On the applicability of the molecular dynamics SCC-DFTB treatment on optical spectra for thiophene and phenyl containting oligomers

Vladimir Lukes, Jan Rimarcik, Lenka Rottmanová, Kraiwan Punyain, Erik Klein, Anne-Marie Kelterer

Research output: Contribution to journalArticlepeer-review

Original languageEnglish
Pages (from-to)55-65
JournalComputational & theoretical chemistry
Publication statusPublished - 2012

Fields of Expertise

  • Advanced Materials Science

Treatment code (Nähere Zuordnung)

  • Basic - Fundamental (Grundlagenforschung)
  • Theoretical

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