Semi-empirical calculation of (CH3D)-C-12-H-2 broadening coefficients and their temperature-dependence exponents for rovibrational lines in parallel bands
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Titre | Semi-empirical calculation of (CH3D)-C-12-H-2 broadening coefficients and their temperature-dependence exponents for rovibrational lines in parallel bands |
Type de publication | Journal Article |
Year of Publication | 2019 |
Auteurs | Dudaryonok A.S, Lavrentieva N.N, Buldyreva J. |
Journal | JOURNAL OF QUANTITATIVE SPECTROSCOPY & RADIATIVE TRANSFER |
Volume | 229 |
Pagination | 157-165 |
Date Published | MAY |
Type of Article | Article |
ISSN | 0022-4073 |
Mots-clés | H-2-broadening coefficients, Monodeuterated methane, Planetary atmosphere, Semi-empirical calculation, Temperature exponents |
Résumé | Hydrogen-broadening coefficients and their temperature-dependence exponents for (CH3D)-C-12 (J, K) lines in the parallel (Delta K =0) nu(3) band are computed by a semi-empirical method employing analytical Andersontype expressions with a few-parameter correction factor introduced to account for various deviations from Anderson's theory approximations. On the basis of experimentally observed J-dependences of line widths, this correction factor is taken in the traditional two-parameter form, and the parameters are determined from fits on some room-temperature measurements. After validation by comparison with available experimental data, the calculations are done for extended ranges of rotational quantum numbers (0 <= J <= 70, 0 <= K <= 20) typically requested for spectroscopic databases. To get the temperature-dependence exponents, computations with the room-temperature parameters' values are repeated for various temperatures in the room-temperature containing range 200-400K recommended for HITRAN and least-squares fit procedures are applied. Detailed P-Q-R-line lists are provided. With negligible vibrational dependence of CH3D line widths, these data can be also employed for other A(1)-type bands. (C) 2019 Elsevier Ltd. All rights reserved. |
DOI | 10.1016/j.jqsrt.2019.03.008 |