Search Results - Ruiz Puigdollers, Antonio

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  1. 1
    Increasing Oxide Reducibility: The Role of Metal/Oxide Interfaces in the Formation of Oxygen Vacancies

    Increasing Oxide Reducibility: The Role of Metal/Oxide Interfaces in the Formation of Oxygen Vacancies by Ruiz Puigdollers, Antonio, Schlexer, Philomena, Tosoni, Sergio, Pacchioni, Gianfranco

    Published in ACS catalysis
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  2. 2
    Role of Metal/Oxide Interfaces in Enhancing the Local Oxide Reducibility

    Role of Metal/Oxide Interfaces in Enhancing the Local Oxide Reducibility by Schlexer, Philomena, Ruiz Puigdollers, Antonio, Pacchioni, Gianfranco

    Published in Topics in catalysis
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  3. 3
    First-principles study of structural, elastic and electronic properties of α-, β- and γ-graphyne

    First-principles study of structural, elastic and electronic properties of α-, β- and γ-graphyne by Puigdollers, Antonio Ruiz, Alonso, Gerard, Gamallo, Pablo

    Published in Carbon (New York)
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  4. 4
    TiO₂ and ZrO₂ in biomass conversion: why catalyst reduction helps

    TiO₂ and ZrO₂ in biomass conversion: why catalyst reduction helps by Tosoni, Sergio, Chen, Hsin-Yi Tiffany, Puigdollers, Antonio Ruiz, Pacchioni, Gianfranco

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  5. 5
    Theory of Ferromagnetism in Reduced ZrO2–x Nanoparticles

    Theory of Ferromagnetism in Reduced ZrO2–x Nanoparticles by Albanese, Elisa, Ruiz Puigdollers, Antonio, Pacchioni, Gianfranco

    Published in ACS omega
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  6. 6
    Structure and Properties of Zirconia Nanoparticles from Density Functional Theory Calculations

    Structure and Properties of Zirconia Nanoparticles from Density Functional Theory Calculations by Puigdollers, Antonio Ruiz, Illas, Francesc, Pacchioni, Gianfranco

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  7. 7
    CO Oxidation on Au Nanoparticles Supported on ZrO2: Role of Metal/Oxide Interface and Oxide Reducibility

    CO Oxidation on Au Nanoparticles Supported on ZrO2: Role of Metal/Oxide Interface and Oxide Reducibility by Puigdollers, Antonio Ruiz, Pacchioni, Gianfranco

    Published in ChemCatChem
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  8. 8
    Tuning the charge state of Ag and Au atoms and clusters deposited on oxide surfaces by doping: a DFT study of the adsorption properties of nitrogen- and niobium-doped TiO2 and ZrO2

    Tuning the charge state of Ag and Au atoms and clusters deposited on oxide surfaces by doping: a DFT study of the adsorption properties of nitrogen- and niobium-doped TiO2 and ZrO2 by Schlexer, Philomena, Ruiz Puigdollers, Antonio, Pacchioni, Gianfranco

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  9. 9
    Reduction of Hydrogenated ZrO2 Nanoparticles by Water Desorption

    Reduction of Hydrogenated ZrO2 Nanoparticles by Water Desorption by Ruiz Puigdollers, Antonio, Illas, Francesc, Pacchioni, Gianfranco

    Published in ACS omega
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  10. 10
    DFT study of the role of N- and B-doping on structural, elastic and electronic properties of α-, β- and γ-graphyne

    DFT study of the role of N- and B-doping on structural, elastic and electronic properties of α-, β- and γ-graphyne by Ruiz-Puigdollers, Antonio, Gamallo, Pablo

    Published in Carbon (New York)
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  11. 11
    Reducibility of ZrO2/Pt3Zr and ZrO2/Pt 2D films compared to bulk zirconia: a DFT+U study of oxygen removal and H2 adsorption

    Reducibility of ZrO2/Pt3Zr and ZrO2/Pt 2D films compared to bulk zirconia: a DFT+U study of oxygen removal and H2 adsorption by Ruiz Puigdollers, Antonio, Pacchioni, Gianfranco

    Published in Nanoscale
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  12. 12
    Functionalization of γ-graphyne by transition metal adatoms

    Functionalization of γ-graphyne by transition metal adatoms by Kim, Sunkyung, Ruiz Puigdollers, Antonio, Gamallo, Pablo, Viñes, Francesc, Lee, Jin Yong

    Published in Carbon (New York)
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  13. 13
    Turning a Nonreducible into a Reducible Oxide via Nanostructuring: Opposite Behavior of Bulk ZrO2 and ZrO2 Nanoparticles Toward H2 Adsorption

    Turning a Nonreducible into a Reducible Oxide via Nanostructuring: Opposite Behavior of Bulk ZrO2 and ZrO2 Nanoparticles Toward H2 Adsorption by Ruiz Puigdollers, Antonio, Tosoni, Sergio, Pacchioni, Gianfranco

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  14. 14
    Reducibility of ZrO 2 /Pt 3 Zr and ZrO 2 /Pt 2D films compared to bulk zirconia: a DFT+U study of oxygen removal and H 2 adsorption

    Reducibility of ZrO 2 /Pt 3 Zr and ZrO 2 /Pt 2D films compared to bulk zirconia: a DFT+U study of oxygen removal and H 2 adsorption by Ruiz Puigdollers, Antonio, Pacchioni, Gianfranco

    Published in Nanoscale
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  15. 15
    Effect of Nanostructuring on the Reactivity of Zirconia: A DFT+U Study of Au Atom Adsorption

    Effect of Nanostructuring on the Reactivity of Zirconia: A DFT+U Study of Au Atom Adsorption by Ruiz Puigdollers, Antonio, Illas, Francesc, Pacchioni, Gianfranco

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  16. 16
    CO Oxidation on Au Nanoparticles Supported on ZrO 2 : Role of Metal/Oxide Interface and Oxide Reducibility

    CO Oxidation on Au Nanoparticles Supported on ZrO 2 : Role of Metal/Oxide Interface and Oxide Reducibility by Puigdollers, Antonio Ruiz, Pacchioni, Gianfranco

    Published in ChemCatChem
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  17. 17
    Turning a Nonreducible into a Reducible Oxide via Nanostructuring: Opposite Behavior of Bulk ZrO 2 and ZrO 2 Nanoparticles Toward H 2 Adsorption

    Turning a Nonreducible into a Reducible Oxide via Nanostructuring: Opposite Behavior of Bulk ZrO 2 and ZrO 2 Nanoparticles Toward H 2 Adsorption by Ruiz Puigdollers, Antonio, Tosoni, Sergio, Pacchioni, Gianfranco

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  18. 18
    Correction to “Gold and Silver Clusters on TiO 2 and ZrO 2 (101) Surfaces: Role of Dispersion Forces”

    Correction to “Gold and Silver Clusters on TiO 2 and ZrO 2 (101) Surfaces: Role of Dispersion Forces” by Ruiz Puigdollers, Antonio, Schlexer, Philomena, Pacchioni, Gianfranco

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  19. 19
    Gold and Silver Clusters on TiO 2 and ZrO 2 (101) Surfaces: Role of Dispersion Forces

    Gold and Silver Clusters on TiO 2 and ZrO 2 (101) Surfaces: Role of Dispersion Forces by Puigdollers, Antonio Ruiz, Schlexer, Philomena, Pacchioni, Gianfranco

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  20. 20
    Tuning the charge state of Ag and Au atoms and clusters deposited on oxide surfaces by doping: a DFT study of the adsorption properties of nitrogen- and niobium-doped TiO2 and ZrO2Electronic supplementary information (ESI) available. See DOI: 10.1039/c5cp03834k

    Tuning the charge state of Ag and Au atoms and clusters deposited on oxide surfaces by doping: a DFT study of the adsorption properties of nitrogen- and niobium-doped TiO2 and ZrO2... by Schlexer, Philomena, Ruiz Puigdollers, Antonio, Pacchioni, Gianfranco

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