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Title:A VARIATIONALLY COMPUTED T=300 K LINE LIST FOR THE METHYL RADICAL CH3
Author(s):Jensen, Per
Contributor(s):Yurchenko, Sergei N.; Yachmenev, Andrey ; Adam, Ahmad Y.
Subject(s):Astronomy
Abstract:We present the first variational calculation of a room temperature \textit{ab initio} line list for the CH$_3$ radical. It is based on a high level {\it ab initio} potential energy surface and dipole moment surface of CH$_3$ in the ground electronic state. The ro-vibrational energy levels and Einstein $A$ coefficients were calculated using the general-molecule variational approach implemented in the computer program TROVE. Vibrational energies and vibrational intensities are found to be in very good agreement with the available experimental data.
Issue Date:2019-06-21
Publisher:International Symposium on Molecular Spectroscopy
Genre:Conference Paper / Presentation
Type:Text
Language:English
URI:http://hdl.handle.net/2142/104509
DOI:10.15278/isms.2019.FA07
Rights Information:Copyright 2019 Per Jensen
Date Available in IDEALS:2019-07-15
2020-01-25


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