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Service Design for Urban Commons

1, 2022

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One step towards bridging the materials gap: surface studies of TiO2 anatase

Catalysis today, 2003-10, Vol.85 (2-4), p.93-100

2003

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Structure of the rutile TiO2(011) surface in an aqueous environment

Physical review letters, 2011-04, Vol.106 (16), p.166102-166102

2011

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Density Functional Theory and Electron Paramagnetic Resonance Study on the Effect of N−F Codoping of TiO2

Chemistry of materials, 2008-06, Vol.20 (11), p.3706-3714

2008

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The SPEAK study rationale and design: A linguistic corpus-based approach to understanding thought disorder

Schizophrenia research, 2023-09, Vol.259, p.80-87

2023

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Formic Acid Adsorption on Dry and Hydrated TiO2 Anatase (101) Surfaces by DFT Calculations

The journal of physical chemistry. B, 2000-02, Vol.104 (6), p.1300-1306

2000

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A density functional study of carbon monoxide adsorption on small cationic, neutral, and anionic gold clusters

The Journal of chemical physics, 2002-08, Vol.117 (8), p.4010-4015

2002

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Electronic Structure of Metal/Molecule//Metal Junctions: A Density Functional Theory Study of the Influence of the Molecular Terminal Group

The journal of physical chemistry. B, 2006-03, Vol.110 (8), p.3493-3498

2006

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First-principles string molecular dynamics: an efficient approach for finding chemical reaction pathways

The Journal of chemical physics, 2004-08, Vol.121 (8), p.3359-3367

2004

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Reactivity of Anatase TiO2 Nanoparticles: The Role of the Minority (001) Surface

The journal of physical chemistry. B, 2005-10, Vol.109 (42), p.19560-19562

2005

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Electronic properties of metal–molecule–metal systems at zero bias: A periodic density functional study

The Journal of chemical physics, 2003-10, Vol.119 (13), p.6729-6735

2003

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Massive Codesign: A Proposal for a Collaborative Design Framework

2018

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Theory of Carbon Doping of Titanium Dioxide

Chemistry of materials, 2005-12, Vol.17 (26), p.6656-6665

2005

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Structure and Dynamics of Small Metallic Clusters on an Insulating Metal-Oxide Surface: Copper on MgO(100)

Physical review letters, 1999-10, Vol.83 (16), p.3242-3245

1999

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Characterization of Paramagnetic Species in N-Doped TiO2 Powders by EPR Spectroscopy and DFT Calculations

The journal of physical chemistry. B, 2005-06, Vol.109 (23), p.11414-11419

2005

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Combined Experimental and DFT-TDDFT Computational Study of Photoelectrochemical Cell Ruthenium Sensitizers

Journal of the American Chemical Society, 2005-12, Vol.127 (48), p.16835-16847

2005

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The adsorption of small molecules on the TiO2 anatase (101) surface by first-principles molecular dynamics

Surface science, 1998-05, Vol.402-404, p.219-222

1998

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Binding sites, migration paths, and barriers for hydrogen on Si(111)-(7 x 7)

Physical review letters, 1995-12, Vol.75 (26), p.4756-4759

1995

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Density Functional Theory Study of Formic Acid Adsorption on Anatase TiO2(001): Geometries, Energetics, and Effects of Coverage, Hydration, and Reconstruction

The journal of physical chemistry. B, 2006-02, Vol.110 (6), p.2804-2811

2006

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Adsorption modes of cysteine on Au(111): thiolate, amino-thiolate, disulfide

The Journal of chemical physics, 2004-03, Vol.120 (10), p.4906-4914

2004

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Dopamine D1R Receptor Stimulation as a Mechanistic Pro-cognitive Target for Schizophrenia

Schizophrenia bulletin, 2022-01, Vol.48 (1), p.199-210

2022

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Initial Stages of Growth of Copper on MgO(100): A First Principles Study

Physical review letters, 1999-10, Vol.83 (14), p.2761-2764

1999

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Structure and Reactivity of Water Layers on Defect-Free and Defective Anatase TiO2(101) Surfaces

The journal of physical chemistry. B, 2004-04, Vol.108 (15), p.4743-4751

2004

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Absorption Spectrum and Solvatochromism of the [Ru(4,4‘-COOH-2,2‘-bpy)2(NCS)2] Molecular Dye by Time Dependent Density Functional Theory

Journal of the American Chemical Society, 2003-04, Vol.125 (14), p.4381-4387

2003

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Vertical and Lateral Order in Adsorbed Water Layers on Anatase TiO2(101)

Langmuir, 2004-09, Vol.20 (19), p.8379-8384

2004

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Service Design for Urban Commons

One step towards bridging the materials gap: surface studies of TiO2 anatase

Structure of the rutile TiO2(011) surface in an aqueous environment

Density Functional Theory and Electron Paramagnetic Resonance Study on the Effect of N−F Codoping of TiO2

The SPEAK study rationale and design: A linguistic corpus-based approach to understanding thought disorder

Formic Acid Adsorption on Dry and Hydrated TiO2 Anatase (101) Surfaces by DFT Calculations

A density functional study of carbon monoxide adsorption on small cationic, neutral, and anionic gold clusters

Electronic Structure of Metal/Molecule//Metal Junctions: A Density Functional Theory Study of the Influence of the Molecular Terminal Group

First-principles string molecular dynamics: an efficient approach for finding chemical reaction pathways

Reactivity of Anatase TiO2 Nanoparticles: The Role of the Minority (001) Surface

Electronic properties of metal–molecule–metal systems at zero bias: A periodic density functional study

Massive Codesign: A Proposal for a Collaborative Design Framework

Theory of Carbon Doping of Titanium Dioxide

Structure and Dynamics of Small Metallic Clusters on an Insulating Metal-Oxide Surface: Copper on MgO(100)

Characterization of Paramagnetic Species in N-Doped TiO2 Powders by EPR Spectroscopy and DFT Calculations

Combined Experimental and DFT-TDDFT Computational Study of Photoelectrochemical Cell Ruthenium Sensitizers

The adsorption of small molecules on the TiO2 anatase (101) surface by first-principles molecular dynamics

Binding sites, migration paths, and barriers for hydrogen on Si(111)-(7 x 7)

Density Functional Theory Study of Formic Acid Adsorption on Anatase TiO2(001): Geometries, Energetics, and Effects of Coverage, Hydration, and Reconstruction

Adsorption modes of cysteine on Au(111): thiolate, amino-thiolate, disulfide

Dopamine D1R Receptor Stimulation as a Mechanistic Pro-cognitive Target for Schizophrenia

Initial Stages of Growth of Copper on MgO(100): A First Principles Study

Structure and Reactivity of Water Layers on Defect-Free and Defective Anatase TiO2(101) Surfaces

Absorption Spectrum and Solvatochromism of the [Ru(4,4‘-COOH-2,2‘-bpy)2(NCS)2] Molecular Dye by Time Dependent Density Functional Theory

Vertical and Lateral Order in Adsorbed Water Layers on Anatase TiO2(101)

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