Constant-potential DFT insights into CO 2 electroreduction on Fe 3 and Cu 3 clusters supported by N-doped graphene
Abstract
Fe 3 @NG enables deep reduction toward CH 4 , while Cu 3 @NG is limited by CO hydrogenation.
Fields of Study & Subjects
CO2 Reduction Techniques and Catalysts
Ammonia Synthesis and Nitrogen Reduction
Electrocatalysts for Energy Conversion
Publication details
- Journal / source
- Chemical Communications
- Publisher
- Royal Society of Chemistry (RSC)
- Volume
- 62
- Issue
- 35
- Pages
- 8915–8918
- Publication date
- 1 January 2026
- Language
- EN