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Creating single-atom Pt-ceria catalysts by surface step decoration

Nature communications, 2016-02, Vol.7 (1), p.10801-10801, Article 10801

2016

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Computational Approaches to the Chemical Conversion of Carbon Dioxide

ChemSusChem, 2013-06, Vol.6 (6), p.944-965

2013

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Role of Cluster Morphology in the Dynamics and Reactivity of Subnanometer Pt Clusters Supported on Ceria Surfaces

Journal of physical chemistry. C, 2014-09, Vol.118 (36), p.21014-21020

2014

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Effects of Thermal Fluctuations on the Hydroxylation and Reduction of Ceria Surfaces by Molecular H2

Journal of physical chemistry. C, 2015-09, Vol.119 (37), p.21567-21573

2015

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The unexpected effect of vacancies and wrinkling on the electronic properties of MoS2 layers

Physical chemistry chemical physics : PCCP, 2019, Vol.21 (44), p.24731-24739

2019

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Bimetallic Ag‐Pt Sub‐nanometer Supported Clusters as Highly Efficient and Robust Oxidation Catalysts

Angewandte Chemie (International ed.), 2018-01, Vol.57 (5), p.1209-1213

International ed. in English, 2018

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Alumina-supported sub-nanometer Pt10 clusters: amorphization and role of the support material in a highly active CO oxidation catalyst

Journal of materials chemistry. A, Materials for energy and sustainability, 2017, Vol.5 (10), p.4923-4931

2017

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Metal Tungstates at the Ultimate Two-Dimensional Limit: Fabrication of a CuWO4 Nanophase

ACS nano, 2014-04, Vol.8 (4), p.3947-3954

2014

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Interface Effects on the Magnetism of CoPt-Supported Nanostructures

Nano letters, 2011-12, Vol.11 (12), p.5542-5547

2011

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Interaction of Na with 2D WO3 and MoO3 Layers on Pd(100): From Doping to 2D Bronze Formation

Journal of physical chemistry. C, 2022-02, Vol.126 (6), p.3289-3300

2022

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Reactivity of atomically dispersed Pt(2+) species towards H2: model Pt-CeO2 fuel cell catalyst

Physical chemistry chemical physics : PCCP, 2016-03, Vol.18 (11), p.7672-7679

2016

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Effect of Charges on the Interaction of a Water Molecule with the Fe2O3(0001) Surface

Journal of physical chemistry. C, 2016-06, Vol.120 (22), p.11918-11925

2016

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Interaction of Water with the Gypsum (010) Surface: Structure and Dynamics from Nonlinear Vibrational Spectroscopy and Ab Initio Molecular Dynamics

Journal of the American Chemical Society, 2018-12, Vol.140 (49), p.17141-17152

2018

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The atomistic origin of the extraordinary oxygen reduction activity of Pt3Ni7 fuel cell catalysts

Chemical science (Cambridge), 2015-07, Vol.6 (7), p.3915-3925

2015

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Ligand/cluster/support catalytic complexes in heterogeneous ultrananocatalysis: NO oxidation on Ag3/MgO(100)

Physical chemistry chemical physics : PCCP, 2014-12, Vol.16 (48), p.2657-26577

2014

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A first-principles theoretical approach to heterogeneous nanocatalysis

Nanoscale, 2012-02, Vol.4 (4), p.128-1219

2012

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Structures of gas-phase Ag-Pd nanoclusters: A computational study

The Journal of chemical physics, 2010-06, Vol.132 (23), p.234703-234703-8

2010

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Concepts in theoretical heterogeneous ultrananocatalysis

Comptes rendus. Chimie, 2014-07, Vol.17 (7-8), p.625-633

2014

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Modelling the metal-on-top effect for Pd clusters on the MgO{100} substrate

The Journal of chemical physics, 2013-06, Vol.138 (22), p.224703-224703

2013

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Ordered arrays of size-selected oxide nanoparticles

Physical review letters, 2012-05, Vol.108 (19), p.195507-195507, Article 195507

2012

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Structures of AgPd nanoclusters adsorbed on MgO(100): A computational study

Surface science, 2011-03, Vol.605 (5), p.483-488

2011

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Communication: Striking dependence of diffusion kinetics in Ag-Cu nanoalloys upon composition and quantum effects

The Journal of chemical physics, 2014-07, Vol.141 (4), p.041108-041108

2014

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Redox processes at a nanostructured interface under strong electric fields

Nanoscale, 2014-09, Vol.6 (18), p.10589-10595

2014

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Atomistic Quantum Plasmonics of Gold Nanowire Arrays

ACS photonics, 2014-04, Vol.1 (4), p.315-322

2014

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The atomistic origin of the extraordinary oxygen reduction activity of Pt 3 Ni 7 fuel cell catalysts

Chemical science (Cambridge), 2015-07, Vol.6 (7), p.3915-3925

2015

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Creating single-atom Pt-ceria catalysts by surface step decoration

Computational Approaches to the Chemical Conversion of Carbon Dioxide

Role of Cluster Morphology in the Dynamics and Reactivity of Subnanometer Pt Clusters Supported on Ceria Surfaces

Effects of Thermal Fluctuations on the Hydroxylation and Reduction of Ceria Surfaces by Molecular H2

The unexpected effect of vacancies and wrinkling on the electronic properties of MoS2 layers

Bimetallic Ag‐Pt Sub‐nanometer Supported Clusters as Highly Efficient and Robust Oxidation Catalysts

Alumina-supported sub-nanometer Pt10 clusters: amorphization and role of the support material in a highly active CO oxidation catalyst

Metal Tungstates at the Ultimate Two-Dimensional Limit: Fabrication of a CuWO4 Nanophase

Interface Effects on the Magnetism of CoPt-Supported Nanostructures

Interaction of Na with 2D WO3 and MoO3 Layers on Pd(100): From Doping to 2D Bronze Formation

Reactivity of atomically dispersed Pt(2+) species towards H2: model Pt-CeO2 fuel cell catalyst

Effect of Charges on the Interaction of a Water Molecule with the Fe2O3(0001) Surface

Interaction of Water with the Gypsum (010) Surface: Structure and Dynamics from Nonlinear Vibrational Spectroscopy and Ab Initio Molecular Dynamics

The atomistic origin of the extraordinary oxygen reduction activity of Pt3Ni7 fuel cell catalysts

Ligand/cluster/support catalytic complexes in heterogeneous ultrananocatalysis: NO oxidation on Ag3/MgO(100)

A first-principles theoretical approach to heterogeneous nanocatalysis

Structures of gas-phase Ag-Pd nanoclusters: A computational study

Concepts in theoretical heterogeneous ultrananocatalysis

Modelling the metal-on-top effect for Pd clusters on the MgO{100} substrate

Ordered arrays of size-selected oxide nanoparticles

Structures of AgPd nanoclusters adsorbed on MgO(100): A computational study

Communication: Striking dependence of diffusion kinetics in Ag-Cu nanoalloys upon composition and quantum effects

Redox processes at a nanostructured interface under strong electric fields

Atomistic Quantum Plasmonics of Gold Nanowire Arrays

The atomistic origin of the extraordinary oxygen reduction activity of Pt 3 Ni 7 fuel cell catalysts

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