Energy-band structure of poly

The energy band structures of poly(methylphenylsilane) are shown in Figure 12. The original skeleton band gap is 3.6 eV, and the polymer also yields a direct-type band structure. The characteristic features of this elec-... 

Figure 12. Calculated energy band structure of poly(methylphenylsihm). Abbreviations and symbols are defined as follows CB, conduction band LU, lowest unoccupied molecular orbital VB, valence band HO, highest occupied molecular orbital F, k = 0 point and X, Brillouin zone edge. Bu, A, Bg, b2g, 62u, and eig denote orbital symmetries.

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See also in sourсe #XX -- [ , , ]

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