Electronic structure and second-order polarizability of benzodithiapolyenals

F. Meyers; J. Zyss; J. L. Brédas

doi:10.1016/0379-6779(91)91265-C

Electronic structure and second-order polarizability of benzodithiapolyenals

F. Meyers^*, J. Zyss, J. L. Brédas

^*Corresponding author for this work

Research output: Contribution to journal › Article › peer-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 language	English (US)
Pages (from-to)	3191-3194
Number of pages	4
Journal	Synthetic Metals
Volume	43
Issue number	1-2
DOIs	https://doi.org/10.1016/0379-6779(91)91265-C
State	Published - Jun 7 1991
Externally published	Yes

ASJC Scopus subject areas

Electronic, Optical and Magnetic Materials
Condensed Matter Physics
Mechanics of Materials
Mechanical Engineering
Metals and Alloys
Materials Chemistry

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10.1016/0379-6779(91)91265-C

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title = "Electronic structure and second-order polarizability of benzodithiapolyenals",

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.",

author = "F. Meyers and J. Zyss and Br{\'e}das, {J. L.}",

year = "1991",

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T1 - Electronic structure and second-order polarizability of benzodithiapolyenals

AU - Meyers, F.

AU - Zyss, J.

AU - Brédas, J. L.

PY - 1991/6/7

Y1 - 1991/6/7

N2 - 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.

AB - 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.

UR - http://www.scopus.com/inward/record.url?scp=0026418779&partnerID=8YFLogxK

U2 - 10.1016/0379-6779(91)91265-C

DO - 10.1016/0379-6779(91)91265-C

M3 - Article

AN - SCOPUS:0026418779

SN - 0379-6779

VL - 43

SP - 3191

EP - 3194

JO - Synthetic Metals

JF - Synthetic Metals

IS - 1-2

ER -

Electronic structure and second-order polarizability of benzodithiapolyenals

Abstract

ASJC Scopus subject areas

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