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(000) and (010) energy levels of the HD18O and molecules from analysis of their ν2 bands

Authors :
An-Wen Liu
Hong-Yu Ni
K.-F. Song
Olga V. Naumenko
Shui-Ming Hu
Semen Mikhailenko
I.A. Vasilenko
Source :
Journal of Molecular Spectroscopy. 265:26-38
Publication Year :
2011
Publisher :
Elsevier BV, 2011.

Abstract

High-resolution Fourier-transform spectra of water samples enriched by deuterium and oxygen-18 at room temperature are analyzed in the range 969–2148 cm−1. Line positions of about 2470 transitions up to Jmax = 22 and Ka max = 12 of the ν2 bands of the HD18O and D 2 18 O molecules are reported. This has allowed the determination of extended sets of rotational energies of the (0 0 0) and (0 1 0) vibrational states for both molecules. The generation function model of an effective rotational Hamiltonian was used in the data reduction to account for the strong centrifugal distortion of the rotational levels. Values of effective Hamiltonian parameters have been determined. The RMS standard deviations of the least-squares fits of the energy levels were 2.4 × 10−4 cm−1 for 293 energy levels of the ground state and 3.2 × 10−4 cm−1 for 281 energy levels of the (010) state of D 2 18 O , and 2.6 × 10−4 cm−1 for 227 energy levels of the ground state and 4.2 × 10−4 cm−1 for 246 energy levels of the (0 1 0) state of HD18O. Comparisons of obtained data with the theoretical predictions as well as with other observations are presented.

Details

ISSN :
00222852
Volume :
265
Database :
OpenAIRE
Journal :
Journal of Molecular Spectroscopy
Accession number :
edsair.doi...........d2beda17941ac82857902bc81854796c
Full Text :
https://doi.org/10.1016/j.jms.2010.10.007