Fulvene DC-FSSH

Decoherence corrected fewest-switches surface hopping dynamics of fulvene. <br><br>60 fs, 0.1 fs time step.<br>SA-2-CAS(6,6)/6-31G*<br>Dataset 1 (adjnac). Dynamics with nonadiabatic coupling vectors <b>h</b> with <b>h</b>-adjusted velocities after hopping.Dataset 2 (adjmom). Dynamics with nonadiabatic coupling vectors <b>h</b> with <b>p</b>-adjusted velocities after hopping.Dataset 3 (adjtdba). Dynamics with Time-dependent Baeck-An model.<br>