A research team has developed a 2D metal-organic framework (Cu₃(THT)₂) with copper-sulfur active sites for efficient CO₂ electroreduction to methane.
Cu₃(THT)₂ achieves a high Faradaic efficiency of 63.5% for methane production and shows remarkable stability during electrolysis.
Comparatively, the Cu-N₄ framework Cu₃(HITP)₂ exhibits inferior catalytic behavior and rapid structural decomposition under electrochemical conditions.
DFT calculations reveal the electronic differences between Cu-S₄ and Cu-N₄ sites and highlight the role of sulfur in enhancing catalytic activity.
Sulfur atoms facilitate S···O interactions with CO, optimizing CO binding strength and enabling efficient CO₂-to-CH₄ conversion.
Cu₃(THT)₂ demonstrates long-term catalytic stability and resistance to degradation issues, showcasing its potential for practical applications.
The study emphasizes the importance of sulfur coordination in CO₂ electroreduction catalysts for enhanced selectivity and efficiency.
By altering the catalyst microenvironment with sulfur, the study opens avenues for tailored electrocatalysts for sustainable chemical synthesis.
The research integrates experimental and theoretical approaches to advance renewable energy technologies and carbon-neutral cycles.
Overall, the study signifies a significant step in utilizing non-metallic heteroatoms to transform catalytic landscapes for sustainable energy solutions.
The work underscores the potential of conductive metal-organic frameworks with sulfur-coordinated copper sites in addressing global carbon recycling challenges.