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. 2017 Dec 4;149(1):1–9. doi: 10.1007/s00706-017-2108-4

Fig. 4.

Fig. 4

Time evolution of a energy levels, b the C5–C5′ and C6–C6′ distances, and c the delocalization length and charge-transfer (CT) contribution for a trajectory trapped in the minimum of T 1