Computational identification of bifunctional metal-modified ZSM-5 catalysts to boost methane–methanol coupling-Reference-Cited by-同舟云学术

Computational identification of bifunctional metal-modified ZSM-5 catalysts to boost methane–methanol coupling

Published:2022 Issue:24 Volume:12 Page:7328-7340
ISSN:2044-4753
Container-title:Catalysis Science & Technology
language:en
Short-container-title:Catal. Sci. Technol.

Author:

Sun Mengnan¹,Nie Xiaowa¹^ORCID,Zhang Xinwei²,Liu Sirui¹,Song Chunshan¹³,Guo Xinwen¹^ORCID

Affiliation:

1. State Key Laboratory of Fine Chemicals, Frontier Science Center for Smart Materials, PSU-DUT Joint Center for Energy Research, School of Chemical Engineering, Dalian University of Technology, Dalian 116024, China

2. Dalian Research Institute of Petroleum and Petrochemicals, SINOPEC, Dalian 116041, China

3. Department of Chemistry, Faculty of Science, The Chinese University of Hong Kong, Shatin, NT, Hong Kong, China

Abstract

Zn/ZSM-5 exhibits superior catalytic activity for reactant activation and C–C coupling in methane–methanol coupling revealed by DFT calculations. Introducing Co, Ni or Pd into Zn/ZSM-5 further promotes the reaction by reducing C–C coupling barriers.

Funder

Liaoning Revitalization Talents Program

Fundamental Research Funds for the Central Universities

Publisher

Royal Society of Chemistry (RSC)

Subject

Catalysis

Link

http://pubs.rsc.org/en/content/articlepdf/2022/CY/D2CY01758J

Reference62 articles.

1. Methane activation by ZSM-5-supported transition metal centers

2. Direct Conversion of Methane to Value-Added Chemicals over Heterogeneous Catalysts: Challenges and Prospects