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. 2023 Jun 29;19(20):6859–6890. doi: 10.1021/acs.jctc.3c00347

Figure 13.

Figure 13

Computed (left) and experimental (right) TA spectra of pyrene in the gas phase. Band origins of S1 and S2 were shifted by −0.42 and −0.02 eV, respectively. Experimental spectra reprinted from ref (278). Copyright 1999 Hindawi Publishing Corporation. Distributed under a CC-BY license.