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1.
J Mol Spectrosc ; 206(1): 83-103, 2001 Mar.
Artículo en Inglés | MEDLINE | ID: mdl-11281688

RESUMEN

As a continuation of the work carried out on the ground and (010) vibrational states of water (R. Lanquetin, L. H. Coudert, and C. Camy-Peyret, 1999, J. Mol. Spectrosc. 195, 54-57), rotational energy levels for these two states are revisited here and new accurate rotational energy levels are considered for the three next vibrational states, that is, the (020), (100), and (001) states. Experimental rotational energies, along with their uncertainties, are retrieved through analyses of already published data sets and of discharge and flame emission spectra. The maximum value of J for the obtained levels is 25 for the ground state, 21 for the (010) state, and 20 for the three next states. Based on the bending-rotation Hamiltonian approach (L. H. Coudert, 1997, J. Mol. Spectrosc. 181, 246-273), a new theoretical approach is proposed to calculate rotational energies in the five interacting vibrational states under consideration and is used to carry out an analysis of the experimental energies. Comparisons with other existing energy level data sets are also presented. Copyright 2001 Academic Press.

2.
J Mol Spectrosc ; 205(1): 1-8, 2001 Jan.
Artículo en Inglés | MEDLINE | ID: mdl-11148100

RESUMEN

The water-vapor spectra in the near-infrared and visible region were reanalyzed with the purpose of finding experimental evidences of unusual high-order resonance between "dark" high-bending and "bright" stretch vibration states. About 70 transitions to the (050), (060), (070), (080), (160), (061), (170), (071), and, even (0 10 0) bending states, and their resonating partners were assigned in the spectra that gives the experimental energy levels lying near or above the potential energy barrier to linearity. The assignments were confirmed by combination differences and simultaneous observation of both perturbed and perturbing levels. It was found that the high-order resonances with large changing of vibration quantum numbers are typical for the water molecule and they are caused by the strong centrifugal distortion near the linear configuration. These resonances destroy the usual polyad scheme originating from well-known Coriolis, Darling-Dennison, and Fermi resonances in H(2)O molecule. Copyright 2001 Academic Press.

3.
J Mol Spectrosc ; 195(1): 54-67, 1999 May.
Artículo en Inglés | MEDLINE | ID: mdl-10191152

RESUMEN

Emission spectra of methane-oxygen low-pressure flames have been recorded at a resolution of 0.02 cm-1 with an infrared Fourier transform spectrometer in the spectral ranges 780-1370 and 1800-5000 cm-1. The flame temperature was about 1850 K and a large number of transitions involving J values as high as 34 for an extended set of vibrational states could be assigned. Combined with already published data sets on H2O, our line position analysis yielded rotational energy levels for many of these states, but only the results relevant to the ground and the (010) states are presented here. The experimental energies for these two states have been fitted with the help of the bending-rotation Hamiltonian approach [L. H. Coudert, J. Mol. Spectrosc. 181, 246-273 (1997)], and for each rotational level, the calculated energy along with its uncertainty is reported and compared with the observed value. Comparisons with other available energy level data sets for the ground and (010) states are also presented. Copyright 1999 Academic Press.

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