Monday, July 27, 2015

Structure–Property Relationships for Exciton and Charge Reorganization Energies of Dipolar Organic Semiconductors: A Combined Valence Bond Self-Consistent Field and Time-Dependent Hartree-Fock and DFT Study of Merocyanine Dyes

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The Journal of Physical Chemistry C
DOI: 10.1021/acs.jpcc.5b06206

Charlotte Brückner, Christof Walter, Matthias Stolte, Benoît Braïda, Klaus Meerholz, Frank Würthner and Bernd Engels
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