Particle-in-a-bos model of one-dimensional excitons in conjugated polymers

Citation
Tg. Pedersen et al., Particle-in-a-bos model of one-dimensional excitons in conjugated polymers, PHYS REV B, 61(15), 2000, pp. 10504-10510
Citations number
17
Categorie Soggetti
Apllied Physucs/Condensed Matter/Materiales Science
Journal title
PHYSICAL REVIEW B
ISSN journal
10980121 → ACNP
Volume
61
Issue
15
Year of publication
2000
Pages
10504 - 10510
Database
ISI
SICI code
1098-0121(20000415)61:15<10504:PMOOEI>2.0.ZU;2-F
Abstract
A simple two-particle model of excitons in conjugated polymers is proposed as an alternative to usual highly computationally demanding quantum chemica l methods. In the two-particle model, the exciton is described as an electr on-hole pair interacting via Coulomb forces and confined to the polymer bac kbone by rigid walls. Furthermore, by integrating out the transverse part, the two-particle equation is reduced to one-dimensional form. It is demonst rated how essentially exact solutions are obtained in the cases of short an d long conjugation length, respectively. From a linear combination of these cases an approximate solution for the general case is obtained. As an appl ication of the model the influence of a static electric field on the electr on-hole overlap integral and exciton energy is considered.