Solid-state supramolecular organization of polythiophene chains containing thienothiophene units

Patrick Brocorens; Antoine Van Vooren; Michael L. Chabinyc; Michael F. Toney; Maxim Shkunov; Martin Heeney; Iain Mcculloch; Jérôme Cornil; Roberto Lazzaroni

doi:10.1002/adma.200801668

Solid-state supramolecular organization of polythiophene chains containing thienothiophene units

Patrick Brocorens^*, Antoine Van Vooren, Michael L. Chabinyc, Michael F. Toney, Maxim Shkunov, Martin Heeney, Iain Mcculloch, Jérôme Cornil, Roberto Lazzaroni

^*Corresponding author for this work

Physical Science and Engineering

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

62 Scopus citations

Abstract

We use molecular modeling and the simulation of X-ray diffraction patterns to determine the molecular packing of a thiophene-based polymer showing exceptionally high field-effect mobilities (up to 1 cm² V ^-1 s^-1). We focus on the organization of the polymer chains in lamellae and the orientation of these crystalline domains with respect to the substrate in thin films. The analysis is supported by XRD and NEXAFS experiments and is complemented by calculating intermolecular transfer integrals, which govern the charge mobility.

Original language	English (US)
Pages (from-to)	1193-1198
Number of pages	6
Journal	Advanced Materials
Volume	21
Issue number	10-11
DOIs	https://doi.org/10.1002/adma.200801668
State	Published - Mar 20 2009

ASJC Scopus subject areas

Materials Science(all)
Mechanics of Materials
Mechanical Engineering

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title = "Solid-state supramolecular organization of polythiophene chains containing thienothiophene units",

abstract = "We use molecular modeling and the simulation of X-ray diffraction patterns to determine the molecular packing of a thiophene-based polymer showing exceptionally high field-effect mobilities (up to 1 cm2 V -1 s-1). We focus on the organization of the polymer chains in lamellae and the orientation of these crystalline domains with respect to the substrate in thin films. The analysis is supported by XRD and NEXAFS experiments and is complemented by calculating intermolecular transfer integrals, which govern the charge mobility.",

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Solid-state supramolecular organization of polythiophene chains containing thienothiophene units. / Brocorens, Patrick; Van Vooren, Antoine; Chabinyc, Michael L.; Toney, Michael F.; Shkunov, Maxim; Heeney, Martin; Mcculloch, Iain; Cornil, Jérôme; Lazzaroni, Roberto.

In: Advanced Materials, Vol. 21, No. 10-11, 20.03.2009, p. 1193-1198.

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

TY - JOUR

T1 - Solid-state supramolecular organization of polythiophene chains containing thienothiophene units

AU - Brocorens, Patrick

AU - Van Vooren, Antoine

AU - Chabinyc, Michael L.

AU - Toney, Michael F.

AU - Shkunov, Maxim

AU - Heeney, Martin

AU - Mcculloch, Iain

AU - Cornil, Jérôme

AU - Lazzaroni, Roberto

PY - 2009/3/20

Y1 - 2009/3/20

N2 - We use molecular modeling and the simulation of X-ray diffraction patterns to determine the molecular packing of a thiophene-based polymer showing exceptionally high field-effect mobilities (up to 1 cm2 V -1 s-1). We focus on the organization of the polymer chains in lamellae and the orientation of these crystalline domains with respect to the substrate in thin films. The analysis is supported by XRD and NEXAFS experiments and is complemented by calculating intermolecular transfer integrals, which govern the charge mobility.

AB - We use molecular modeling and the simulation of X-ray diffraction patterns to determine the molecular packing of a thiophene-based polymer showing exceptionally high field-effect mobilities (up to 1 cm2 V -1 s-1). We focus on the organization of the polymer chains in lamellae and the orientation of these crystalline domains with respect to the substrate in thin films. The analysis is supported by XRD and NEXAFS experiments and is complemented by calculating intermolecular transfer integrals, which govern the charge mobility.

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DO - 10.1002/adma.200801668

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SN - 0935-9648

IS - 10-11

ER -

Solid-state supramolecular organization of polythiophene chains containing thienothiophene units

Abstract

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