Hydrogenation of molecular oxygen to hydroperoxyl: An alternative pathway for O2 activation on nanogold catalysts

Theoretical investigation of gold based model catalysts

(2015) Wenhua Zhang et al.   Science China-Chemistry

Dynamic formation of single-atom catalytic active sites on ceria-supported gold nanoparticles

(2015) Yang-Gang Wang et al.   Nature Communications

Activation of Molecular Oxygen and the Nature of the Active Oxygen Species for CO Oxidation on Oxide Supported Au Catalysts

(2014) D. Widmann et al.   ACCOUNTS OF CHEMICAL RESEARCH

Superoxide Formation on Isolated Cationic Gold Clusters

(2014) Alex P. Woodham et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

The critical role of water at the gold-titania interface in catalytic CO oxidation

(2014) J. Saavedra et al.   SCIENCE

The Important Role of Hydroxyl on Oxidation Catalysis by Gold Nanoparticles

(2013) Matthew S. Ide et al.   ACCOUNTS OF CHEMICAL RESEARCH

Insights into Catalytic Oxidation at the Au/TiO2 Dual Perimeter Sites

(2013) Isabel X. Green et al.   ACCOUNTS OF CHEMICAL RESEARCH

Nitric acid catalyzed hydrolysis of SO3 in the formation of sulfuric acid: A theoretical study

(2013) Bo Long et al.   CHEMICAL PHYSICS LETTERS

Interaction between O2 and neutral/charged Aun (n=1–3) clusters: A comparative study between density-functional theory and coupled cluster calculations

(2013) Yu Zhao et al.   CHEMICAL PHYSICS LETTERS

Evidence of Pd segregation and stabilization at edges of AuPd nano-clusters in the presence of CO: A combined DFT and DRIFTS study

(2013) Beien Zhu et al.   JOURNAL OF CATALYSIS

Theoretical Studies on Gas-Phase Reactions of Sulfuric Acid Catalyzed Hydrolysis of Formaldehyde and Formaldehyde with Sulfuric Acid and H2SO4···H2O Complex

(2013) Bo Long et al.   JOURNAL OF PHYSICAL CHEMISTRY A

DFT+U Study on the Localized Electronic States and Their Potential Role During H2O Dissociation and CO Oxidation Processes on CeO2(111) Surface

(2013) Yang-Gang Wang et al.   Journal of Physical Chemistry C

Charge Separation Promoted Activation of Molecular Oxygen by Neutral Gold Clusters

(2013) Alex P. Woodham et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

CO Self-Promoting Oxidation on Nanosized Gold Clusters: Triangular Au3 Active Site and CO Induced O–O Scission

(2013) Chunyan Liu et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

The Role of Reducible Oxide–Metal Cluster Charge Transfer in Catalytic Processes: New Insights on the Catalytic Mechanism of CO Oxidation on Au/TiO2 from ab Initio Molecular Dynamics

(2013) Yang-Gang Wang et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

The Effects of Adsorbed Water on Gold Catalysis and Surface Chemistry

(2013) Gregory M. Mullen et al.   TOPICS IN CATALYSIS

A Water-Promoted Mechanism of Alcohol Oxidation on a Au(111) Surface: Understanding the Catalytic Behavior of Bulk Gold

(2013) Chun-Ran Chang et al.   ACS Catalysis

Activation of Molecular Oxygen by Anionic Gold Clusters

(2012) Alex P. Woodham et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Unraveling the Mechanisms of O2 Activation by Size-Selected Gold Clusters: Transition from Superoxo to Peroxo Chemisorption

(2012) Rhitankar Pal et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Water-Promoted O2 Dissociation on Small-Sized Anionic Gold Clusters

(2012) Yi Gao et al.   ACS Catalysis

Mechanisms of the gold-catalysed water-gas shift

(2011) Geoffrey Bond   GOLD BULLETIN

A review of the use of gold catalysts in selective hydrogenation reactions Lynsey McEwana

(2011) Melissa Juliusa et al.   GOLD BULLETIN

Theoretical Study on the Gas Phase Reaction of Sulfuric Acid with Hydroxyl Radical in the Presence of Water

(2011) Bo Long et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Au40: A large tetrahedral magic cluster

(2011) De-en Jiang et al.   PHYSICAL REVIEW B

Spectroscopic Observation of Dual Catalytic Sites During Oxidation of CO on a Au/TiO2 Catalyst

(2011) I. X. Green et al.   SCIENCE

Theoretical studies on energetics and mechanisms of the decomposition of CF3OH

(2010) Bo Long et al.   CHEMICAL PHYSICS LETTERS

The Effect of CO and H Chemisorption on the Chemical Ordering of Bimetallic Clusters

(2010) Paul S. West et al.   Journal of Physical Chemistry C

Reactant-Promoted Oxygen Dissociation on Gold Clusters

(2010) Andrey Lyalin et al.   Journal of Physical Chemistry Letters

Probing the Interactions of O2with Small Gold Cluster Anions (Aun−,n= 1−7): Chemisorption vs Physisorption

(2010) Wei Huang et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Positive Charge States and Possible Polymorphism of Gold Nanoclusters on Reduced Ceria

(2010) Changjun Zhang et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Theoretical investigations of the catalytic role of water in propene epoxidation on gold nanoclusters: A hydroperoxyl-mediated pathway

(2010) Chun-Ran Chang et al.   Nano Research

Investigation of the structures and chemical ordering of small Pd–Au clusters as a function of composition and potential parameterisation

(2010) Ramli Ismail et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

O2 adsorption and dissociation on neutral, positively and negatively charged Aun (n = 5–79) clusters

(2010) Alberto Roldán et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Selective Propene Epoxidation on Immobilized Au6-10Clusters: The Effect of Hydrogen and Water on Activity and Selectivity

(2009) Sungsik Lee et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Propene Epoxidation with Dioxygen Catalyzed by Gold Clusters

(2009) Jiahui Huang et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Critical Size for O2Dissociation by Au Nanoparticles

(2009) Alberto Roldán et al.   CHEMPHYSCHEM

Effect of subsurface Ti-interstitials on the bonding of small gold clusters on rutile TiO2(110)

(2009) Georg K. H. Madsen et al.   JOURNAL OF CHEMICAL PHYSICS

Theoretical Studies of Palladium−Gold Nanoclusters: Pd−Au Clusters with up to 50 Atoms

(2009) Faye Pittaway et al.   Journal of Physical Chemistry C

Towards the computational design of solid catalysts

(2009) J. K. Nørskov et al.   Nature Chemistry

Influence of the exchange–correlation potential on the description of the molecular mechanism of oxygen dissociation by Au nanoparticles

(2009) Alberto Roldán et al.   THEORETICAL CHEMISTRY ACCOUNTS

Selective oxidation using gold

(2008) Cristina Della Pina et al.   CHEMICAL SOCIETY REVIEWS

Structural motifs, mixing, and segregation effects in 38-atom binary clusters

(2008) Lauro Oliver Paz-Borbón et al.   JOURNAL OF CHEMICAL PHYSICS