CW-cavity ring down spectroscopy of the ozone molecule in the 6220-6400 cm-1 region

被引:24
作者
Barbe, A.
De Backer-Barilly, M. -R.
Tyuterev, Vl. G.
Kassi, S.
Campargue, A.
机构
[1] CNRS, UFR Sci Exactes & Nat, UMR 6089, Grp Spectrometrie Mol & Atmospher, Reims 2, France
[2] Univ Grenoble 1, Spectrometrie Phys Lab, CNRS, UMR 5588, F-38402 St Martin Dheres, France
关键词
ozone; O-16(3); cavity ring down spectroscopy; CRDS; effective Hamiltonian model; effective transition moment operator;
D O I
10.1016/j.jms.2007.08.001
中图分类号
O64 [物理化学(理论化学)、化学物理学]; O56 [分子物理学、原子物理学];
学科分类号
070203 ; 070304 ; 081704 ; 1406 ;
摘要
The absorption spectrum of ozone,O-16(3), has been recorded in the 6220-6400 cm(-1) region by high sensitivity CW-cavity ring down spectroscopy (alpha(min)similar to 3 x 10(-10) cm(-1)). 1836 rovibrational transitions have been assigned to the 2 nu(2) + 5 nu(3), 5 nu(1) + nu(3) and 2 nu(1) + 2 nu(2) + 3 nu(3) A-type bands centred at 6305, 6355 and 6387 cm(-1), respectively. In addition, 99 lines of the very weak nu(1) + 2 nu(2) + 4 nu(3) and 4 nu(1) + 3 nu(2) B-type bands are identified. The modeling of the observed spectrum in the effective Hamiltonian approach was particularly laborious and complex as several rovibrational interactions of both Coriolis and anaharmonic type were found to be of importance, in particular for the (124) vibrational state. Nevertheless, it has finally been possible to fit the 990 experimentally determined energy levels with an rms deviation of 8.29 x 10(-3) cm(-1) and to derive the transition moment parameters allowing a satisfactory reproduction of the observed intensities. As the differences in positions between the final calculations and observations are still larger than the experimental accuracy, we provide the list of all energy levels derived from the observation, in addition to their differences with the calculated ones. These experimental energy levels, with the transition moment parameters were used to generate a line-list of 2451 transitions, reproducing the observed spectrum. This list is given as Supplementary Material. (C) 2007 Elsevier Inc. All rights reserved.
引用
收藏
页码:22 / 38
页数:17
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