Excited state singlet-A | Eigenvectors | Transition | ΔE eV | λcalc. nm | f | Ex Ip eV |
Excited state 1 | ||||||
39− > 40 39− > 41 | −0.38190 0.56353 | ψm− > ψm+1 ψm− > ψm+2 | 3.6203 | 342.47 | 0.0001 | 1.264399 |
Excited state 2 | ||||||
36− > 40 36− > 41 39− > 40 39− > 41 | 0.63656 0.13159 0.15913 0.13339 | ψm−3− > ψm+1 ψm−3− > ψm+2 ψm− > ψm+1 ψm− > ψm+2 | 3.9108 | 342.47 | 0.0001 | 1.464898 |
Excited state 3 | ||||||
36− > 40 39− > 40 39− > 41 | −0.19827 0.56276 0.35182 | ψm−3− > ψm+1 ψm− > ψm+1 ψm− > ψm+2 | 4.0769 | 304.11 | 0.0000 | 1.44943 |