Insight into C + O(OH) reaction for carbon elimination on different types of CoNi(111) surfaces: a DFT study-Reference-Cited by-同舟云学术

Insight into C + O(OH) reaction for carbon elimination on different types of CoNi(111) surfaces: a DFT study

Published:2015 Issue:26 Volume:5 Page:19970-19982
ISSN:2046-2069
Container-title:RSC Advances
language:en
Short-container-title:RSC Adv.

Author:

Guo Xiaoqiang¹²³⁴,Liu Hongyan⁵⁶⁷⁴,Wang Baojun¹²³⁴,Wang Qiang⁸⁹¹⁰¹¹⁴,Zhang Riguang¹²³⁴

Affiliation:

1. Key Laboratory of Coal Science and Technology of Ministry of Education and Shanxi Province

2. Taiyuan University of Technology

3. Taiyuan 030024

4. P.R. China

5. College of Chemistry and Environment Engineering

6. Shanxi Datong University

7. Datong

8. State Key Laboratory of Coal Conversion

9. Institute of Coal Chemistry

10. Chinese Academy of Sciences

11. Taiyuan 030001

Abstract

A density-functional theory (DFT) method has been performed to investigate the reaction of C + O(OH) on three types of bimetallic alloy CoNi(111) surface, and the obtained results are compared with those on the pure Ni(111) surface.

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemical Engineering,General Chemistry

Link

http://pubs.rsc.org/en/content/articlepdf/2015/RA/C4RA15555F

Reference53 articles.

1. Catalytic Technology for Carbon Dioxide Reforming of Methane to Synthesis Gas

2. CO2Reforming of CH4

3. Coke Formation over a Nickel Catalyst under Methane Dry Reforming Conditions: Thermodynamic and Kinetic Models

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5. Carbon dioxide reforming of methane over Ni/Al2O3 treated with glow discharge plasma

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