☆ 4.6 Article

Catalytic activity of 1D chains of gold oxide on a stepped gold surface from density functional theory

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2022)

相关参考文献

注意：仅列出部分参考文献，下载原文获取全部文献信息。

Article Chemistry, Physical

Methanol oxidation on Au(332): methyl formate selectivity and surface deactivation under isothermal conditions

Christoph D. Feldt et al.

Summary: The oxidation of methanol on the Au(332) surface was investigated, and it was found that the maximum formation of methyl formate occurred at 250 K. Increasing the methanol to oxygen ratio increased the selectivity to methyl formate and decreased the unwanted overoxidation.

CATALYSIS SCIENCE & TECHNOLOGY (2022)

添加到收藏夹

Review Chemistry, Multidisciplinary

Dilute Alloys Based on Au, Ag, or Cu for Efficient Catalysis: From Synthesis to Active Sites

Jennifer D. Lee et al.

Summary: The development of new catalyst materials is crucial for energy-efficient chemical synthesis. Dilute alloy catalysts, which enhance reactivity and retain selectivity, show great promise. The integrated approach, combining materials synthesis, surface chemistry, reaction kinetics, characterization, and theoretical calculations, can predict and improve catalytic selectivity. This approach bridges the gap between fundamental knowledge and the design of complex catalytic systems, leading to the development of new and efficient catalytic processes.

CHEMICAL REVIEWS (2022)

添加到收藏夹

Article Chemistry, Physical

Methanol oxidation on Au(332): an isothermal pulsed molecular beam study

Christoph D. Feldt et al.

Summary: Isothermal molecular beam experiments were conducted on the methanol oxidation over the stepped Au(332) surface under well-defined ultra-high vacuum conditions. The results suggest a different reactivity of oxygen for competing reaction pathways in the oxidation of methanol.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2021)

添加到收藏夹

Article Chemistry, Physical

What Changes on the Inverse Catalyst? Insights from CO Oxidation on Au-Supported Ceria Nanoparticles Using Ab Initio Molecular Dynamics

Yong Li et al.

ACS CATALYSIS (2020)

添加到收藏夹

Article Chemistry, Physical

Density Functional Theory Investigation of Oxidation Intermediates on Gold and Gold-Silver Surfaces

Mehmet Gokhan Sensoy et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2020)

添加到收藏夹

Article Chemistry, Physical

Enhanced Electrocatalytic Activities toward the Ethanol Oxidation of Nanoporous Gold Prepared via Solid-Phase Reaction

An Zhang et al.

ACS APPLIED ENERGY MATERIALS (2020)

添加到收藏夹

Article Chemistry, Physical

CO Oxidation over Unsupported Group 11 Metal Catalysts: New Mechanistic Insight from First-Principles

Wilke Dononelli et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2019)

添加到收藏夹

Article Chemistry, Physical

Oxygen adsorption on spontaneously reconstructed Au(511)

Fang Xu et al.

SURFACE SCIENCE (2019)

添加到收藏夹

Article Chemistry, Physical

Understanding Oxygen Activation on Nanoporous Gold

Wilke Dononelli et al.

ACS CATALYSIS (2019)

添加到收藏夹

Article Chemistry, Physical

Oxygen-Driven Surface Evolution of Nanoporous Gold: Insights from Ab Initio Molecular Dynamics and Auger Electron Spectroscopy

Yong Li et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2018)

添加到收藏夹

Article Chemistry, Applied

Structural Differentiation of the Reactivity of Alcohols with Active Oxygen on Au(110)

Fanny Hiebel et al.

TOPICS IN CATALYSIS (2018)

添加到收藏夹

Article Chemistry, Physical

Methanol oxidation on the Au(310) surface: A theoretical study

Gabriele Tomaschun et al.

JOURNAL OF CATALYSIS (2018)

添加到收藏夹

Article Chemistry, Physical

CO Oxidation on a Au/TiO2 Nanoparticle Catalyst via the Au-Assisted Mars-van Krevelen Mechanism

Philomena Schlexer et al.

ACS CATALYSIS (2018)

添加到收藏夹

Review Chemistry, Multidisciplinary

O-2 Activation by Metal Surfaces: Implications for Bonding and Reactivity on Heterogeneous Catalysts

Matthew M. Montemore et al.

CHEMICAL REVIEWS (2018)

添加到收藏夹

Review Chemistry, Multidisciplinary

Industrial Applications of Gold Catalysis

Rosaria Ciriminna et al.

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2016)

添加到收藏夹

Article Chemistry, Physical

Active sites for methanol partial oxidation on nanoporous gold catalysts

Lu-Cun Wang et al.

JOURNAL OF CATALYSIS (2016)

添加到收藏夹

Article Chemistry, Physical

How Does Nanoporous Gold Dissociate Molecular Oxygen?

Matthew M. Montemore et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2016)

添加到收藏夹

Article Chemistry, Multidisciplinary

Unsupported Nanoporous Gold Catalyst for Chemoselective Hydrogenation Reactions under Low Pressure: Effect of Residual Silver on the Reaction

Balaram S. Takale et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2016)

添加到收藏夹

Article Chemistry, Physical

Direct visualization of quasi-ordered oxygen chain structures on Au(110)-(1 x 2)

F. Hiebel et al.

SURFACE SCIENCE (2016)

添加到收藏夹

Review Chemistry, Applied

Single atom gold catalysts for low-temperature CO oxidation

Botao Qiao et al.

CHINESE JOURNAL OF CATALYSIS (2016)

添加到收藏夹

Article Chemistry, Physical

Chemisorbed Oxygen on the Au(321) Surface Alloyed with Silver: A First-Principles Investigation

Lyudmila V. Moskaleva et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2015)

添加到收藏夹

Article Physics, Multidisciplinary

Strongly Constrained and Appropriately Normed Semilocal Density Functional

Jianwei Sun et al.

PHYSICAL REVIEW LETTERS (2015)

添加到收藏夹

Article Multidisciplinary Sciences

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

Yang-Gang Wang et al.

NATURE COMMUNICATIONS (2015)

添加到收藏夹

Article Chemistry, Physical

Nanoporous Gold: Understanding the Origin of the Reactivity of a 21st Century Catalyst Made by Pre-Columbian Technology

Juergen Biener et al.

ACS CATALYSIS (2015)

添加到收藏夹

Review Chemistry, Multidisciplinary

Model Studies Studies with Gold: A Versatile Oxidation and Hydrogenation Catalyst

Ming Pan et al.

ACCOUNTS OF CHEMICAL RESEARCH (2014)

添加到收藏夹

Review Chemistry, Multidisciplinary

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

Jose A. Rodriguez et al.

ACCOUNTS OF CHEMICAL RESEARCH (2014)

添加到收藏夹

Article Chemistry, Physical

Tuning the catalytic activity of Au-Pd nanoalloys in CO oxidation via composition

Daojian Cheng et al.

JOURNAL OF CATALYSIS (2014)

添加到收藏夹

Review Chemistry, Multidisciplinary

Gold catalysts in environmental remediation and water-gas shift technologies

Tarek Barakat et al.

ENERGY & ENVIRONMENTAL SCIENCE (2013)

添加到收藏夹

Article Chemistry, Physical

CO Oxidation at the Interface of Au Nanoclusters and the Stepped-CeO2(111) Surface by the Mars-van Krevelen Mechanism

Hyun You Kim et al.

JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2013)

添加到收藏夹

Article Chemistry, Multidisciplinary

Oxygen-Mediated Coupling of Alcohols over Nanoporous Gold Catalysts at Ambient Pressures

Kathryn M. Kosuda et al.

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2012)

添加到收藏夹

Article Chemistry, Physical

Theoretical Study of Atomic Oxygen on Gold Surface by Huckel Theory and DFT Calculations

Keju Sun et al.

JOURNAL OF PHYSICAL CHEMISTRY A (2012)

添加到收藏夹

Article Chemistry, Multidisciplinary

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

Rhitankar Pal et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2012)

添加到收藏夹

Article Chemistry, Multidisciplinary

CO Oxidation Mechanism on CeO2-Supported Au Nanoparticles

Hyun You Kim et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2012)

添加到收藏夹

Article Chemistry, Physical

CO Oxidation by Subnanometer AgxAu3-x Supported Clusters via Density Functional Theory Simulations

F. R. Negreiros et al.

ACS CATALYSIS (2012)

添加到收藏夹

Article Chemistry, Multidisciplinary

On the theoretical understanding of the unexpected O-2 activation by nanoporous gold

Jose L. C. Fajin et al.

CHEMICAL COMMUNICATIONS (2011)

添加到收藏夹

Article Chemistry, Multidisciplinary

Synthesis and Stabilization of Subnanometric Gold Oxide Nanoparticles on Multiwalled Carbon Nanotubes and Their Catalytic Activity

Leonor Alves et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2011)

添加到收藏夹

Article Chemistry, Physical

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

Thomas A. Baker et al.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2011)

添加到收藏夹

Article Chemistry, Physical

Silver residues as a possible key to a remarkable oxidative catalytic activity of nanoporous gold

Lyudmila V. Moskaleva et al.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2011)

添加到收藏夹

Article Multidisciplinary Sciences

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

Isabel Xiaoye Green et al.

SCIENCE (2011)

添加到收藏夹

Article Chemistry, Physical

Local Bonding Effects in the Oxidation of CO on Oxygen-Covered Au(111) from Ab Initio Molecular Dynamics Simulations

Thomas A. Baker et al.

JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2010)

添加到收藏夹

Article Multidisciplinary Sciences

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

A. Wittstock et al.

SCIENCE (2010)

添加到收藏夹

Review Chemistry, Multidisciplinary

Surface Science Investigations of Oxidative Chemistry on Gold

Jinlong Gong et al.

ACCOUNTS OF CHEMICAL RESEARCH (2009)

添加到收藏夹

Article Chemistry, Physical

Chainlike Au-O Structures on Au(110)-(1 x r) Surfaces Calculated from First Principles

M. Landmann et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2009)

添加到收藏夹

Article Chemistry, Physical

DFT Study of the CO Oxidation on the Au(321) Surface

Jose L. C. Fajin et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2008)

添加到收藏夹

Article Chemistry, Physical

DFT study of the Au(321) surface reconstruction by consecutive deposition of oxygen atoms

Jose L. C. Fajin et al.

SURFACE SCIENCE (2008)

添加到收藏夹

Article Multidisciplinary Sciences

Activity of CeOx and TiOx nanoparticles grown on Au(111) in the water-gas shift reaction

J. A. Rodriguez et al.

SCIENCE (2007)

添加到收藏夹

Article Chemistry, Physical

Adsorption of atomic and molecular oxygen on the au(321) surface: DFT study

Jose L. C. Fajin et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2007)

添加到收藏夹

Article Materials Science, Multidisciplinary

First-principles investigations of the structure and stability of oxygen adsorption and surface oxide formation at Au(111)

Hongqing Shi et al.

PHYSICAL REVIEW B (2007)

添加到收藏夹

Article Chemistry, Multidisciplinary

Low temperature CO oxidation over unsupported nanoporous gold

Caixia Xu et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2007)

添加到收藏夹

Article Chemistry, Physical

Oxygen adsorption and oxidation reactions on Au(211) surfaces:: Exposures using O2 at high pressures and ozone (O3) in UHV

Jooho Kirn et al.

SURFACE SCIENCE (2006)

添加到收藏夹

Article Chemistry, Multidisciplinary

Gold catalysts: Nanoporous gold foams

Volkmar Zielasek et al.

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2006)

添加到收藏夹

Article Chemistry, Multidisciplinary

Enhancement of O2 dissociation on Au(111) by adsorbed oxygen:: Implications for oxidation catalysis

XY Deng et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2005)

添加到收藏夹

Article Chemistry, Physical

Relationship between structure and CO oxidation activity of ceria-supported gold catalysts

AM Venezia et al.

JOURNAL OF PHYSICAL CHEMISTRY B (2005)

添加到收藏夹

Article Chemistry, Physical

Adsorption and dissociation of O2 on gold surfaces:: Effect of steps and strain

Y Xu et al.

JOURNAL OF PHYSICAL CHEMISTRY B (2003)

添加到收藏夹

Article Chemistry, Multidisciplinary

Catalytic role of gold in gold-based catalysts: A density functional theory study on the CO oxidation on gold

ZP Liu et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2002)

添加到收藏夹

Article Chemistry, Physical

A climbing image nudged elastic band method for finding saddle points and minimum energy paths

G Henkelman et al.

JOURNAL OF CHEMICAL PHYSICS (2000)

添加到收藏夹

© Peeref 2019-2024. All rights reserved.