Role of magnetization on catalytic pathways of non-oxidative methane activation on neutral iron carbide clusters-Reference-Cited by-同舟云学术

Role of magnetization on catalytic pathways of non-oxidative methane activation on neutral iron carbide clusters

Published:2022 Issue:19 Volume:24 Page:11668-11679
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Kumar Manish¹^ORCID,Dar Manzoor Ahmad¹²^ORCID,Katiyar Ankita¹,Agrawal Ravi³,Shenai Prathamesh M.³,Srinivasan Varadharajan¹^ORCID

Affiliation:

1. Department of Chemistry, Indian Institute of Science Education and Research Bhopal, Bhopal 462 066, India

2. Department of Chemistry, Islamic University of Science and Technology, Awantipora, Jammu and Kashmir 192122, India

3. Shell India Markets Pvt. Ltd., Bangalore 562149, India

Abstract

We explore the potential of neutral iron carbide clusters as alternative catalysts for thermocatalytic methane activation. Spin-crossovers along the reaction paths reduce activation barriers and the energy of methyl radical evolution suggesting external tunability of methane activation on these catalysts.

Funder

Indian Institute of Science Education and Research Bhopal

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2022/CP/D1CP05769C

Reference43 articles.

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