|Molecule Types Vibrational Structure Vibrational Energy Levels and Franck-Condon Factors Samples
This provides a basic example of simulating vibrational structure
including the Renner-Teller effect. The file was set up by fitting
to selected bending levels in the A1Πu and X1Σg+
states. The level structure spectroscopy of both states is very
complicated, so this simulation is far from complete.