Table 11.
Pathway |
[eV] |
[eV] |
---|---|---|
E 00↔E 01 |
0.29 |
0.10 |
E 00↔E 01 (Ex.) |
0.28 |
0.09 |
E 10↔E 11 (Ex.) |
0.31 |
0.04 |
E 10↔E 12 |
0.36 |
0.09 |
E 10↔E 12 (Ex.) |
0.37 |
0.10 |
E 13↔E 11 (Ex.) |
0.19 |
0.08 |
E 20↔E 21 |
0.35 |
0.09 |
E 20↔E 21 (Ex.) |
0.27 |
0.00 |
E 20↔E 22 (Ex.) |
0.30 |
0.03 |
E 30↔E 31 |
0.42 |
0.19 |
E 30↔E 31 (Ex.) |
0.25 |
0.02 |
E 30↔E 32 (Ex.) |
0.27 |
0.04 |
[a] All values were calculated by means of DFT‐PBE.