Experimental observation of the ν2+4ν3 bands of HD16O and HD18O between 14975 and 15275 cm−1

Chandran, Satheesh; Dixneuf, Sophie; Orphal, Johannes J.; Ruth, Albert A.

Experimental observation of the ν2+4ν3 bands of HD16O and HD18O between 14975 and 15275 cm−1

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Supplementary data 2

Date

2020-11-21

Authors

Chandran, Satheesh

Dixneuf, Sophie

Orphal, Johannes J.

Ruth, Albert A.

Publisher

Elsevier

Published Version

10.1016/j.jms.2020.111395

Abstract

The ν2+4ν3 combination bands of HD16O and HD18O were measured using Fourier transform-incoherent broadband cavity-enhanced absorption spectroscopy (FT-IBBCEAS) with a spectral resolution of 0.08 cm−1. The ro-vibrational lines of these bands were assigned through comparison with ab-initio molecular lines from the Tomsk variational calculation database (http://spectra.iao.ru/). For HD18O and HD16O in total 114 and 141 strong lines were assigned in the region between 14975.3 cm−1 and 15243.3 cm−1 and between 14998.5 cm−1 and 15274.7 cm−1, respectively. While the very satisfactory agreement of line intensities was used for line assignments, a systematic average discrepancy of ~0.305 cm−1 in line positions was identified between the measured lines of HD18O and the theoretically predicted lines from the Tomsk database. Similarly for HD16O, an approximate wavenumber difference of ~0.361 cm−1 was observed. The wavenumber accuracy of the Fourier transform cavity enhanced absorption spectrometer was confirmed on basis of concurrently measured H216O spectra in the region between 15254.2 cm−1 and 15376.9 cm−1 and corroborated the systematic shifts of the ab initio data. A few lines of the ν1+4ν2+2ν3 bands of HD16O and HD18O were also identified. The data are compared and discussed on basis of existing literature data.

Keywords

Water isotopologues , Overtone combination bands , Near infra-red , HDO , Fourier transform-incoherent broadband cavity enhanced absorption spectroscopy (FT-IBBCEAS) , Trace gas sensing.

Citation

Chandran, S., Dixneuf, S., Orphal, J. and Ruth, A. A. (2021) 'Experimental observation of the ν2+4ν3 bands of HD16O and HD18O between 14975 and 15275 cm−1', Journal of Molecular Spectroscopy, 375, 111395 (11 pp). doi: 10.1016/j.jms.2020.111395