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Cooperation of Different Active Sites to Promote CO 2 Electroreduction to Multi-carbon Products at Ampere-Level.

Dawei ZhouChunjun ChenYichi ZhangMin WangShitao HanXue DongTing YaoShuaiqiang JiaMingyuan HeHaihong WuHuizhen Liu
Published in: Angewandte Chemie (International ed. in English) (2024)
Electroreduction of CO 2 to C 2+ products provides a promising strategy for reaching the goal of carbon neutrality. However, achieving high selectivity of C 2+ products at high current density remains a challenge. In this work, we designed and prepared a multi-sites catalyst, in which Pd was atomically dispersed in Cu (Pd-Cu). It was found that the Pd-Cu catalyst had excellent performance for producing C 2+ products from CO 2 electroreduction. The Faradaic efficiency (FE) of C 2+ products could be maintained at approximately 80.8 %, even at a high current density of 0.8 A cm -2 for at least 20 hours. In addition, the FE of C 2+ products was above 70 % at 1.4 A cm -2 . Experiments and density functional theory (DFT) calculations revealed that the catalyst had three distinct catalytic sites. These three active sites allowed for efficient conversion of CO 2 , water dissociation, and CO conversion, ultimately leading to high yields of C 2+ products.
Keyphrases
  • density functional theory
  • metal organic framework
  • room temperature
  • molecular dynamics
  • carbon dioxide
  • visible light
  • molecular docking
  • crystal structure