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fig7

From:  Superior single-atom and single-cluster catalysts towards electrocatalytic nitrogen reduction reactions: a theoretical perspective
Superior single-atom and single-cluster catalysts towards electrocatalytic nitrogen reduction reactions: a theoretical perspective

Figure 7. (A) Free energy profiles and the optimized geometries of reaction intermediates for the NRR on B3@GDY. Reprinted with permission from Ref.[111]. Copyright © 2023 Wiley-VCH GmbH; (B) Free energy profiles for the NRR on B2@C3N4. Reprinted with permission from Ref.[112]. Copyright © 2022 by the authors. NRR: Nitrogen reduction reaction; GDY: graphdiyne.

Journal of Materials Informatics
ISSN 2770-372X (Online)
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