Theoretical Investigation of the Structural and Spectroscopic Properties of Anthracene Dimers

R. R. Valiev, K. B. Kopbalina, V. N. Cherepanov, N. Kh Ibraev, N. A. Mazhenov

Research output: Contribution to journalArticle

4 Citations (Scopus)

Abstract

Equilibrium geometries of the ground electronic state of anthracene dimers are obtained using the density functional level of theory with the B97D hybrid functional and the TZVP basis set and their electronic absorption spectra are simulated.

Original languageEnglish
Pages (from-to)95-99
Number of pages5
JournalRussian Physics Journal
Volume57
Issue number1
DOIs
Publication statusPublished - 1 Jan 2014

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Keywords

  • anthracene dimers
  • density functional theory
  • thin films

ASJC Scopus subject areas

  • Physics and Astronomy(all)

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