Electronic structure and second-order polarizability of benzodithiapolyenals

F. Meyers*, J. Zyss, J. L. Brédas

*Corresponding author for this work

Research output: Contribution to journalArticlepeer-review

4 Scopus citations

Abstract

The electronic structure and second-order polarizability, β, are calculated at the ab initio level for two series of novel push-pull polyene molecules, benzodithiapolyenals and dithiolylidenepolyenals. The benzodithiapolyenal molecules have recently been reported to present among the largest μ.β values ever measured. The theoretical results allow for an in-depth understanding of the properties of these compounds.

Original languageEnglish (US)
Pages (from-to)3191-3194
Number of pages4
JournalSynthetic Metals
Volume43
Issue number1-2
DOIs
StatePublished - Jun 7 1991
Externally publishedYes

ASJC Scopus subject areas

  • Electronic, Optical and Magnetic Materials
  • Materials Chemistry
  • Polymers and Plastics

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