Self-trapping of positive polarons upon evolution from leucoemeraldine to pernigraniline: A theoretical study

J. Libert; J. L. Brédas

doi:10.1016/0379-6779(94)02383-A

Self-trapping of positive polarons upon evolution from leucoemeraldine to pernigraniline: A theoretical study

J. Libert^*, J. L. Brédas

^*Corresponding author for this work

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

11 Scopus citations

Abstract

We investigate theoretically the geometry and charge distribution in three singly oxidized oligomers representative of leucoelmeraldine, emeraldine, and pernigraniline. We analyze the influence of both torsion-angle and chemical-structure aspects on the self-trapping of the induced polarons.

Original language	English (US)
Pages (from-to)	121-122
Number of pages	2
Journal	Synthetic Metals
Volume	69
Issue number	1-3
DOIs	https://doi.org/10.1016/0379-6779(94)02383-A
State	Published - Mar 1 1995
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(94)02383-A

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title = "Self-trapping of positive polarons upon evolution from leucoemeraldine to pernigraniline: A theoretical study",

abstract = "We investigate theoretically the geometry and charge distribution in three singly oxidized oligomers representative of leucoelmeraldine, emeraldine, and pernigraniline. We analyze the influence of both torsion-angle and chemical-structure aspects on the self-trapping of the induced polarons.",

author = "J. Libert and Br{\'e}das, {J. L.}",

year = "1995",

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doi = "10.1016/0379-6779(94)02383-A",

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T1 - Self-trapping of positive polarons upon evolution from leucoemeraldine to pernigraniline

T2 - A theoretical study

AU - Libert, J.

AU - Brédas, J. L.

PY - 1995/3/1

Y1 - 1995/3/1

N2 - We investigate theoretically the geometry and charge distribution in three singly oxidized oligomers representative of leucoelmeraldine, emeraldine, and pernigraniline. We analyze the influence of both torsion-angle and chemical-structure aspects on the self-trapping of the induced polarons.

AB - We investigate theoretically the geometry and charge distribution in three singly oxidized oligomers representative of leucoelmeraldine, emeraldine, and pernigraniline. We analyze the influence of both torsion-angle and chemical-structure aspects on the self-trapping of the induced polarons.

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U2 - 10.1016/0379-6779(94)02383-A

DO - 10.1016/0379-6779(94)02383-A

M3 - Article

AN - SCOPUS:0029271572

SN - 0379-6779

VL - 69

SP - 121

EP - 122

JO - Synthetic Metals

JF - Synthetic Metals

IS - 1-3

ER -

Self-trapping of positive polarons upon evolution from leucoemeraldine to pernigraniline: A theoretical study

Abstract

ASJC Scopus subject areas

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