Skip to main content
. 2020 Aug 14;11(18):7483–7488. doi: 10.1021/acs.jpclett.0c02193

Figure 2.

Figure 2

Absorption spectra of (dA)20 with (a) four, (b) six, and (c) eight adenines included in the QM region and their decomposition into exciton, monomer-like, excimer, and charge-transfer states at the CAM-B3LYP/def2-SV(P) level of theory. The two vertical lines indicate the excitation window chosen for the dynamics. Panel (c) is convoluted from data taken from ref (9).