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Visible light photocatalytic activity in nitrogen-doped TiO2 nanobelts

Applied physics letters, 2009-03, Vol.94 (9)

2009

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Origin of Photocatalytic Activity of Nitrogen-Doped TiO2 Nanobelts

Journal of the American Chemical Society, 2009-09, Vol.131 (34), p.12290-12297

2009

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Shape-Enhanced Photocatalytic Activity of Single-Crystalline Anatase TiO2 (101) Nanobelts

Journal of the American Chemical Society, 2010-05, Vol.132 (19), p.6679-6685

2010

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First-principles-based kinetic Monte Carlo studies of diffusion of hydrogen in Ni–Al and Ni–Fe binary alloys

Journal of materials science, 2015-05, Vol.50 (9), p.3361-3370

Tafen, De Nyago

2015

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Temperature tunability in Sr1−xCaxFeO3−δ for reversible oxygen storage: a computational and experimental study

Journal of materials chemistry. A, Materials for energy and sustainability, 2020, Vol.8 (5), p.2602-2612

2020

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Dimensionality of Nanoscale TiO2 Determines the Mechanism of Photoinduced Electron Injection from a CdSe Nanoparticle

Nano letters, 2014-04, Vol.14 (4), p.1790-1796

2014

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Size and Temperature Dependence of Electron Transfer between CdSe Quantum Dots and a TiO2 Nanobelt

Journal of physical chemistry. C, 2015-03, Vol.119 (10), p.5639-5647

2015

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On the Flow of CO2-Saturated Water in a Cement Fracture

Geosciences (Basel), 2023-10, Vol.13 (10), p.312

2023

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First-Principles Modeling in Heterogeneous Electrocatalysis

Catalysts, 2018-10, Vol.8 (10), p.424

2018

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The inclusion of experimental information in first principles modelling of materials

Journal of physics. Condensed matter, 2004-11, Vol.16 (44), p.S5173-S5182

2004

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On the Flow of CO[sub.2]-Saturated Water in a Cement Fracture

Geosciences (Basel), 2023-10, Vol.13 (10)

2023

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Silver transport in GexSe1-x:Ag materials : Ab initio simulation of a solid electrolyte

Physical review. B, Condensed matter and materials physics, 2005-08, Vol.72 (5), p.054206.1-054206.9

2005

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Designing perovskite catalysts for controlled active-site exsolution in the microwave dry reforming of methane

Applied catalysis. B, Environmental, 2021-05, Vol.284, p.119711, Article 119711

2021

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Realistic models of binary glasses from models of tetrahedral amorphous semiconductors

Physical review. B, Condensed matter, 2003-10, Vol.68 (16), Article 165208

2003

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Electrocatalytic Oxygen Evolution with an Atomically Precise Nickel Catalyst

ACS catalysis, 2016-02, Vol.6 (2), p.1225-1234

2016

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Simulation of Atomic Diffusion in the Fcc NiAl System: A Kinetic Monte Carlo Study

Journal of physical chemistry. C, 2015-05, Vol.119 (21), p.11809-11817

2015

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Size and Temperature Dependence of Electron Transfer between CdSe Quantum Dots and a TiO 2 Nanobelt

Journal of physical chemistry. C, 2015-03, Vol.119 (10), p.5639-5647

2015

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Selective Electrocatalytic Reduction of CO2 into CO at Small, Thiol-Capped Au/Cu Nanoparticles

Journal of physical chemistry. C, 2018-12, Vol.122 (49), p.27991-28000

2018

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Electrocatalytic oxygen evolution with pure and substituted M 6 (SR) 12 (M=Pd, Fe, Rh) complexes

Computational materials science, 2018-04, Vol.150 (C)

2018

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Simulation of Diffusion in FCC NiFe Binary Alloys Using Kinetic Monte Carlo Method

Journal of physical chemistry. C, 2014-09, Vol.118 (38), p.22221-22228

2014

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A framework for optimizing oxygen vacancy formation in doped perovskites

Computers & chemical engineering, 2019-07, Vol.126 (C), p.168-177

2019

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Designing perovskite catalysts for controlled active-site exsolution in the microwave dry reforming of methane

Applied catalysis. B, Environmental, 2020-11, Vol.284

2020

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Electrocatalytic oxygen evolution with pure and substituted M6(SR)12 (M = Pd, Fe, Rh) complexes

Computational materials science, 2018-07, Vol.150, p.283-290

2018

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A framework for optimizing oxygen vacancy formation in doped perovskites

Computers & chemical engineering, 2019-04, Vol.126 (C)

2019

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Temperature tunability in Sr 1−x Ca x FeO 3−δ for reversible oxygen storage: a computational and experimental study

Journal of materials chemistry. A, Materials for energy and sustainability, 2020-02, Vol.8 (5), p.2602-2612

2020

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Visible light photocatalytic activity in nitrogen-doped TiO2 nanobelts

Origin of Photocatalytic Activity of Nitrogen-Doped TiO2 Nanobelts

Shape-Enhanced Photocatalytic Activity of Single-Crystalline Anatase TiO2 (101) Nanobelts

First-principles-based kinetic Monte Carlo studies of diffusion of hydrogen in Ni–Al and Ni–Fe binary alloys

Temperature tunability in Sr1−xCaxFeO3−δ for reversible oxygen storage: a computational and experimental study

Dimensionality of Nanoscale TiO2 Determines the Mechanism of Photoinduced Electron Injection from a CdSe Nanoparticle

Size and Temperature Dependence of Electron Transfer between CdSe Quantum Dots and a TiO2 Nanobelt

On the Flow of CO2-Saturated Water in a Cement Fracture

First-Principles Modeling in Heterogeneous Electrocatalysis

The inclusion of experimental information in first principles modelling of materials

On the Flow of CO[sub.2]-Saturated Water in a Cement Fracture

Silver transport in GexSe1-x:Ag materials : Ab initio simulation of a solid electrolyte

Designing perovskite catalysts for controlled active-site exsolution in the microwave dry reforming of methane

Realistic models of binary glasses from models of tetrahedral amorphous semiconductors

Electrocatalytic Oxygen Evolution with an Atomically Precise Nickel Catalyst

Simulation of Atomic Diffusion in the Fcc NiAl System: A Kinetic Monte Carlo Study

Size and Temperature Dependence of Electron Transfer between CdSe Quantum Dots and a TiO 2 Nanobelt

Selective Electrocatalytic Reduction of CO2 into CO at Small, Thiol-Capped Au/Cu Nanoparticles

Electrocatalytic oxygen evolution with pure and substituted M 6 (SR) 12 (M=Pd, Fe, Rh) complexes

Simulation of Diffusion in FCC NiFe Binary Alloys Using Kinetic Monte Carlo Method

A framework for optimizing oxygen vacancy formation in doped perovskites

Designing perovskite catalysts for controlled active-site exsolution in the microwave dry reforming of methane

Electrocatalytic oxygen evolution with pure and substituted M6(SR)12 (M = Pd, Fe, Rh) complexes

A framework for optimizing oxygen vacancy formation in doped perovskites

Temperature tunability in Sr 1−x Ca x FeO 3−δ for reversible oxygen storage: a computational and experimental study

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