Abstract

A line list for the N2 second positive system, B3Πg - C3Πu, has been compiled using the PGOPHER spectral simulation software. The line list extends the number of vibrational states of the B3Πg up to v= 29 and a maximum rotational state of J= 150 for simulation temperatures up to 7000 K. New electronic–vibrational transition moments were calculated using refined potential energy curves and a transition dipole moment with the DUO software. Comparisons to experimental data and the SPECAIR software have been used to validate the new line list. The results are available in ASCII ExoMol .state and .trans files and as a PGOPHER input file for use in spectral analysis.

Full Text
Published version (Free)

Talk to us

Join us for a 30 min session where you can share your feedback and ask us any queries you have

Schedule a call