Table 2.
Computed binding energies, photoionization lifetimes (in fs) for a field intensity of 1013 and 1014 W/cm2 and transition dipole moments (μtrans) between the ground and excited states shown in Fig. 3.
| Excitation energy(eV) | Photoionization lifetime (fs) | μtrans (au) | ||||
|---|---|---|---|---|---|---|
| 1013 W/cm2 | 1014 W/cm2 | Ho3N@C80 | C60 | C80 | ||
| Valence (ES 67) | 4.25 | 351.03 | 39.00 | 1.19 | 1.55 | 1.47 |
| s SAMO (ES 100) | 4.98 | 2.00 | 0.22 | 0.66 | 0.00 | 0.02 |
| p SAMO (ES 116) | 5.23 | 1.49 | 0.13 | 0.69 | 0.00 | 0.30 |
| d SAMO (ES 145) | 5.60 | 1.56 | 0.17 | 0.49 | 0.00 | 0.29 |
The photoionization lifetimes are computed for the ionization of an electron with a kinetic energy of 0.2 eV. For comparison, the computed transition dipole moments of the valence (with an excitation energy around 4.25 eV), s, p and d SAMO states are also given for C60 and C80.