N2-broadening coefficients of methyl chloride at room temperature

نویسندگان

  • C. Bray
  • D. Jacquemart
چکیده

Methyl chloride is of interest for atmospheric applications, since this molecule is directly involved in the catalytic destruction of ozone in the lower stratosphere. In a previous work [Bray et al. JQSRT 2011;112:2446], lines positions and intensities of self-perturbed CH3Cl and CH3Cl have been studied into details for the 3.4 μm spectral region. The present work is focused on measurement and calculation of N2-broadening coefficients of the CH3Cl and CH3Cl isotopologues. High-resolution Fourier Transform spectra of CH3Cl-N2 mixtures at room-temperature have been recorded between 2800 and 3200 cm at LADIR (using a classical source) and between 47 and 59 cm at SOLEIL (using the synchrotron source on the AILES beamline). 612 mid-infrared transitions of the ν1 band and 86 far-infrared transitions of the pure rotational band have been analyzed using a multispectrum fitting procedure. Average accuracy on the deduced N2-broadening coefficients has been estimated to 5% and 10% in the midand far-infrared spectral regions, respectively. The Jand K-rotational dependences of these coefficients have been observed in the mid-infrared region and then a simulation has been performed using an empirical model for 0 ≤ J ≤ 50, K ≤ 9. The CH3Cl-N2 line widths for 0 ≤ J ≤ 50 and K ≤ 10 of the ν1 band and for 55 ≤ J ≤ 67 and K ≤ 15 of the pure rotational band have been computed using a semiclassical approach involving exact trajectories and a real symmetric-top geometry of the active molecule. Finally, a global comparison with the experimental and theoretical data existing in the literature has been performed. Similar Jand K-rotational dependences appeared while no clear evidence for any vibrational and isotopic dependences have pointed out. ha l-0 07 46 01 0, v er si on 1 29 O ct 2 01 2

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تاریخ انتشار 2012