Journal of Nanotechnology / 2010 / Article / Fig 18

Review Article

Theoretical Studies of Substitutionally Doped Single-Walled Nanotubes

Figure 18

Optimized geometries of Pt-doped BNNT resulting from N-substitution (i.e., B45N44H20Pt) and B-substitution (i.e., B44N45H20Pt) and their relevant FMOs. Orbital energies are in parentheses [200]. Legend: pink = boron, navy blue = nitrogen, dark pink = platinum.
801789.fig.0018

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