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Hybrid nanoarrays of Cu-MOFs@H-substituted graphdiyne with various levels of Lewis acidity for nitrate electroreduction.

Jiahao MaRu WangBiwen WangJiaxin LuoQiu-Yu ZhangSifei Zhuo
Published in: Chemical communications (Cambridge, England) (2023)
To mimic enzymes in nature, a set of hybrid nanoarrays of Cu-MOFs sealed in hydrogen-substituted graphdiyne has been developed in order to serve as Lewis-acid-promoted catalysts. By regulating the electron-withdrawing capability of the ligands bridging Cu 2+ sites, these Cu-MOFs provided different levels of Lewis acidity toward nitrate affinity, a feature crucial for nitrate-to-ammonia conversion.
Keyphrases
  • metal organic framework
  • nitric oxide
  • drinking water
  • aqueous solution
  • molecular docking
  • machine learning
  • deep learning
  • anaerobic digestion
  • molecular dynamics simulations
  • transition metal