skip to main content
DOE PAGES title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Graphene Supported Single Atom Transition Metal Catalysts for Methane Activation

Authors:
ORCiD logo [1]; ORCiD logo [2]; ORCiD logo [3]
  1. Department of Materials Science and Engineering and Institute of Materials Science, University of Connecticut, Storrs CT 06269 USA
  2. Department of Materials Science and Engineering and Institute of Materials Science, University of Connecticut, Storrs CT 06269 USA, Department of Chemistry, University of Connecticut, Storrs CT 06269 USA
  3. Department of Materials Science and Engineering and Institute of Materials Science, University of Connecticut, Storrs CT 06269 USA, Department of Physics, University of Connecticut, Storrs CT 06269 USA
Publication Date:
Sponsoring Org.:
USDOE
OSTI Identifier:
1439262
Grant/Contract Number:  
FG02-86ER13622.A000
Resource Type:
Publisher's Accepted Manuscript
Journal Name:
ChemCatChem
Additional Journal Information:
Journal Name: ChemCatChem Journal Volume: 10 Journal Issue: 15; Journal ID: ISSN 1867-3880
Publisher:
Wiley Blackwell (John Wiley & Sons)
Country of Publication:
Germany
Language:
English

Citation Formats

Sahoo, Sanjubala, Suib, Steven L., and Alpay, S. Pamir. Graphene Supported Single Atom Transition Metal Catalysts for Methane Activation. Germany: N. p., 2018. Web. doi:10.1002/cctc.201800465.
Sahoo, Sanjubala, Suib, Steven L., & Alpay, S. Pamir. Graphene Supported Single Atom Transition Metal Catalysts for Methane Activation. Germany. doi:10.1002/cctc.201800465.
Sahoo, Sanjubala, Suib, Steven L., and Alpay, S. Pamir. Mon . "Graphene Supported Single Atom Transition Metal Catalysts for Methane Activation". Germany. doi:10.1002/cctc.201800465.
@article{osti_1439262,
title = {Graphene Supported Single Atom Transition Metal Catalysts for Methane Activation},
author = {Sahoo, Sanjubala and Suib, Steven L. and Alpay, S. Pamir},
abstractNote = {},
doi = {10.1002/cctc.201800465},
journal = {ChemCatChem},
number = 15,
volume = 10,
place = {Germany},
year = {2018},
month = {5}
}

Journal Article:
Free Publicly Available Full Text
Publisher's Version of Record
DOI: 10.1002/cctc.201800465

Citation Metrics:
Cited by: 4 works
Citation information provided by
Web of Science

Save / Share:

Works referenced in this record:

Direct Imaging of Pt Single Atoms Adsorbed on TiO 2 (110) Surfaces
journal, December 2013

  • Chang, Teng-Yuan; Tanaka, Yusuke; Ishikawa, Ryo
  • Nano Letters, Vol. 14, Issue 1
  • DOI: 10.1021/nl403520c

Generalized Gradient Approximation Made Simple
journal, October 1996

  • Perdew, John P.; Burke, Kieron; Ernzerhof, Matthias
  • Physical Review Letters, Vol. 77, Issue 18, p. 3865-3868
  • DOI: 10.1103/PhysRevLett.77.3865

Magnetic properties of small Pt-capped Fe, Co, and Ni clusters: A density functional theory study
journal, August 2010


Tackling CO Poisoning with Single-Atom Alloy Catalysts
journal, May 2016

  • Liu, Jilei; Lucci, Felicia R.; Yang, Ming
  • Journal of the American Chemical Society, Vol. 138, Issue 20
  • DOI: 10.1021/jacs.6b03339

Catalysis by Supported Single Metal Atoms
journal, November 2016


Single atom catalysts on amorphous supports: A quenched disorder perspective
journal, March 2015

  • Peters, Baron; Scott, Susannah L.
  • The Journal of Chemical Physics, Vol. 142, Issue 10
  • DOI: 10.1063/1.4914145

Pt and Pt–Ru nanoparticles decorated polypyrrole/multiwalled carbon nanotubes and their catalytic activity towards methanol oxidation
journal, May 2007


Density functional theory study of Fe, Co, and Ni adatoms and dimers adsorbed on graphene
journal, June 2009


The Power of Single-Atom Catalysis
journal, August 2015


Hydrogenation of CO2 to formic acid over a Cu-embedded graphene: A DFT study
journal, February 2016


Inhibition of CO poisoning on Pt catalyst coupled with the reduction of toxic hexavalent chromium in a dual-functional fuel cell
journal, December 2014

  • Chung, Dong Young; Kim, Hyoung-il; Chung, Young-Hoon
  • Scientific Reports, Vol. 4, Issue 1
  • DOI: 10.1038/srep07450

Chemistry with ADF
journal, January 2001

  • te Velde, G.; Bickelhaupt, F. M.; Baerends, E. J.
  • Journal of Computational Chemistry, Vol. 22, Issue 9, p. 931-967
  • DOI: 10.1002/jcc.1056

First-principles studies on graphene-supported transition metal clusters
journal, August 2014

  • Sahoo, Sanjubala; Gruner, Markus E.; Khanna, Shiv N.
  • The Journal of Chemical Physics, Vol. 141, Issue 7
  • DOI: 10.1063/1.4893328

Catalysis by Design: Well-Defined Single-Site Heterogeneous Catalysts
journal, March 2016


Atomically dispersed supported metal catalysts: perspectives and suggestions for future research
journal, January 2017

  • Gates, Bruce C.; Flytzani-Stephanopoulos, Maria; Dixon, David A.
  • Catalysis Science & Technology, Vol. 7, Issue 19
  • DOI: 10.1039/C7CY00881C

Single-atom catalysis of CO oxidation using Pt1/FeOx
journal, July 2011

  • Qiao, Botao; Wang, Aiqin; Yang, Xiaofeng
  • Nature Chemistry, Vol. 3, Issue 8
  • DOI: 10.1038/nchem.1095

Stone-Wales defects in graphene and other planar s p 2 -bonded materials
journal, July 2009


The electronic properties of graphene
journal, January 2009

  • Castro Neto, A. H.; Guinea, F.; Peres, N. M. R.
  • Reviews of Modern Physics, Vol. 81, Issue 1, p. 109-162
  • DOI: 10.1103/RevModPhys.81.109

Single-Atomic Ruthenium Catalytic Sites on Nitrogen-Doped Graphene for Oxygen Reduction Reaction in Acidic Medium
journal, June 2017


Thermally stable single-atom platinum-on-ceria catalysts via atom trapping
journal, July 2016


Bonded-atom fragments for describing molecular charge densities
journal, January 1977


Creating single-atom Pt-ceria catalysts by surface step decoration
journal, February 2016

  • Dvořák, Filip; Farnesi Camellone, Matteo; Tovt, Andrii
  • Nature Communications, Vol. 7, Issue 1
  • DOI: 10.1038/ncomms10801

Single Atom (Pd/Pt) Supported on Graphitic Carbon Nitride as an Efficient Photocatalyst for Visible-Light Reduction of Carbon Dioxide
journal, May 2016

  • Gao, Guoping; Jiao, Yan; Waclawik, Eric R.
  • Journal of the American Chemical Society, Vol. 138, Issue 19
  • DOI: 10.1021/jacs.6b02692

Methane Activation by Heterogeneous Catalysis
journal, November 2014


CO 2 Electroreduction Performance of Transition Metal Dimers Supported on Graphene: A Theoretical Study
journal, October 2015


Effect of the damping function in dispersion corrected density functional theory
journal, March 2011

  • Grimme, Stefan; Ehrlich, Stephan; Goerigk, Lars
  • Journal of Computational Chemistry, Vol. 32, Issue 7
  • DOI: 10.1002/jcc.21759

CO Catalytic Oxidation on Iron-Embedded Graphene: Computational Quest for Low-Cost Nanocatalysts
journal, February 2010

  • Li, Yafei; Zhou, Zhen; Yu, Guangtao
  • The Journal of Physical Chemistry C, Vol. 114, Issue 14
  • DOI: 10.1021/jp911535v

The synchronous-transit method for determining reaction pathways and locating molecular transition states
journal, July 1977


Tens of thousands of atoms replaced by one
journal, September 2015


Identification of single-site gold catalysis in acetylene hydrochlorination
journal, March 2017


Single Cobalt Atoms with Precise N-Coordination as Superior Oxygen Reduction Reaction Catalysts
journal, August 2016


Controlling the magnetic anisotropy of Ni cluster supported on graphene flakes with topological defects
journal, July 2015

  • Sahoo, Sanjubala; Khanna, Shiv N.; Entel, Peter
  • Applied Physics Letters, Vol. 107, Issue 4
  • DOI: 10.1063/1.4927480

NiCu single atom alloys catalyze the C H bond activation in the selective non- oxidative ethanol dehydrogenation reaction
journal, June 2018


Highly Efficient Catalysis of Preferential Oxidation of CO in H 2 -Rich Stream by Gold Single-Atom Catalysts
journal, September 2015


A single iron site confined in a graphene matrix for the catalytic oxidation of benzene at room temperature
journal, December 2015


Single-Atom Pd 1 /Graphene Catalyst Achieved by Atomic Layer Deposition: Remarkable Performance in Selective Hydrogenation of 1,3-Butadiene
journal, August 2015

  • Yan, Huan; Cheng, Hao; Yi, Hong
  • Journal of the American Chemical Society, Vol. 137, Issue 33
  • DOI: 10.1021/jacs.5b06485

Effect of location and filling of d-states on methane activation in single site Fe-based catalysts
journal, September 2016


Single-atom Catalysis Using Pt/Graphene Achieved through Atomic Layer Deposition
journal, May 2013

  • Sun, Shuhui; Zhang, Gaixia; Gauquelin, Nicolas
  • Scientific Reports, Vol. 3, Issue 1
  • DOI: 10.1038/srep01775

CO oxidation catalyzed by Pt-embedded graphene: a first-principles investigation
journal, January 2014

  • Liu, Xin; Sui, Yanhui; Duan, Ting
  • Phys. Chem. Chem. Phys., Vol. 16, Issue 43
  • DOI: 10.1039/C4CP02106A

The rise of graphene
journal, March 2007

  • Geim, A. K.; Novoselov, K. S.
  • Nature Materials, Vol. 6, Issue 3, p. 183-191
  • DOI: 10.1038/nmat1849

A Comparative Study of Sulfur Poisoning and Regeneration of Precious-Metal Catalysts
journal, November 1998

  • Nasri, N. Shawal; Jones, Jenny M.; Dupont, Valerie A.
  • Energy & Fuels, Vol. 12, Issue 6
  • DOI: 10.1021/ef980104j

Poisoning of Pt/C catalysts by CO and its consequences over the kinetics of hydrogen chemisorption
journal, November 2009


Remarkable Performance of Ir 1 /FeO x Single-Atom Catalyst in Water Gas Shift Reaction
journal, October 2013

  • Lin, Jian; Wang, Aiqin; Qiao, Botao
  • Journal of the American Chemical Society, Vol. 135, Issue 41
  • DOI: 10.1021/ja408574m

Direct, Nonoxidative Conversion of Methane to Ethylene, Aromatics, and Hydrogen
journal, May 2014


First-principles study of metal adatom adsorption on graphene
journal, June 2008


Single Cobalt Atoms with Precise N-Coordination as Superior Oxygen Reduction Reaction Catalysts
journal, August 2016

  • Yin, Peiqun; Yao, Tao; Wu, Yuen
  • Angewandte Chemie International Edition, Vol. 55, Issue 36
  • DOI: 10.1002/anie.201604802

Pt/Cu single-atom alloys as coke-resistant catalysts for efficient C–H activation
journal, January 2018

  • Marcinkowski, Matthew D.; Darby, Matthew T.; Liu, Jilei
  • Nature Chemistry, Vol. 10, Issue 3
  • DOI: 10.1038/nchem.2915

Gas-phase activation of methane by ligated transition-metal cations
journal, October 2008

  • Schroder, D.; Schwarz, H.
  • Proceedings of the National Academy of Sciences, Vol. 105, Issue 47
  • DOI: 10.1073/pnas.0801849105

Aspects of Methane Chemistry
journal, June 1995