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Excitonic Hamiltonians for Calculating Optical Absorption Spectra and Optoelectronic Properties of Molecular Aggregates and Solids
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A numerical-tensorial "hybrid" nuclear motion Hamiltonian and dipole moment operator for spectra calculation of

Michaël Rey1, Dominika Viglaska1, Oleg Egorov2,3

  • 1Groupe de Spectrométrie Moléculaire et Atmosphérique, UMR CNRS 7331, BP 1039, F-51687 Reims Cedex 2, France.

The Journal of Chemical Physics
|September 15, 2023
PubMed

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