4.6 Article

A computational study of CO oxidation reactions on metal impurities in graphene divacancies

Related references

Note: Only part of the references are listed.
Article Chemistry, Physical

Theoretical study on geometric, electronic and catalytic performances of Fe dopant pairs in graphene

Yanan Tang et al.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2017)

Article Chemistry, Analytical

Adsorption sensitivity of metal atom decorated bilayer graphene toward toxic gas molecules (CO, NO, SO2 and HCN)

Yanan Tang et al.

SENSORS AND ACTUATORS B-CHEMICAL (2017)

Article Nanoscience & Nanotechnology

Atomic Mechanism of Electrocatalytically Active Co-N Complexes in Graphene Basal Plane for Oxygen Reduction Reaction

Feng Li et al.

ACS APPLIED MATERIALS & INTERFACES (2015)

Article Materials Science, Multidisciplinary

Reaction mechanisms for CO catalytic oxidation on monodisperse Mo atom-embedded graphene

Yanan Tang et al.

APPLIED PHYSICS A-MATERIALS SCIENCE & PROCESSING (2015)

Article Chemistry, Analytical

Improving the adsorption behavior and reaction activity of Co-anchored graphene surface toward CO and O2 molecules

Yanan Tang et al.

SENSORS AND ACTUATORS B-CHEMICAL (2015)

Article Materials Science, Multidisciplinary

CO catalytic oxidation on Al-doped graphene-like ZnO monolayer sheets: a first-principles study

Dongwei Ma et al.

JOURNAL OF MATERIALS CHEMISTRY C (2015)

Article Chemistry, Physical

Theoretical study on the Si-doped graphene as an efficient metal-free catalyst for CO oxidation

Yanan Tang et al.

APPLIED SURFACE SCIENCE (2014)

Review Chemistry, Physical

Carbon as catalyst and support for electrochemical energy conversion

Panagiotis Trogadas et al.

CARBON (2014)

Article Chemistry, Physical

Improved catalytic activity of mixed platinum catalysts supported on various carbon nanomaterials

Jie Zhang et al.

JOURNAL OF POWER SOURCES (2014)

Article Chemistry, Physical

Formation and catalytic activity of Pt supported on oxidized graphene for the CO oxidation reaction

Yanan Tang et al.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2014)

Article Materials Science, Multidisciplinary

Substitutional doping of graphene: The role of carbon divacancies

L. Tsetseris et al.

PHYSICAL REVIEW B (2014)

Article Chemistry, Multidisciplinary

Density functional theory calculations on the CO catalytic oxidation on Al-embedded graphene

Q. G. Jiang et al.

RSC ADVANCES (2014)

Article Chemistry, Multidisciplinary

Dynamics of Single Fe Atoms in Graphene Vacancies

Alex W. Robertson et al.

NANO LETTERS (2013)

Review Chemistry, Multidisciplinary

Graphene-related nanomaterials: tuning properties by functionalization

Qing Tang et al.

NANOSCALE (2013)

Article Materials Science, Multidisciplinary

Self-healing of vacancy defects in single-layer graphene and silicene

V. Ongun Ozcelik et al.

PHYSICAL REVIEW B (2013)

Article Chemistry, Multidisciplinary

Metallic Impurities in Graphenes Prepared from Graphite Can Dramatically Influence Their Properties

Adriano Ambrosi et al.

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2012)

Article Electrochemistry

Enhanced electrocatalytic activity of nitrogen-doped graphene for the reduction of nitro explosives

Ti-Wei Chen et al.

ELECTROCHEMISTRY COMMUNICATIONS (2012)

Article Chemistry, Physical

Improving Platinum Catalyst Durability with a Doped Graphene Support

Michael N. Groves et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2012)

Article Chemistry, Physical

Modification of Defect Structures in Graphene by Electron Irradiation: Ab Initio Molecular Dynamics Simulations

Zhiguo Wang et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2012)

Article Chemistry, Multidisciplinary

Doping Monolayer Graphene with Single Atom Substitutions

Hongtao Wang et al.

NANO LETTERS (2012)

Article Chemistry, Physical

A theoretical simulation on the catalytic oxidation of CO on Pt/graphene

Yanan Tang et al.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2012)

Review Chemistry, Multidisciplinary

Structural Defects in Graphene

Florian Banhart et al.

ACS NANO (2011)

Article Chemistry, Physical

Trapping of metal atoms in the defects on graphene

Yanan Tang et al.

JOURNAL OF CHEMICAL PHYSICS (2011)

Article Materials Science, Multidisciplinary

Noble metals induced magnetic properties of graphene

Yanan Tang et al.

JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS (2011)

Article Chemistry, Physical

CO Catalytic Oxidation on Copper-Embedded Graphene

E. H. Song et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2011)

Article Chemistry, Multidisciplinary

Trapping of Metal Atoms in Vacancies of Carbon Nanotubes and Graphene

Julio A. Rodriguez-Manzo et al.

ACS NANO (2010)

Article Chemistry, Physical

Greatly enhanced adsorption and catalytic activity of Au and Pt clusters on defective graphene

Miao Zhou et al.

JOURNAL OF CHEMICAL PHYSICS (2010)

Article Chemistry, Physical

CO Catalytic Oxidation on Iron-Embedded Graphene: Computational Quest for Low-Cost Nanocatalysts

Yafei Li et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2010)

Article Materials Science, Multidisciplinary

Magnetism of substitutional Co impurities in graphene: Realization of single π vacancies

E. J. G. Santos et al.

PHYSICAL REVIEW B (2010)

Article Physics, Multidisciplinary

Migration and Localization of Metal Atoms on Strained Graphene

Ovidiu Cretu et al.

PHYSICAL REVIEW LETTERS (2010)

Article Physics, Applied

Destruction of graphene by metal adatoms

D. W. Boukhvalov et al.

APPLIED PHYSICS LETTERS (2009)

Article Chemistry, Physical

Metal-Embedded Graphene: A Possible Catalyst with High Activity

Yun-Hao Lu et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2009)

Article Chemistry, Multidisciplinary

Creation of Individual Vacancies in Carbon Nanotubes by Using an Electron Beam of 1 Å Diameter

Julio A. Rodriguez-Manzo et al.

NANO LETTERS (2009)

Article Multidisciplinary Sciences

Low-temperature oxidation of CO catalysed by Co3O4 nanorods

Xiaowei Xie et al.

NATURE (2009)

Article Physics, Multidisciplinary

Embedding Transition-Metal Atoms in Graphene: Structure, Bonding, and Magnetism

A. V. Krasheninnikov et al.

PHYSICAL REVIEW LETTERS (2009)

Article Chemistry, Multidisciplinary

Au-Cu Alloy nanoparticles confined in SBA-15 as a highly efficient catalyst for CO oxidation

Xiaoyan Liu et al.

CHEMICAL COMMUNICATIONS (2008)

Article Chemistry, Physical

CO oxidation on unsupported Au55, Ag55, and Au25Ag30 nanoclusters

C. M. Chang et al.

JOURNAL OF CHEMICAL PHYSICS (2008)

Article Chemistry, Multidisciplinary

CO oxidation catalyzed by single-walled helical gold nanotube

Wei An et al.

NANO LETTERS (2008)

Article Chemistry, Multidisciplinary

Superior thermal conductivity of single-layer graphene

Alexander A. Balandin et al.

NANO LETTERS (2008)

Article Multidisciplinary Sciences

Identification of active gold nanoclusters on iron oxide supports for CO oxidation

Andrew A. Herzing et al.

SCIENCE (2008)

Article Multidisciplinary Sciences

Measurement of the elastic properties and intrinsic strength of monolayer graphene

Changgu Lee et al.

SCIENCE (2008)

Article Chemistry, Multidisciplinary

One- and two-dimensional diffusion of metal atoms in graphene

Yanjie Gan et al.

SMALL (2008)

Article Chemistry, Physical

Highly active surfaces for CO oxidation on rh, pd, and pt

M. S. Chen et al.

SURFACE SCIENCE (2007)

Article Materials Science, Multidisciplinary

Role of the nanoscale in catalytic CO oxidation by supported Au and Pt nanostructures

Sergey N. Rashkeev et al.

PHYSICAL REVIEW B (2007)

Article Chemistry, Physical

The rise of graphene

A. K. Geim et al.

NATURE MATERIALS (2007)

Article Materials Science, Multidisciplinary

A fast and robust algorithm for Bader decomposition of charge density

Graeme Henkelman et al.

COMPUTATIONAL MATERIALS SCIENCE (2006)

Article Physics, Multidisciplinary

Structural, electronic, and chemical properties of nanoporous carbon

JM Carlsson et al.

PHYSICAL REVIEW LETTERS (2006)

Article Physics, Multidisciplinary

Structure and reactivity of surface oxides on Pt(110) during catalytic CO oxidation

MD Ackermann et al.

PHYSICAL REVIEW LETTERS (2005)

Article Physics, Multidisciplinary

Diffusion, coalescence, and reconstruction of vacancy defects in graphene layers -: art. no. 205501

GD Lee et al.

PHYSICAL REVIEW LETTERS (2005)

Article Multidisciplinary Sciences

Two-dimensional gas of massless Dirac fermions in graphene

KS Novoselov et al.

NATURE (2005)

Article Chemistry, Physical

The activity of the tetrahedral Au20 cluster:: charging and impurity effects

LM Molina et al.

JOURNAL OF CATALYSIS (2005)

Article Chemistry, Multidisciplinary

A systematic study of CO oxidation on metals and metal oxides: Density functional theory calculations

XQ Gong et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2004)

Article Physics, Multidisciplinary

Atomistic study of dislocation loop emission from a crack tip

T Zhu et al.

PHYSICAL REVIEW LETTERS (2004)

Article Physics, Multidisciplinary

Active role of oxide support during CO oxidation at Au/MgO

LM Molina et al.

PHYSICAL REVIEW LETTERS (2003)

Article Chemistry, Multidisciplinary

CO oxidation on Pd(100) and Pd(111): A comparative study of reaction pathways and reactivity at low and medium coverages

CJ Zhang et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2001)

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)