English

ExoMol line lists -- XXXIX. Ro-vibrational molecular line list for CO$_2$

Earth and Planetary Astrophysics 2020-07-10 v1 Solar and Stellar Astrophysics Chemical Physics

Abstract

A new hot line list for the main isotopologue of CO2_2 is presented. The line list consists of almost 2.5 billion transitions between 3.5 million rotation-vibration states of CO2_2 in its ground electronic state, covering the wavenumber range 0-20000 cm1^{-1} (λ>0.5\lambda >0.5 μ\mum) with the upper and lower energy thresholds of 36 000 cm1^{-1} and 16 000 cm1^{-1}, respectively. The ro-vibrational energies and wavefunctions are computed variationally using the Ames-2 accurate empirical potential energy surface. The ro-vibrational transition probabilities in the form of Einstein coefficients are computed using an accurate ab initio dipole moment surface using variational program TROVE. A new implementation of TROVE which uses an exact nuclear-motion kinetic energy operator is employed. Comparisons with the existing hot line lists are presented. The line list should be useful for atmospheric retrievals of exoplanets and cool stars. The UCL-4000 line list is available from the CDS and ExoMol databases.

Keywords

Cite

@article{arxiv.2007.02122,
  title  = {ExoMol line lists -- XXXIX. Ro-vibrational molecular line list for CO$_2$},
  author = {S. N. Yurchenko and Thomas M. Mellor and Richard S. Freedman and J. Tennyson},
  journal= {arXiv preprint arXiv:2007.02122},
  year   = {2020}
}