Unveiling the role of dopant electronegativity in improving the catalytic performance of MXene catalysts in propane dehydrogenation using microkinetic simulations
The electronegativity of metal dopants for MXenes catalyst effectively regulate both reaction barrier and TOF of propene formation.
Authors
- Huijie Wang (ORCID: https://orcid.org/0000-0001-8954-9857)
- Xiaoying Sun (ORCID: https://orcid.org/0000-0002-9110-9444)
- Bo Li (ORCID: https://orcid.org/0000-0001-8895-2054)
- Yuqing Tang (ORCID: https://orcid.org/0009-0009-1043-4914)
- Aqsa Abid (ORCID: https://orcid.org/0009-0005-7664-9572)
Institutions
- University of Science and Technology of China (CN)
- Chinese Academy of Sciences (CN)
- Shenyang Normal University (CN)
Publication Details
- Journal
- Journal of Materials Chemistry A
- Published
- 2025-01-01
- DOI
- https://doi.org/10.1039/d5ta03869c
- Citations
- 3
- Primary Topic
- Ammonia Synthesis and Nitrogen Reduction
- Type
- article
- Field-Weighted Citation Impact
- 1.17