Publikationsliste Prof. Dr. Carolin König
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2013
König C, Schlüter N, Neugebauer J. Direct determination of exciton couplings from subsystem time-dependent density-functional theory within the Tamm-Dancoff approximation. Journal of Chemical Physics. 2013. doi: 10.1063/1.4774117
König C, Neugebauer J. Exciton coupling mechanisms analyzed with subsystem TDDFT: Direct vs pseudo exchange effects. Journal of Physical Chemistry B. 2013. doi: 10.1021/jp3105419
König C, Neugebauer J. Protein effects on the optical spectrum of the Fenna-Matthews-Olson complex from fully quantum chemical calculations. Journal of Chemical Theory and Computation. 2013. doi: 10.1021/ct301111q
2012
König C, Neugebauer J. Quantum chemical description of absorption properties and excited-state processes in photosynthetic systems. CHEMPHYSCHEM. 2012. doi: 10.1002/cphc.201100408
2011
König C, Neugebauer J. First-principles calculation of electronic spectra of light-harvesting complex II. Physical Chemistry Chemical Physics. 2011. doi: 10.1039/c0cp02808h
2010
Roquette P, König C, Hübner O, Wagner A, Kaifer E, Enders M et al. Mono- and dinuclear Ni<sup>II</sup> and Co<sup>II</sup> complexes that feature chelating guanidine ligands: Structural characteristics and molecular magnetism. European Journal of Inorganic Chemistry. 2010. doi: 10.1002/ejic.201000315
Vitske V, König C, Hübner O, Kaifer E, Himmel HJ. Syntheses of the first coordination compounds of the new strong molecular electron donor and double proton sponge l,4,5,8-tetrakis(tetramethylguanidino) naphthalene. European Journal of Inorganic Chemistry. 2010. doi: 10.1002/ejic.200900724
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