Catalytic role of graphitic nitrogen atoms in the CO oxidation reaction over N-containing graphene: a first-principles mechanistic evaluation-Reference-Cited by-同舟云学术

Catalytic role of graphitic nitrogen atoms in the CO oxidation reaction over N-containing graphene: a first-principles mechanistic evaluation

Published:2021 Issue:31 Volume:45 Page:13822-13832
ISSN:1144-0546
Container-title:New Journal of Chemistry
language:en
Short-container-title:New J. Chem.

Author:

Esrafili Mehdi D.¹²³^ORCID,Mousavian Parisasadat¹²³⁴⁵

Affiliation:

1. Department of Chemistry, Faculty of Basic Sciences, University of Maragheh

2. Maragheh

3. Iran

4. Department of Chemistry, Azarbaijan Shahid Madani University

5. Tabriz

Abstract

The catalytic role of graphitic nitrogen atoms of a series of nitrogen-doped graphene surfaces is explored for low-temperature oxidation of CO using periodic DFT calculations.

Publisher

Royal Society of Chemistry (RSC)

Subject

Materials Chemistry,General Chemistry,Catalysis

Link

http://pubs.rsc.org/en/content/articlepdf/2021/NJ/D1NJ01867A

Reference84 articles.

1. Human health effects of air pollution

2. A. C. Stern , Fundamentals of Air Pollution , Elsevier , 2014

3. Identification of Active Gold Nanoclusters on Iron Oxide Supports for CO Oxidation

4. A Review on CO Oxidation Over Copper Chromite Catalyst

5. Graphyne-supported single Fe atom catalysts for CO oxidation

Cited by 3 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. N-doped hollow carbon nanospheres embedded in N-doped graphene loaded with palladium nanoparticles as an efficient electrocatalyst for formic acid oxidation;New Carbon Materials;2024-04

2. Graphene-based catalysts for carbon monoxide oxidation: Experimental and theoretical insights;International Journal of Hydrogen Energy;2023-05

3. Catalytic CO oxidation reaction over N-substituted graphene nanoribbon with edge defects;Journal of Molecular Graphics and Modelling;2021-11