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• W3207911150 endingPage "23521" @default.
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• W3207911150 abstract "By using the explicit solvent model, we demonstrated that the axial O atom could enhance the catalytic performance of NiN 4 single-atom catalysts by facilitating CO 2 activation with enhanced electron transfer and stabilizing effect." @default.
• W3207911150 created "2021-10-25" @default.
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• W3207911150 date "2021-01-01" @default.
• W3207911150 modified "2023-10-01" @default.
• W3207911150 title "Understanding the role of axial O in CO₂ electroreduction on NiN₄ single-atom catalysts <i>via</i> simulations in realistic electrochemical environment" @default.
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• W3207911150 doi "https://doi.org/10.1039/d1ta07791k" @default.
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