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The 2020 release of the ExoMol database: molecular line lists for exoplanet and other hot atmospheres
Jonathan Tennyson, Sergei N. Yurchenko, Ahmed F. Al-Refaie +19
The ExoMol database (www.exomol.com) provides molecular data for spectroscopic studies of hot atmospheres. While the data is intended for studies of exoplanets and other astronomic…
Calculated line lists for HO and HO with extensive comparisons to theoretical and experimental sources including the HITRAN2016 database
Eamon K. Conway, Iouli E. Gordon, Aleksandra A. Kyuberis +3
New line lists are presented for the two most abundant water isotopologues; HO and HO. The HO line list extends to 25710 cm with inten…
Use of the complete basis set limit for computing highly accurate ab initio dipole moments
Eamon K. Conway, Iouli E. Gordon, Oleg L. Polyansky +1
Calculating dipole moments with high-order basis sets is generally only possible for the light molecules, such as water. A simple, yet highly effective strategy of obtaining high-o…