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Direct determination of exciton couplings from subsystem time-dependent density-functional theory within the Tamm-Dancoff approximation.
König C, Schlüter N, Neugebauer J. König C, et al. Among authors: neugebauer j. J Chem Phys. 2013 Jan 21;138(3):034104. doi: 10.1063/1.4774117. J Chem Phys. 2013. PMID: 23343265
In subsystem time-dependent density functional theory (TDDFT) [J. Neugebauer, J. Chem. Phys. 126, 134116 (2007)] localized excitations are used to calculate delocalized excitations in large chromophore aggregates. ...
In subsystem time-dependent density functional theory (TDDFT) [J. Neugebauer, J. Chem. Phys. 126, 134116 (2007)] locali …
415 results