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Wavelength-dependent HER mechanism for COK-47. Upon visible photoexcitation, electrons go from the ligand to the metal SBU, activating an LMCT. Upon UV photoexcitation, electrons are excited from O atoms in the SBU, making recombination processes (red dashed arrow) more likely due to the nearly located electrons and holes. Color code: C, grey; Ti, blue; O, red.
#Workflow#Illustration#Chemical Structure#HER Mechanism#COK-47#Photoexcitation#Ligand to Metal Charge Transfer#LMCT#Recombination#Metal-Organic Framework#MOF
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