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Excitonic Hamiltonians for Calculating Optical Absorption Spectra and Optoelectronic Properties of Molecular Aggregates and Solids
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Assessment of the ΔSCF density functional theory approach for electronic excitations in organic dyes

Tim Kowalczyk1, Shane R Yost, Troy Van Voorhis

  • 1Department of Chemistry, Massachusetts Institute of Technology, Cambridge, Massachusetts 02139-4307, USA.

The Journal of Chemical Physics
|February 10, 2011
PubMed

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