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DFT and TD-DFT calculations of fluorene bridged Triarylamine Dimers and Triar...
This dataset contains (TD)-DFT calculations (Gaussian 09 output files) for a series of 2,7 fluorene bridged triarylamine dimers in their mono-cationic inter valence charge... -
Experimental Data to the publication "The Golden Goal of Entatic State Model ...
Cyclic voltammetric data, UV/Vis spectroscopic data and DFT optimized structures of the complexes are deposited. The measurements were performed with a METROHM AUTOLAB PGSTAT... -
TD-DFT calculations of bridged triarylamine dimers
This dataset contains (TD-)DFT calculations (Gaussian 09 output files) for a series of 2,7-fluorene bridged triarylamine dimers in their neutral-, monoradicalic- and diradicalic...