ExoMol line lists - LI. Molecular line lists for lithium hydroxide (LiOH)

Alec Owens, Sam O. M. Wright,Yakiv Pavlenko, Alexander Mitrushchenkov,Jacek Koput, Sergei N. Yurchenko,Jonathan Tennyson

MONTHLY NOTICES OF THE ROYAL ASTRONOMICAL SOCIETY(2024)

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摘要
New molecular line lists for lithium hydroxide ((LiOH)-Li-6-O-16-H-1 and (LiOH)-Li-7-O-16-H-1 isotopologues) covering wavelengths lambda > 1 mu m (0-10 000 cm(-1) range) are presented. Each line list contains around 300 million transitions between rotation-vibration energy levels with total angular momentum up to J = 95, applicable for temperatures up to T approximate to 3500 K. Line list calculations were based on a previously published, high-level ab initio potential energy surface and a newly computed dipole moment surface of the ground (X) over tilde (1)Sigma(+) electronic state. Lithium-containing molecules are important in a variety of stellar objects and there is potential for LiOH to be observed in the atmospheres of exoplanets. Transit spectra are simulated using the rocky super-Earth 55 Cancri e as an example with two different atmospheric scenarios including LiOH. This work provides the first, comprehensive line lists of LiOH to facilitate its future molecular detection. The OYT7 line lists along with the associated temperature- and pressure-dependent molecular opacities can be downloaded from the ExoMol database at www.exomol.com and the CDS astronomical database.
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关键词
molecular data,opacity,planets and satellites: atmospheres,stars: atmospheres,ISM: molecules
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