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A theoretical study of the effect of disorder of the transition dipole moments of molecules on the shape of optical bands of molecular aggregates
Authors:D V Makhov  A A Bagatur’yants  M V Alfimov
Institution:(1) Center of Photochemistry, Russian Academy of Sciences, Moscow, 117421, Russia
Abstract:Aggregates with substitutional disorder, in which molecules of different types have different transition dipole moments, are considered. The relations between the absorption spectra of aggregates with disordered and nondisordered transition dipole moments are obtained for two limiting cases: (1) the case when there is no statistical correlation between the transition energies and transition dipole moments of the molecules and (2) the case of total correlation, when the transition energies and transition dipole moments are strictly related to each other. For aggregates that are characterized by substitutional disorder along with diagonal disorder, an effective method of calculation of the optical bands is developed. Numerical calculations of the absorption bands of aggregates consisting of molecules of two types are carried out at different values of the parameters.
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