Articles producció científica> Química Física i Inorgànica

Theoretical simulation of temperature programmed desorption of molecular oxygen on isolated au nanoparticles from density functional calculations and microkinetics model

  • Datos identificativos

    Identificador: imarina:3399022
    Autores:
    Roldán ANovell GRicart JIllas F
  • Otros:

    Autor según el artículo: Roldán A; Novell G; Ricart J; Illas F
    Departamento: Química Física i Inorgànica
    Autor/es de la URV: Ricart Pla, Jose Manuel
    Palabras clave: Wave basis-set Total-energy calculations Thermal-stability Support Selective oxidation Saddle-points Gold nanoparticles Elastic band method Chemoselective hydrogenation Active-sites
    Áreas temáticas: 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
    Direcció de correo del autor: josep.ricart@urv.cat
    Identificador del autor: 0000-0002-2610-5535
    Fecha de alta del registro: 2023-02-22
    Referencia al articulo segun fuente origial: Journal Of Physical Chemistry c. 114 (11): 5101-5106
    Referencia de l'ítem segons les normes APA: Roldán A; Novell G; Ricart J; Illas F (2010). Theoretical simulation of temperature programmed desorption of molecular oxygen on isolated au nanoparticles from density functional calculations and microkinetics model. Journal Of Physical Chemistry c, 114(11), 5101-5106. DOI: 10.1021/jp911283j
    URL Documento de licencia: https://repositori.urv.cat/ca/proteccio-de-dades/
    DOI del artículo: 10.1021/jp911283j
    Entidad: Universitat Rovira i Virgili
    Año de publicación de la revista: 2010
    Tipo de publicación: Journal Publications
  • Palabras clave:

    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
    Wave basis-set
    Total-energy calculations
    Thermal-stability
    Support
    Selective oxidation
    Saddle-points
    Gold nanoparticles
    Elastic band method
    Chemoselective hydrogenation
    Active-sites
    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
  • Documentos:

  • Cerca a google

    Search to google scholar