TIME AND ENERGY RESOLVED PROCESSES IN MOLECULAR-DYNAMICS

The validity of the time-dependent Bloch's wave operator theory compared to widely used time propagation algorithms such as the split operator method and the short iterative Lanczos propagation is tested on a collinear collision system, which exhibits energy transfer probabilities with pronounced structure and on the two color ir multiphoton dissociation of a diatom. Both energy- and time-resolved processes are investigated by analyzing the spectra of the outgoing flux in the excited and/or in the dissociative channels.