F. Thibault et al., Experimental and theoretical CO2-Ar pressure-broadening cross sections andtheir temperature dependence, PHYS CHEM P, 3(18), 2001, pp. 3924-3933
Line broadening coefficients of the CO2-Ar fundamental nu (3) band are obta
ined experimentally and theoretically for temperatures from 120 to 765 K. T
he experimental results are obtained by Fourier-transform infrared spectros
copy. Theoretical values are provided via quantum-mechanical (close couplin
g and coupled states) approaches as well as semiclassical (improved Smith-G
iraud-Cooper and Robert Bonamy) methods. The most up-to-date CO2-Ar ab init
io intermolecular potential (J. M. Hutson, A. Ernesti, M. M. Law, C. F. Roc
he and R. J. Wheatley, J. Chem. Phys., 1996,105, 9130) is employed for all
calculations. For all the temperatures probed, theoretical values are found
to be in a rather good agreement with experiment. In addition, the Raman Q
(j) line broadening coefficients and the application of the random phase ap
proximation are presented.