Articles producció científica> Química 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 WJansen AVan Santen RNovell-Leruth GRicart JPérez-Ramírez J
  • Others:

    Author, as appears in the article.: Offermans W; Jansen A; Van Santen R; Novell-Leruth G; Ricart J; Pérez-Ramírez J
    Department: Química Física i Inorgànica
    URV's Author/s: Ricart Pla, Jose Manuel
    Keywords: Ultrasoft pseudopotentials Transition Surfaces Saddle-points Platinum Nitric-oxide decomposition Nh3 decomposition Minimum energy paths Initio molecular-dynamics Activation
    Thematic Areas: Surfaces, coatings and films Química Physical and theoretical chemistry Nanoscience and nanotechnology Nanoscience & nanotechnology Medicina ii Medicina i Materials science, multidisciplinary Materiais Interdisciplinar General energy Farmacia Ensino Engenharias iv Engenharias iii Engenharias ii Engenharias i Energy (miscellaneous) Energy (all) Electronic, optical and magnetic materials Ciências biológicas iii Ciências biológicas ii Ciências biológicas i Ciências ambientais Ciências agrárias i Chemistry, physical Biotecnología Biodiversidade Astronomia / física
    ISSN: 19327447
    Author's mail: josep.ricart@urv.cat
    Author identifier: 0000-0002-2610-5535
    Record's date: 2023-02-22
    Papper original source: Journal Of Physical Chemistry c. 111 (47): 17551-17557
    APA: Offermans W; Jansen A; Van Santen R; Novell-Leruth G; Ricart J; 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
    Licence document URL: https://repositori.urv.cat/ca/proteccio-de-dades/
    Article's DOI: 10.1021/jp073083f
    Entity: Universitat Rovira i Virgili
    Journal publication year: 2007
    Publication Type: Journal Publications
  • Keywords:

    Chemistry, Physical,Electronic, Optical and Magnetic Materials,Energy (Miscellaneous),Materials Science, Multidisciplinary,Nanoscience & Nanotechnology,Nanoscience and Nanotechnology,Physical and Theoretical Chemistry,Surfaces, Coatings and Films
    Ultrasoft pseudopotentials
    Transition
    Surfaces
    Saddle-points
    Platinum
    Nitric-oxide decomposition
    Nh3 decomposition
    Minimum energy paths
    Initio molecular-dynamics
    Activation
    Surfaces, coatings and films
    Química
    Physical and theoretical chemistry
    Nanoscience and nanotechnology
    Nanoscience & nanotechnology
    Medicina ii
    Medicina i
    Materials science, multidisciplinary
    Materiais
    Interdisciplinar
    General energy
    Farmacia
    Ensino
    Engenharias iv
    Engenharias iii
    Engenharias ii
    Engenharias i
    Energy (miscellaneous)
    Energy (all)
    Electronic, optical and magnetic materials
    Ciências biológicas iii
    Ciências biológicas ii
    Ciências biológicas i
    Ciências ambientais
    Ciências agrárias i
    Chemistry, physical
    Biotecnología
    Biodiversidade
    Astronomia / física
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