Dynamics of carbon monoxide dissociation on Co(112̄0)-Reference-Cited by-同舟云学术

Dynamics of carbon monoxide dissociation on Co(112̄0)

Published:2017 Issue:20 Volume:19 Page:12826-12837
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Hu Xixi¹²³⁴⁵^ORCID,Zhou Yipeng¹²³⁴⁵,Jiang Bin⁶⁷⁸⁹^ORCID,Guo Hua¹⁰¹¹¹²¹³,Xie Daiqian¹²³⁴⁵^ORCID

Affiliation:

1. Institute of Theoretical and Computational Chemistry

2. Key Laboratory of Mesoscopic Chemistry

3. School of Chemistry and Chemical Engineering

4. Nanjing University

5. Nanjing 210093

6. Department of Chemical Physics

7. University of Science and Technology of China

8. Hefei 230026

9. China

10. Department of Chemistry and Chemical Biology

11. University of New Mexico

12. Albuquerque

13. USA

Abstract

The dissociative chemisorption dynamics of CO on rigid Co(112̄0) is investigated using a quasi-classical trajectory method on a new global six-dimensional potential energy surface.

Funder

Ministry of Science and Technology of the People's Republic of China

National Natural Science Foundation of China

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2017/CP/C7CP01697B

Reference82 articles.

1. Design, synthesis, and use of cobalt-based Fischer-Tropsch synthesis catalysts

2. Advances in the Development of Novel Cobalt Fischer−Tropsch Catalysts for Synthesis of Long-Chain Hydrocarbons and Clean Fuels

3. Hydrogen chemisorption and the carbon monoxide-hydrogen interaction on cobalt (0001)

4. The interaction of hydrogen with a cobalt(101̄0) surface

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