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Multispectrum fitting of line parameters for C2H2 in the 3.8-μm spectral region
Authors:D Jacquemart  N Lacome  V Dana  VI Perevalov
Institution:a Université Pierre et Marie Curie-Paris 6, Laboratoire de Dynamique, Interactions et Réactivité, CNRS, UMR 7075, Case courrier 49, Bât F 74, 4, place Jussieu, 75252 Paris Cedex 05, France
b Université Pierre et Marie Curie-Paris 6, Laboratoire de Physique Moléculaire pour l’Atmosphère et l’Astrophysique, CNRS, UMR 7092, Case courrier 76, 4, place Jussieu, 75252 Paris Cedex 05, France
c Laboratory of Theoretical Spectroscopy, Institute of Atmopheric Optics, Siberian Branch, Russian Academy of Sciences, 1, Akademicheskii av., 634055 Tomsk, Russia
Abstract:Using FT spectra (Bruker IFS 120, unapodized FWHM resolution ≈ 0.001 cm−1) of acetylene 12C2H2, absolute positions and intensities have been measured for about 250 lines between 2600 and 2800 cm−1 in the View the MathML source and View the MathML source cold bands, and in the View the MathML source and View the MathML source hot bands. These measurements improve the accuracy of wavenumbers previously available and lead to individual line intensities for the first time in this spectral region. A multispectrum fitting procedure has been used to retrieve line parameters from five experimental spectra recorded at different pressures. The frequencies of the ν3 band of 12C16O2 allowed to perform an absolute wavenumber calibration. The accuracy of the amount of 12C2H2 in the sample has been checked using the View the MathML source cold band around 2100 cm−1, and has been estimated to be around ±2%. The average absolute accuracy of the line parameters obtained in this work has then been estimated to be ±0.0002 cm−1 for line positions, and ±5% for line intensities. For each studied band, the vibrational transition dipole moment squared value has been determined, as also empirical Herman-Wallis coefficients. A complete line list containing positions and intensities for the five strongest bands around 3.8 μm has been set up for atmospheric applications.
Keywords:Acetylene  Infrared  Vibro-rotational transitions  Fourier transform spectroscopy  Line intensities  Transition dipole moment  Herman-Wallis factor
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