Excited States of Ladder-type Poly-p-phenylene Oligomers

Details Excited States of Ladder-type Poly-p-phenylene Oligomers Excited States of Ladder-type Poly-p-phenylene Oligomers

2001-03-15

arxiv.org/abs/cond-mat/0103320v1

Phys. Rev. B, 64 (2001) 045122

Physics

Condensed Matter

24 pages, 21 figures

Scientific paper

10.1103/PhysRevB.64.045122

Ground state properties and excited states of ladder-type paraphenylene oligomers are calculated applying semiempirical methods for up to eleven phenylene rings. The results are in qualitative agreement with experimental data. A new scheme to interpret the excited states is developed which reveals the excitonic nature of the excited states. The electron-hole pair of the S1-state has a mean distance of approximately 4 Angstroem.

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