HOMO-LUMO gap (a.u.) | |||||
H10 | 0.1393 | −0.0662 | −0.1628 | −0.1142 | 0.1550 |
H12 | 0.1116 | −0.0573 | −0.1351 | −0.0983 | 0.1387 |
H14 | 0.0917 | −0.0506 | −0.1142 | −0.0865 | 0.1264 |
H16 | 0.0766 | −0.0453 | −0.0978 | −0.0773 | 0.1168 |
H18 | 0.0649 | −0.0410 | −0.0846 | −0.0700 | 0.1091 |
H20 | 0.0555 | −0.0375 | −0.0738 | −0.0640 | 0.1029 |