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. 2023 Nov 10;8(46):43792–43812. doi: 10.1021/acsomega.3c05665

Table 6. λmax, Ex, Osscillator Strength (f), and Assignment of DF-R and Studied Molecules in Gaseous Medium.

molecules exp. λmax (nm) calculated λmax (nm) excitation energies Ex (eV) oscillator strength (f) assignment
DF-R 671 613 2.02 3.06 H–L (+99%)
DF-M1   958 1.29 1.78 H–L (+99%)
DF-M2   931 1.33 2.40 H–L (+99%)
DF-M3   783 1.58 2.56 H–L (+97%)
DF-M4   735 1.68 3.49 H–L (+98%)
DF-M5   718 1.72 3.17 H–L (+99%)
DF-M6   694 1.78 3.50 H–L (+96%)