Skeleton side-group interaction in organopolysilane

Kyozaburo Takeda, Masaie Fujino, Kazuhiko Seki, Hiroo Inokuchi

Research output: Contribution to journalArticle

52 Citations (Scopus)

Abstract

The skeleton <̂>side-group interaction due to <̂>-<̂ mixing in organopolysilane <>(SiXY)n <> where X and Y are methyl (Me) and phenyl (<>) groups, has been theoretically investigated. The results are discussed on the basis of uv photoemission experiments. The <>-<> interaction at the valence-band edge produces not only the delocalized <> states along the Si skeleton, but also the localized <> states in the individual <> side groups. On the other hand, the <>*-<>* interaction at the conduction-band edge is inhibited owing to the orbital symmetry. This paper also presents the results of theoretical investigations on the influence of side-group substitution and of <>side-group rotation on the electron distribution along the Si skeleton.

Original languageEnglish
Pages (from-to)8129-8137
Number of pages9
JournalPhysical Review B
Volume36
Issue number15
DOIs
Publication statusPublished - 1987 Jan 1
Externally publishedYes

ASJC Scopus subject areas

  • Condensed Matter Physics

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