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Mg-substituted Prussian blue as a low-strain cathode material for aqueous Fe-ion batteries.

Ge HuangZefeng LaoZe HeFangyu XiongShuangshuang TanMeng HuangGreta ThompsonQinyou AnLiqiang Mai
Published in: Chemical communications (Cambridge, England) (2023)
Aqueous Fe-ion batteries (FIBs) have gradually emerged in recent years due to their inherent merits. Herein, we constructed a Mg-substituted Prussian blue analogue (MgFeHCF) as cathode for FIBs, achieving higher capacity (96 mA h g -1 ) and better stability (70.9% capacity retention over 500 cycles). The Fe-ion storage mechanism was revealed using the in situ XRD technique and DFT calculations were employed to analyse the battery performance.
Keyphrases
  • ion batteries
  • molecular docking
  • density functional theory
  • metal organic framework
  • ionic liquid
  • molecular dynamics simulations
  • aqueous solution
  • molecular dynamics
  • light emitting