The vertical excitation energies and a lifetime of the two lowest singlet excited states of the conjugated polyenes from C2 to C22: Ab initio, DFT, and semiclassical MNDO-MD simulations - researchr publication

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Katerina Fatková, Radim Cajzl, Jaroslav V. Burda. The vertical excitation energies and a lifetime of the two lowest singlet excited states of the conjugated polyenes from C2 to C22: Ab initio, DFT, and semiclassical MNDO-MD simulations. Journal of Computational Chemistry, 44(6):777-787, March 2023. [doi]

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