Rational design of metal node-modified Ti-based MOFs for selective photoreduction of carbon dioxide to ethanol by computational screening
DFT calculations were used to screen and design highly efficient metal node-modified Ti-based MOFs for CO 2 photo-reduction to C 2 products. Ti(Nb)-ATA was identified as the most active and selective catalyst for CO 2 reduction to ethanol.
Authors
- Xiaowa Nie (ORCID: https://orcid.org/0000-0002-9937-5456)
- Shuang Wang (ORCID: https://orcid.org/0000-0003-3768-1359)
- Chunshan Song (ORCID: https://orcid.org/0000-0003-2344-9911)
- Xinwen Guo (ORCID: https://orcid.org/0000-0002-6597-4979)
Institutions
- Chinese University of Hong Kong (HK)
- Dalian University of Technology (CN)
Publication Details
- Journal
- Journal of Materials Chemistry A
- Published
- 2025-01-01
- DOI
- https://doi.org/10.1039/d5ta03415a
- Citations
- 1
- Primary Topic
- Gas Sensing Nanomaterials and Sensors
- Type
- article
- Field-Weighted Citation Impact
- 0.73
Funders
- National Natural Science Foundation of China
- Dalian University of Technology
- Liaoning Revitalization Talents Program
- Fundamental Research Funds for the Central Universities