Articles producció científicaQuímica Física i Inorgànica

Ammonia dissociation on Pt{100}, Pt{111}, and Pt{211}: A comparative density functional theory study

  • Identification data

    Identifier:  imarina:3398998
    Authors:  Offermans, WK; Jansen, APJ; van Santen, RA; Novell-Leruth, G; Ricart, JM; Pérez-Ramírez, J
  • Others:

    APA: Offermans, WK; Jansen, APJ; van Santen, RA; Novell-Leruth, G; Ricart, JM; Pérez-Ramírez, J (2007). Ammonia dissociation on Pt{100}, Pt{111}, and Pt{211}: A comparative density functional theory study. Journal Of Physical Chemistry c, 111(47), 17551-17557. DOI: 10.1021/jp073083f
    Paper original source: Journal Of Physical Chemistry c. 111 (47): 17551-17557
    Article's DOI: 10.1021/jp073083f
    Journal publication year: 2007-11-29
    Entity: Universitat Rovira i Virgili
    Record's date: 2026-05-09
    URV's Author/s: Ricart Pla, Jose Manuel
    Department: Química Física i Inorgànica
    Licence document URL: https://repositori.urv.cat/ca/proteccio-de-dades/
    Publication Type: Journal Publications
    ISSN: 19327447
    Author, as appears in the article.: Offermans, WK; Jansen, APJ; van Santen, RA; Novell-Leruth, G; Ricart, JM; Pérez-Ramírez, J
    Thematic Areas: Surfaces, coatings and films, Physical and theoretical chemistry, Nanoscience and nanotechnology, Nanoscience & nanotechnology, Materials science, multidisciplinary, General energy, Energy (miscellaneous), Energy (all), Electronic, optical and magnetic materials, Chemistry, physical, Biotecnología
    Author's mail: josep.ricart@urv.cat, josep.ricart@urv.cat
  • Keywords:

    Ultrasoft pseudopotentials
    Transition
    Surfaces
    Saddle-points
    Platinum
    Nitric-oxide decomposition
    Nh3 decomposition
    Minimum energy paths
    Initio molecular-dynamics
    Activation
    Chemistry
    Physical
    Electronic
    Optical and Magnetic Materials
    Energy (Miscellaneous)
    Materials Science
    Multidisciplinary
    Nanoscience & Nanotechnology
    Nanoscience and Nanotechnology
    Physical and Theoretical Chemistry
    Coatings and Films
    General energy
    Energy (all)
    Biotecnología
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