Table S2 Charge density of atoms in N-rGO and rGO model N and C atoms N-rGO rGO -0.21 - α Pyridinic N and the C1 0.08 1.03 adjacent C atoms C2 -0.22 -0.41 -0.21 - β1 C3 -0.08 0.79 Pyrrolic N and the C4 -0.24 0.79 adjacent C atoms -0.21 - β2 C5 -0.16 0.79 C6 -0.03 0.79 0.10 - γ1 C7 0.39 0.004 C8 0.20 0.004 Graphitic N and C9 0.19 0.11 the adjacent C -0.02 - γ2 C10 0.06 0.004 C11 0.15 -0.36 C12 0.98 0.60
Table S2 Charge density of atoms in N-rGO and rGO model N and C atoms N-rGO rGO Pyridinic N and the adjacent C atoms α -0.21 - C1 0.08 1.03 C2 -0.22 -0.41 Pyrrolic N and the adjacent C atoms β1 -0.21 - C3 -0.08 0.79 C4 -0.24 0.79 β2 -0.21 - C5 -0.16 0.79 C6 -0.03 0.79 Graphitic N and the adjacent C γ1 0.10 - C7 0.39 0.004 C8 0.20 0.004 C9 0.19 0.11 γ2 -0.02 - C10 0.06 0.004 C11 0.15 -0.36 C12 0.98 0.60
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