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Exploring the limits: A low-pressure, low-temperature Haber–Bosch process

Chemical physics letters, 2014-04, Vol.598 (C), p.108-112

2014

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Ligand effects in heterogeneous catalysis and electrochemistry

Electrochimica acta, 2007-05, Vol.52 (18), p.5512-5516

2007

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Structure sensitivity of the methanation reaction : H2-induced CO dissociation on nickel surfaces

Journal of catalysis, 2008-04, Vol.255 (1), p.6-19

2008

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Electrolysis of water on (oxidized) metal surfaces

Chemical physics, 2005-12, Vol.319 (1), p.178-184

2005

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CO methanation over supported bimetallic Ni–Fe catalysts: From computational studies towards catalyst optimization

Applied catalysis. A, General, 2007-03, Vol.320, p.98-104

2007

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The Brønsted–Evans–Polanyi relation and the volcano curve in heterogeneous catalysis

Journal of catalysis, 2004-05, Vol.224 (1), p.206-217

2004

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Recent STM, DFT and HAADF-STEM studies of sulfide-based hydrotreating catalysts: Insight into mechanistic, structural and particle size effects

Catalysis today, 2008-01, Vol.130 (1), p.86-96

2008

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Modeling the electro-oxidation of CO and H2/CO on Pt, Ru, PtRu and Pt3Sn

Electrochimica acta, 2003-11, Vol.48 (25-26), p.3731-3742

2003

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Theoretical surface science and catalysis—calculations and concepts

Advances in Catalysis, 2000, Vol.45, p.71-129

2000

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Hydrodesulfurization reaction pathways on MoS2 nanoclusters revealed by scanning tunneling microscopy

Journal of catalysis, 2004-05, Vol.224 (1), p.94-106

2004

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Density Functional Theory in Surface Science and Heterogeneous Catalysis

MRS bulletin, 2006-09, Vol.31 (9), p.669-674

2006

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Anode Materials for Low-Temperature Fuel Cells: A Density Functional Theory Study

Journal of catalysis, 2001-04, Vol.199 (1), p.123-131

2001

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Electronic factors determining the reactivity of metal surfaces

Surface science, 1995-12, Vol.343 (3), p.211-220

1995

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Theoretical study of the Au/TiO2(110) interface

Surface science, 2002-08, Vol.515 (1), p.175-186

2002

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How a gold substrate can increase the reactivity of a Pt overlayer

Surface science, 1999-05, Vol.426 (3), p.395-409

1999

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Steam Reforming and Graphite Formation on Ni Catalysts

Journal of catalysis, 2002-07, Vol.209 (2), p.365-384

2002

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Synergetic effects in CO adsorption on Cu–Pd(1 1 1) alloys

Surface science, 2001-04, Vol.477 (1), p.59-75

2001

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Theoretical Studies of Stability and Reactivity of CHx Species on Ni(111)

Journal of catalysis, 2000-01, Vol.189 (1), p.16-30

2000

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The Brønsted–Evans–Polanyi Relation and the Volcano Plot for Ammonia Synthesis over Transition Metal Catalysts

Journal of catalysis, 2001, Vol.197 (2), p.229-231

2001

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Electrochemical dissolution of surface alloys in acids: Thermodynamic trends from first-principles calculations

Electrochimica acta, 2007-05, Vol.52 (19), p.5829-5836

2007

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Electrolysis of water on oxide surfaces

Journal of electroanalytical chemistry (Lausanne, Switzerland), 2007-09, Vol.607 (1), p.83-89

2007

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Predicting Catalysis: Understanding Ammonia Synthesis from First-Principles Calculations

The journal of physical chemistry. B, 2006-09, Vol.110 (36), p.17719-17735

2006

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The effect of strain for N2 dissociation on Fe surfaces

Surface science, 2001-08, Vol.489 (1-3), p.135-143

2001

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On the origin of the catalytic activity of gold nanoparticles for low-temperature CO oxidation

Journal of catalysis, 2004-04, Vol.223 (1), p.232-235

2004

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Ammonia synthesis over a Ru(0001) surface studied by density functional calculations

Journal of catalysis, 2003-12, Vol.220 (2), p.273-279

2003

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Exploring the limits: A low-pressure, low-temperature Haber–Bosch process

Ligand effects in heterogeneous catalysis and electrochemistry

Structure sensitivity of the methanation reaction : H2-induced CO dissociation on nickel surfaces

Electrolysis of water on (oxidized) metal surfaces

CO methanation over supported bimetallic Ni–Fe catalysts: From computational studies towards catalyst optimization

The Brønsted–Evans–Polanyi relation and the volcano curve in heterogeneous catalysis

Recent STM, DFT and HAADF-STEM studies of sulfide-based hydrotreating catalysts: Insight into mechanistic, structural and particle size effects

Modeling the electro-oxidation of CO and H2/CO on Pt, Ru, PtRu and Pt3Sn

Theoretical surface science and catalysis—calculations and concepts

Hydrodesulfurization reaction pathways on MoS2 nanoclusters revealed by scanning tunneling microscopy

Density Functional Theory in Surface Science and Heterogeneous Catalysis

Anode Materials for Low-Temperature Fuel Cells: A Density Functional Theory Study

Electronic factors determining the reactivity of metal surfaces

Theoretical study of the Au/TiO2(110) interface

How a gold substrate can increase the reactivity of a Pt overlayer

Steam Reforming and Graphite Formation on Ni Catalysts

Synergetic effects in CO adsorption on Cu–Pd(1 1 1) alloys

Theoretical Studies of Stability and Reactivity of CHx Species on Ni(111)

The Brønsted–Evans–Polanyi Relation and the Volcano Plot for Ammonia Synthesis over Transition Metal Catalysts

Electrochemical dissolution of surface alloys in acids: Thermodynamic trends from first-principles calculations

Electrolysis of water on oxide surfaces

Predicting Catalysis: Understanding Ammonia Synthesis from First-Principles Calculations

The effect of strain for N2 dissociation on Fe surfaces

On the origin of the catalytic activity of gold nanoparticles for low-temperature CO oxidation

Ammonia synthesis over a Ru(0001) surface studied by density functional calculations

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