Theoretical calculation of CH3Br/N2-broadening coefficients at various temperatures

Journal of Quantitative Spectroscopy and Radiative Transfer

Volumn 112, Issue 5, 2011, Pages 769-778

  Boussetta, Z ^a   Aroui, H ^a   Jacquemart, D ^b,c   Gomez, L ^b,c,e   Bouanich, J P ^d  

^a UNIVERSITY OF TUNIS   (Tunisia)

^b SORBONNE UNIVERSITÉ   (France)

^c Centre National de la Recherche Scientifique Université Pierre et Marie Curie Paris 6 Sorbonne Universités   (France)

^d INSTITUT DES SCIENCES MOLÉCULAIRES D ORSAY   (France)

^e UNIVERSITÉ DE REIMS CHAMPAGNE ARDENNE   (France)

Author keywords

Databases; Infrared; Methyl bromide; N2 broadening coefficients; Semiclassical formalism; Temperature exponent

Indexed keywords

DATABASES; INFRARED; METHYL BROMIDE; N2-BROADENING COEFFICIENTS; SEMICLASSICAL FORMALISM;

BROMINE COMPOUNDS; DATABASE SYSTEMS;

ATMOSPHERIC TEMPERATURE;

DATABASE; DISPERSION; METHYL BROMIDE; POWER LAW; THEORETICAL STUDY;

EID: 79451474930     PISSN: 00224073     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jqsrt.2010.09.004     Document Type: Article

References (26)

1. Mc Cauley S.E., Goldstein A.H., Depaolo D.J. An isotopic approach for understanding the CH3Br budget of the atmosphere. Proc Natl Acad Sci USA 1999, 96:10006-10009.
2. McElroy M.B., Salawitch R.J., Wosfy C.S., Logan J.A. Reductions of Antartic ozone due to synergetic interactions of chlorine and bromine. Lett Nat 1986, 321:759-762.
3. Kurylo MJ, Rodriguez JM, Andreae MO, Atlas EL, Blake DR, Butler JH, et al. Scientifi{ligature}c assessment of ozone depletion: 1998. Global ozone research and monitoring project, Report no.44, Geneva, Switzerland: world meteorological organization, 1999, pp. 2.1-2.56.
4. Jacquemart D., Kwabia Tchana F., Lacome N., Kleiner I. A complete set of line parameters for CH3Br in the 10-γm spectral region. J Quant Spectrosc Radiat Transfer 2007, 105:264-302.
5. Jacquemart D., Tran H. Temperature dependence of self- and N2-broadening coefficients for CH3Br in the 10-γm spectral region. J Quant Spectrosc Radiat Transfer 2008, 109:569-579.
6. Kwabia Tchana F., Kleiner I., Orphal J., Lacome N., Bouba O. New analysis of the Coriolis-interacting v2 and v5 bands of CH379Br and CH381Br. J Mol Spectrosc 2004, 228:441-452.
7. Kwabia Tchana F., Jacquemart D., Lacome N., Kleiner I., Orphal J. Absolute line intensities in methyl bromide: the 7γm region. J Mol Spectrosc 2006, 235:132-143.
8. Brunetaud E., Kleiner I., Lacome N. Line Intensities in the v6 Fundamental Band of CH3Br at 10γm. J Mol Spectrosc 2002, 216:30-47.
9. Rothman L.S., et al. The HITRAN 2008 molecular spectroscopic database. J Quant Spectrosc Radiat Transfer 2009, 110:533-572.
10. Jacquinet-Husson N, et al. The 2009 edition of the GEISA spectroscopic database, J Quant Spectrosc Radiat Transfer, accepted for publication.
11. Gomez L., Jacquemart D., Bouanich J.P., Bousseta Z., Aroui H. Theoretical calculations of self-broadening coefficients in the v6 band of CH3Br. J Quant Spectrosc Radiat Transfer 2010, 111:1252-1261.
12. Tsao C.J., Curnutte B. Line-widths of pressure-broadened spectral lines. J Quant Spectrosc Radiat Transfer 1962, 2:41-91.
13. Robert D., Bonamy J. Short range force effects in semiclassical molecular line broadening calculations. J Phys (Paris) 1979, 40:923-943.
14. Bouanich J.P., Blanquet G., Walrand J. Theoretical O2- and N2-Broadening Coefficients of CH3Cl Spectral Lines. J Mol Spectrosc 1993, 161:416-426.
15. Leavitt R.P. An irreducible tensor method of deriving the long-range anisotropic interactions between molecules of arbitrary symmetry. J Chem Phys 1980, 72:3472-3482.
16. Leavitt R.P. Pressure broadening and shifting in microwave and infrared spectra of molecules of arbitrary symmetry: an irreducible tensor approach. J Chem Phys 1980, 73:5432-5450.
17. Bonamy J., Bonamy L., Robert D. Overlapping effects and motional narrowing in molecular band shapes: application to the Q branch of HD. J Chem Phys 1977, 67:4441-4453.
18. Looney J.P., Herman R.M. Air broadening of the hydrogen halides-I. N2-broadening and shifting in the HCl fundamental. J Quant Spectrosc Radiat Transfer 1987, 37:547-557.
19. Reuter R., Jennings D.E., Brault J.W. The v=1→0 quadrupole spectrum of N2. J Mol Spectrosc 1986, 115:294-304.
20. Carocci S., Minguzzi P., Tonelli M., Di Lieto A. The electric dipole and the nuclear quadrupole moment of methyl bromide in the ground vibrational state. J Mol Spectrosc 1993, 160:359-370.
21. Khristenko S.V., Maslov A.I., Shevelko V.P. Molecules and their spectroscopic properties 1998, Springer-Verlag, Berlin.
22. Flygare W.H., Benson R.C. The molecular Zeeman effect in diamagnetic molecules and the determination of molecular magnetic moments (g-values), magnetic susceptibilities, and molecular quadrupole moments. Mol Phys 1971, 20:225-250.
23. Gray C.G., Gubbins K.E. Theory of molecular fluids 1984, Oxford Univ. Press, New York.
24. Bouanich J.P., Walrand J., Blanquet B. N2-broadening coefficients in the v2 and v4 bands of PH3. J Mol Spectrosc 2005, 232:40-46.
25. Lerot C., Walrand J., Blanquet G., Bouanich J.P., Lepère M. Diode-laser measurements and calculations of H2-broadening coefficients in the v3 band of CH3D. J Mol Spectrosc 2003, 217:79-86.
26. Giraud M., Robert D., Galatry L. Spectroscopie moléculaire-Sur la détermination du moment quadrupolaire de molécules linéaires à partir des élargissements de raies spectrales. C.R Acad Sci Paris 1971, 272:1252-1255.