The effective operator approach is applied to the calculation of both line positions and line intensities of the 13 C 16 O 2 molecule. About 11 000 observed line positions of 13 C 16 O 2 selected from the literature have been used to derive 84 parameters of a reduced effective Hamiltonian globally d
Methyl Chloride ν5Region Lineshape Parameters and Rotational Constants for the ν2, ν5, and 2ν3Vibrational Bands
✍ Scribed by C. Chackerian Jr.; L.R. Brown; N. Lacome; G. Tarrago
- Publisher
- Elsevier Science
- Year
- 1998
- Tongue
- English
- Weight
- 424 KB
- Volume
- 191
- Category
- Article
- ISSN
- 0022-2852
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✦ Synopsis
Fourier spectra of methyl chloride have been obtained at ambient laboratory temperature under self-broadening conditions. Five thousand two hundred and sixty rovibrational transitions of the ( 2 , 5 , 2 3 )-vibrational-band triad have been assigned, and new ground and excited state rotational constants for CH 3 35 Cl and CH 3 27 Cl have been determined. The 5 and 2 vibrational-band intensities are determined to be, respectively, 42(1.2) and 31.7(0.9) cm Ϫ2 atm Ϫ1 . Self-broadening coefficients of individual rovibrational lines are determined for the 5 band of CH 3 35 Cl and CH 3 37 Cl at 296 K. The self-broadening coefficients peak broadly close to the maximum in the Boltzmann rotational population; no specific trends of the broadening coefficients are observed with the rotational quantum number K. With the exception of the R Q(J, 0) branch, the 1260 -1650 cm Ϫ1 spectral region can be well modeled by the superposition of overlapping Voigt line profiles. To adequately model the densely packed R Q(J, 0) branch, however, we included collisional line mixing with A ϩ to A Ϫ in addition to A Ϫ to A Ϫ and A ϩ to A ϩ |⌬J| Ն 1, ⌬K ϭ 0 collisional transitions allowed.
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