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- W2810270534 abstract "Electrocatalytic nitrogen reduction reaction (NRR) under ambient conditions provides an intriguing picture for the conversion of N2 into NH3 . However, electrocatalytic NRR mainly relies on metal-based catalysts, and it remains a grand challenge in enabling effective N2 activation on metal-free catalysts. Here we report a defect engineering strategy to realize effective NRR performance (NH3 yield: 8.09 μg h-1 mg-1cat. , Faradaic efficiency: 11.59 %) on metal-free polymeric carbon nitride (PCN) catalyst. Illustrated by density functional theory calculations, dinitrogen molecule can be chemisorbed on as-engineered nitrogen vacancies of PCN through constructing a dinuclear end-on bound structure for spatial electron transfer. Furthermore, the N-N bond length of adsorbed N2 increases dramatically, which corresponds to strong activation system to reduce N2 into NH3 . This work also highlights the significance of defect engineering for improving electrocatalysts with weak N2 adsorption and activation ability." @default.
- W2810270534 created "2018-07-10" @default.
- W2810270534 creator A5016796831 @default.
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- W2810270534 date "2018-07-15" @default.
- W2810270534 modified "2023-10-10" @default.
- W2810270534 title "Defect Engineering Metal‐Free Polymeric Carbon Nitride Electrocatalyst for Effective Nitrogen Fixation under Ambient Conditions" @default.
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- W2810270534 doi "https://doi.org/10.1002/anie.201806386" @default.
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