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Excitonic Hamiltonians for Calculating Optical Absorption Spectra and Optoelectronic Properties of Molecular Aggregates and Solids
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Prediction of spin-spin coupling constants in solution based on combined density functional theory/molecular

Andreas Møgelhøj1, Kestutis Aidas, Kurt V Mikkelsen

  • 1Department of Chemistry, H. C. Ørsted Institute, University of Copenhagen, Universitetsparken 5, DK-2100 Copenhagen Ø, Denmark.

The Journal of Chemical Physics
|April 10, 2009
PubMed

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