Electronic structure of chain-like polystannane

Kyozaburo Takeda; Kenji Shiraishi

doi:10.1016/0009-2614(92)86123-Y

Electronic structure of chain-like polystannane

Kyozaburo Takeda^*, Kenji Shiraishi

^*Corresponding author for this work

Research output: Contribution to journal › Article › peer-review

31 Citations (Scopus)

Abstract

The electronic structure of polystannane (PSn), (SnH₂)_n, has been calculated by the first principle local density functional method. The effect of bond-angle distortion on PSn's first band gap is also investigated theoretically. The common features in the group IV polymers are then summarized by comparison with previous calculated results for polysilane (SiH₂)_n and polygermane (GeH₂)_n.

Original language	English
Pages (from-to)	121-126
Number of pages	6
Journal	Chemical Physics Letters
Volume	195
Issue number	2-3
DOIs	https://doi.org/10.1016/0009-2614(92)86123-Y
Publication status	Published - 1992 Jul 17
Externally published	Yes

ASJC Scopus subject areas

Physics and Astronomy(all)
Physical and Theoretical Chemistry

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10.1016/0009-2614(92)86123-Y

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title = "Electronic structure of chain-like polystannane",

abstract = "The electronic structure of polystannane (PSn), (SnH2)n, has been calculated by the first principle local density functional method. The effect of bond-angle distortion on PSn's first band gap is also investigated theoretically. The common features in the group IV polymers are then summarized by comparison with previous calculated results for polysilane (SiH2)n and polygermane (GeH2)n.",

author = "Kyozaburo Takeda and Kenji Shiraishi",

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AU - Shiraishi, Kenji

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AB - The electronic structure of polystannane (PSn), (SnH2)n, has been calculated by the first principle local density functional method. The effect of bond-angle distortion on PSn's first band gap is also investigated theoretically. The common features in the group IV polymers are then summarized by comparison with previous calculated results for polysilane (SiH2)n and polygermane (GeH2)n.

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Electronic structure of chain-like polystannane

Abstract

ASJC Scopus subject areas

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