Journal of Nanotechnology / 2010 / Article / Fig 13

Review Article

Theoretical Studies of Substitutionally Doped Single-Walled Nanotubes

Figure 13

Optimized geometries, DOS, and LDOS of (a) C170 with ๐ท 5 โ„Ž symmetry ( ๐œ€ H O M O = โˆ’ 4 . 6 1 โ€‰eV, ๐œ€ L U M O = โˆ’ 4 . 2 6 โ€‰eV), (b) C169Pt(ce) with ๐ถ ๐‘  symmetry ( ๐œ€ H O M O = โˆ’ 4 . 5 1 โ€‰eV, ๐œ€ L U M O = โˆ’ 4 . 2 1 โ€‰eV), (c) C169Pt(c) with Cs symmetry ( ๐œ€ H O M O = โˆ’ 4 . 4 8 โ€‰eV, ๐œ€ L U M O = โˆ’ 4 . 2 5 โ€‰eV), and (d) C169Pt(w) with Cs symmetry ( ๐œ€ H O M O = โˆ’ 4 . 4 6 โ€‰โ€‰eV, ๐œ€ L U M O = โˆ’ 4 . 2 6 โ€‰eV). L1โˆ’L9 are the LDOS for each specified layer of atoms as marked on the diagram [35, 36].
801789.fig.0013a
(a) DOS of C170
801789.fig.0013b
(b) DOS of C169Pt(ce)
801789.fig.0013c
(c) DOS of C169Pt(c)
801789.fig.0013d
(d) DOS of C169Pt(w)

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