Literature DB >> 31091894

Ab initio predictions and laboratory validation for consistent ozone intensities in the MW, 10 and 5 μm ranges.

Vl G Tyuterev1, A Barbe2, D Jacquemart3, C Janssen4, S N Mikhailenko5, E N Starikova5.   

Abstract

Reliable ozone spectral data consistent over several spectral ranges are a challenge for both experiment and theory. We present ab initio calculations for strong lines that lead to consistent results from the microwave to mid-infrared regions. The results agree well with established microwave line lists and our new measurements in the fundamental and first overtone regions of ozone at 5 and 10 μm. The calculations and their agreement to within 1% with measurements provide an important step toward consistent and accurate spectroscopic ozone data. The results imply that actual databases need to be corrected by about 3% in the corresponding mid-infrared spectral intervals. Appropriate recommendations for the consistency of strong line intensities of the ozone molecule in microwave, 10 and 5 μm ranges, in HITRAN (HIgh-resolution TRANsmittance and molecular apbsorption) and GEISA (Gestion et Etude des Informations Spectroscopiques Atmosphériques) databases are suggested.

Entities:  

Year:  2019        PMID: 31091894     DOI: 10.1063/1.5089134

Source DB:  PubMed          Journal:  J Chem Phys        ISSN: 0021-9606            Impact factor:   3.488


  1 in total

Review 1.  High Resolution Infrared Spectroscopy in Support of Ozone Atmospheric Monitoring and Validation of the Potential Energy Function.

Authors:  Alain Barbe; Semen Mikhailenko; Evgeniya Starikova; Vladimir Tyuterev
Journal:  Molecules       Date:  2022-01-28       Impact factor: 4.411

  1 in total

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