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. Author manuscript; available in PMC: 2015 Feb 11.
Published in final edited form as: Chem Phys Lett. 2014 Jan 8;593:132–139. doi: 10.1016/j.cplett.2014.01.002

Figure 5.

Figure 5

Effect of solvent environment on the low-lying Franck-Condon (FC) and relaxed (S1 rlxd) excited singlet states of C29-peridinin and peridinin based on EOM-CCSD and SCRF(PCM) procedures. Transition energies are relative to the MP3 ground state. Each excited state is represented by a rectangle, the height of which is proportional to the oscillator strength (marked above or below the rectangle) and the ionic versus covalent character is indicated by color (see insert). All symmetry assignments are approximate based on the symmetry labels of parent linear polyenes.