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. 2023 Jun 1;11:1172687. doi: 10.3389/fchem.2023.1172687

FIGURE 4.

FIGURE 4

Free energy reaction profile, at 1200 K, of the dehydrogenation on H-passivated (A) zigzag edges and (B) armchair edges. (C) Depiction of the stationary point located in the reaction mechanisms and their respective labels. Reaction coordinate is in arbitrary units.