Influence of uncoordinated N content on Ni N C electrocatalyst for CO2 reduction: Combining first principle with machine learning

An, Beibei; Yu, Guanyao; Li, Jinya; Li, Yuanyuan; Wang, Li; Zhang, Jinglai

doi:10.1016/j.fuel.2022.126563

Cited by 7 publications

(2 citation statements)

References 38 publications

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“…On the other hand, the contribution of uncoordinated nitrogen atoms is not included. According to the previous report, uncoordinated nitrogen atoms have a considerable influence on the overall catalytic performance. , …”

Section: Resultsmentioning

confidence: 99%

“…According to the previous report, uncoordinated nitrogen atoms have a considerable influence on the overall catalytic performance. 46,47 For Ni-BB-BD and Ni-BD, two new configurations, Ni− N4−N and Ni−N3C1−N, are used to involve the uncoordinated nitrogen species. The free energy diagrams of the CO 2 RR to CO and HER are recalculated on the basis of the new models and plotted in Figure 5, Tables S4 and S5.…”

Section: Mechanism Analysismentioning

confidence: 99%

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Fabrication of Nickel Single Atoms with Ionic Liquids by Only One-Step Pyrolysis for CO₂ Electroreduction

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Section: Resultsmentioning

confidence: 99%

Section: Mechanism Analysismentioning

confidence: 99%

Fabrication of Nickel Single Atoms with Ionic Liquids by Only One-Step Pyrolysis for CO₂ Electroreduction

Duan,

Wang,

et al. 2024

Inorg. Chem.

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Recent Progress on the Surface and Bulk Modification of Carbon Nitrides for Photocatalytic Carbon Dioxide Reduction

Ma,

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Wang

et al. 2024

Energy Tech

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Photocatalytic CO2 reduction has been considered as a green and sustainable approach to solve energy and environmental problems. However, the CO2 reduction efficiency of various types of semiconductor photocatalysts studied at this stage is far from realizing practical applications. The challenge of photocatalytic CO2 reduction is to design photocatalysts with excellent catalytic performance. This article summarizes the carbon nitride materials for efficient CO2 reduction and obtaining high value‐added products. The physicochemical properties of carbon nitride materials are discussed in terms of the photocatalytic mechanisms (bandgap tuning, high specific surface area, shorter electron–hole transmission paths, increasing the number of active sites, etc.). The present review provides the latest research progress of carbon nitride modification strategies. The prospects and challenges for the application of carbon nitride materials for CO2 reduction are presented. This review article will provide useful guidance for further research on carbon nitride materials for efficient photocatalytic CO2 reduction.

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Machine learning accelerates the screening of single-atom catalysts towards CO2 electroreduction

Shi,

Liang

2024

Applied Catalysis A: General

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Influence of uncoordinated N content on Ni N C electrocatalyst for CO2 reduction: Combining first principle with machine learning

Cited by 7 publications

References 38 publications

Fabrication of Nickel Single Atoms with Ionic Liquids by Only One-Step Pyrolysis for CO₂ Electroreduction

Fabrication of Nickel Single Atoms with Ionic Liquids by Only One-Step Pyrolysis for CO₂ Electroreduction

Recent Progress on the Surface and Bulk Modification of Carbon Nitrides for Photocatalytic Carbon Dioxide Reduction

Machine learning accelerates the screening of single-atom catalysts towards CO2 electroreduction

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Influence of uncoordinated N content on Ni N C electrocatalyst for CO2 reduction: Combining first principle with machine learning

Cited by 7 publications

References 38 publications

Fabrication of Nickel Single Atoms with Ionic Liquids by Only One-Step Pyrolysis for CO2 Electroreduction

Fabrication of Nickel Single Atoms with Ionic Liquids by Only One-Step Pyrolysis for CO2 Electroreduction

Recent Progress on the Surface and Bulk Modification of Carbon Nitrides for Photocatalytic Carbon Dioxide Reduction

Machine learning accelerates the screening of single-atom catalysts towards CO2 electroreduction

Contact Info

Product

Resources

About

Fabrication of Nickel Single Atoms with Ionic Liquids by Only One-Step Pyrolysis for CO₂ Electroreduction

Fabrication of Nickel Single Atoms with Ionic Liquids by Only One-Step Pyrolysis for CO₂ Electroreduction