Accurate Prediction of Band Gaps in Neutral Heterocyclic Conjugated Polymers

This publication has 46 references indexed in Scilit:

• The Discovery of Polyacetylene Film: The Dawning of an Era of Conducting Polymers (Nobel Lecture)
  Angewandte Chemie International Edition in English, 2001
• Conductive and Magnetic Properties of 3,4-Dimethoxy- and 3,4-Ethylenedioxy-Capped Polypyrrole and Polythiophene
  Chemistry of Materials, 2000
• Organic light-emitting diodes using a novel family of amorphous molecular materials containing an oligothiophene moiety as colour-tunable emitting materials
  Journal of Materials Chemistry, 1999
• An efficient implementation of time-dependent density-functional theory for the calculation of excitation energies of large molecules
  The Journal of Chemical Physics, 1998
• Comparison of geometries and electronic structures of polyacetylene, polyborole, polycyclopentadiene, polypyrrole, polyfuran, polysilole, polyphosphole, polythiophene, polyselenophene and polytellurophene
  Synthetic Metals, 1998
• Synthetic Principles for Bandgap Control in Linear π-Conjugated Systems
  Chemical Reviews, 1997
• Synthesis of .beta.-Methoxy, Methyl-Capped .alpha.-Oligothiophenes
  The Journal of Organic Chemistry, 1995
• Electroluminescence of “wide-bandgap” chemically tunable cyclic conjugated polymers
  Synthetic Metals, 1993
• Ab initio study of the Grignard reaction between magnesium atoms and fluoroethylene and chloroethylene
  The Journal of Physical Chemistry, 1991
• A general synthetic route to 2,2':5',2''-terpyrrole, 2,5-di(2-pyrryl)thiophene, and alkyl-substituted analogs
  The Journal of Organic Chemistry, 1990