Theoretical investigation of gold based model catalysts

Gold Catalysis

(2014) Cynthia M. Friend et al.   ACCOUNTS OF CHEMICAL RESEARCH

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

Reactivity of Oxygen Adatoms on Stepped Au(997) Surface toward NO and NO2

(2014) Zongfang Wu et al.   Journal of Physical Chemistry C

Methanol-Selective Oxidation Pathways on Au Surfaces: A First-Principles Study

(2014) Lei Wang et al.   Journal of Physical Chemistry C

Tuning the Stability of Surface Intermediates Using Adsorbed Oxygen: Acetate on Au(111)

(2014) Till Cremer et al.   Journal of Physical Chemistry Letters

Selective Hydrogen Production from Formic Acid Decomposition on Pd–Au Bimetallic Surfaces

(2014) Wen-Yueh Yu et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Oxygen and Hydroxyl Species Induce Multiple Reaction Pathways for the Partial Oxidation of Allyl Alcohol on Gold

(2014) Gregory M. Mullen et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Switching Selectivity in Oxidation Reactions on Gold: The Mechanism of C–C vs C–H Bond Activation in the Acetate Intermediate on Au(111)

(2014) Cassandra G. F. Siler et al.   ACS Catalysis

Model Studies with Gold: A Versatile Oxidation and Hydrogenation Catalyst

(2013) Ming Pan et al.   ACCOUNTS OF CHEMICAL RESEARCH

The Important Role of Hydroxyl on Oxidation Catalysis by Gold Nanoparticles

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

The Activation of Gold and the Water–Gas Shift Reaction: Insights from Studies with Model Catalysts

(2013) José A. Rodriguez et al.   ACCOUNTS OF CHEMICAL RESEARCH

Gold Atoms Stabilized on Various Supports Catalyze the Water–Gas Shift Reaction

(2013) Maria Flytzani-Stephanopoulos   ACCOUNTS OF CHEMICAL RESEARCH

Theoretical and Experimental Insights into the Origin of the Catalytic Activity of Subnanometric Gold Clusters: Attempts to Predict Reactivity with Clusters and Nanoparticles of Gold

(2013) Mercedes Boronat 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

Strategies for Designing Supported Gold–Palladium Bimetallic Catalysts for the Direct Synthesis of Hydrogen Peroxide

(2013) Jennifer K. Edwards et al.   ACCOUNTS OF CHEMICAL RESEARCH

Model studies of heterogeneous catalytic hydrogenation reactions with gold

(2013) Ming Pan et al.   CHEMICAL SOCIETY REVIEWS

Structure sensitivity of low-temperature NO decomposition on Au surfaces

(2013) Zongfang Wu et al.   JOURNAL OF CATALYSIS

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

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

Reaction mechanism for methanol oxidation on Au(111): A density functional theory study

(2012) Shuping Liu et al.   APPLIED SURFACE SCIENCE

Adsorption and Surface Reaction of NO2 on a Stepped Au(997) Surface: Enhanced Reactivity of Low-Coordinated Au Atoms

(2012) Zongfang Wu et al.   Journal of Physical Chemistry C

Reactivity and Morphology of Oxygen-Modified Au Surfaces

(2012) Ashleigh E. Baber et al.   Journal of Physical Chemistry C

Bimetallic Au–Pd Alloy Catalysts for N2O Decomposition: Effects of Surface Structures on Catalytic Activity

(2012) Xing Wei et al.   Journal of Physical Chemistry C

Highly Selective, Facile NO2 Reduction to NO at Cryogenic Temperatures on Hydrogen Precovered Gold

(2012) Ming Pan et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Mechanistic understanding of hydrogenation of acetaldehyde on Au(111): A DFT investigation

(2012) Qingsen Meng et al.   SURFACE SCIENCE

Structure and Surface Chemistry of Gold-Based Model Catalysts

(2011) Jinlong Gong   CHEMICAL REVIEWS

Reactions of small molecules on gold single crystal surfaces

(2011) Sónia A. C. Carabineiro et al.   GOLD BULLETIN

Mechanism of selective alcohol oxidation to aldehydes on gold catalysts: Influence of surface roughness on reactivity

(2011) Mercedes Boronat et al.   JOURNAL OF CATALYSIS

Theoretical Study of O-Assisted Selective Coupling of Methanol on Au(111)

(2011) Bingjun Xu et al.   Journal of Physical Chemistry C

Low-Temperature Hydrogenation of Acetaldehyde to Ethanol on H-Precovered Au(111)

(2011) Ming Pan et al.   Journal of Physical Chemistry Letters

Origin and Activity of Gold Nanoparticles as Aerobic Oxidation Catalysts in Aqueous Solution

(2011) Cheng Shang et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

In-situ XPS investigation of nitric oxide adsorption on (111), (310), and (533) gold single crystal faces

(2011) A.V. Bukhtiyarov et al.   SURFACE SCIENCE

Hydroxyls-induced oxygen activation on “inert” Au nanoparticles for low-temperature CO oxidation

(2010) Kun Qian et al.   JOURNAL OF CATALYSIS

Mechanism of N2O Formation During NO Reduction on the Au(111) Surface

(2010) Yingying Wang et al.   Journal of Physical Chemistry C

Achieving Optimum Selectivity in Oxygen Assisted Alcohol Cross-Coupling on Gold

(2010) Bingjun Xu 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

The mystery of gold's chemical activity: local bonding, morphology and reactivity of atomic oxygen

(2010) Thomas A. Baker et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Nanoporous Gold Catalysts for Selective Gas-Phase Oxidative Coupling of Methanol at Low Temperature

(2010) A. Wittstock et al.   SCIENCE

Oxygen-assisted cross-coupling of methanol with alkyl alcohols on metallic gold

(2010) Bingjun Xu et al.   Chemical Science

Surface Science Investigations of Oxidative Chemistry on Gold

(2009) Jinlong Gong et al.   ACCOUNTS OF CHEMICAL RESEARCH

Selectivity Control in Gold-Mediated Esterification of Methanol

(2009) Bingjun Xu et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Oxide-supported single gold catalyst for selective hydrogenation of acrolein predicted from first principles

(2009) Chuan-Ming Wang et al.   JOURNAL OF CATALYSIS

Annealing Effect on Reactivity of Oxygen-Covered Au(111)

(2009) Rotimi A. Ojifinni et al.   Journal of Physical Chemistry C

The Role of Preadsorbed Atomic Hydrogen in the NO Dissociation on a Zigzag Stepped Gold Surface: A DFT Study

(2009) José L. C. Fajín et al.   Journal of Physical Chemistry C

Interaction of CO with OH on Au(111): HCOO, CO3, and HOCO as Key Intermediates in the Water-Gas Shift Reaction

(2009) Sanjaya D. Senanayake et al.   Journal of Physical Chemistry C

Metal-Embedded Graphene: A Possible Catalyst with High Activity

(2009) Yun-Hao Lu et al.   Journal of Physical Chemistry C

DFT study of CO and NO adsorption on low index and stepped surfaces of gold

(2009) A. Hussain et al.   SURFACE SCIENCE

Density functional study on mechanism of CO oxidation with activated water on O/Au (111) surface

(2009) WenHua Zhang et al.   Science Bulletin

A first-principles study of NO adsorption and oxidation on Au(111) surface

(2008) Wenhua Zhang et al.   JOURNAL OF CHEMICAL PHYSICS

The Effect of Water on the CO Oxidation on Ag(111) and Au(111) Surfaces: A First-Principle Study

(2008) Hai-Yan Su et al.   Journal of Physical Chemistry C

Surface Chemistry of Methanol on Clean and Atomic Oxygen Pre-Covered Au(111)

(2008) Jinlong Gong et al.   Journal of Physical Chemistry C

Carbonate Formation and Decomposition on Atomic Oxygen Precovered Au(111)

(2008) Rotimi A. Ojifinni et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

On the Mechanism of Low-Temperature Water Gas Shift Reaction on Copper

(2008) Amit A. Gokhale et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Water-Enhanced Low-Temperature CO Oxidation and Isotope Effects on Atomic Oxygen-Covered Au(111)

(2008) Rotimi A. Ojifinni et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Selective Oxidation of Ethanol to Acetaldehyde on Gold

(2008) Jinlong Gong et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

CO Oxidation Catalyzed by Single-Walled Helical Gold Nanotube

(2007) Wei An et al.   NANO LETTERS