To
improve the photocatalytic efficiency of the N2 reduction
reaction, MXene quantum dots (Ti3C2-QDs) and
two-dimensional (2D) nickel metal–organic framework (Ni-MOF)
with different ratios were fabricated by a simple self-assembly strategy
to form type II heterojunctions. The resultant composites showed enhanced
absorption and excellent interfacial charge-transfer capabilities
according to the optical and photoelectron properties. The optimal
Ti3C2-QD/Ni-MOF heterostructure exhibited a
considerable ammonia yield rate (88.79 μmol gcat
–1 h–1). By means of X-ray absorption near-edge fine structure (XANES)
technique, it was found that the interaction of Ti3C2-QD and Ni-MOF could accelerate the electron transfer, and
Ni site would be the main area to enrich the electron density as well
as adsorb and activate N2. Finally, with the aid of density
functional theory (DFT) calculations and in situ Fourier
transform infrared spectrometry (FTIR), the reaction pathway and intermediate
products were studied.
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