28Si16O SiOUVenIR spectroscopic model

Code used:

Duo, j-duo-v0208.x

Input:

Duo inputs for isotopologue 28Si-16O.

28Si-16O__SiOUVenIR_Duo__117.inp (contains parameters)

The input files contain experimental line positions and energy terms values used to build the model.  The PE, (T)DM, SO and EAM functions are represented by expansion parameters as well as on grids of points. The Duo code can be accessed via http://www.exomol.com/software/.

Zero point energy (ZPE): 619.39

 cm-1 relative to J=0, v=0, parity=1

Links

28Si-16O__SiOUVenIR_Duo__117.inp [231.3 KB]

References

  1. Barton, E. J., Yurchenko, S. N., Tennyson, J., "ExoMol line lists - II. The ro-vibrational spectrum of SiO", Monthly Notices of the Royal Astronomical Society 434, 1469-1475 (2013). [link to article][13BaYuTe.SiO]
  2. Medvedev, E. S., Meshkov, V. V., Stolyarov, A. V., Gordon, I. E., "Peculiarities of high-overtone transition probabilities in carbon monoxide revealed by high-precision calculation", Journal of Chemical Physics 143, 154301 (2015). [link to article][15MeMeSt.CO]