Login / Signup

The 3d-4f electron transition of the CoS 2 /CeO 2 heterojunction for efficient oxygen evolution.

Yaqin ChenYuchao ZhangHui XueJing SunNiankun GuoTianshan SongJiawen SunYi-Ru HaoQin Wang
Published in: Chemical communications (Cambridge, England) (2024)
CoS 2 /CeO 2 , exhibiting the 3d-4f orbital coupling effect, is developed and shows exceptional OER activity, with an overpotential of 140 mV at 10 mA cm -2 . DFT calculation and Raman spectra show the existence of a d-p-f electron transport ladder that can accelerate electron transfer through the Co-O(S)-Ce bond, optimize the adsorption free energy, and enhance the catalytic activity.
Keyphrases
  • electron transfer
  • density functional theory
  • solar cells
  • molecular docking
  • aqueous solution
  • molecular dynamics
  • crystal structure
  • visible light
  • perovskite solar cells