania. Consejo Nacional de Investigaciones Científicas y Técnicas; Argentina Fil: Guesmi, Hazar. Institut Charles Gerhardt Montpellier; Francia Fil: Tielens, Frederik. Universite Pierre et Marie Curie; Francia Fil: Santos, Elizabeth del Carmen. Universitat Ulm; Alemania. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Córdoba. Instituto de Física Enrique Gaviola. Universidad Nacional de Córdoba. Instituto de Física Enrique Gaviola; Argentina |
| Databáze: | OpenAIRE |
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