Literature DB >> 20113041

Spectroscopic measurements of SO(2) line parameters in the 9.2 mum atmospheric region and theoretical determination of self-broadening coefficients.

Nicola Tasinato1, Andrea Pietropolli Charmet, Paolo Stoppa, Santi Giorgianni, Giovanni Buffa.   

Abstract

Sulfur dioxide is still the subject of numerous spectroscopic studies since it plays an active role in the chemistry of Earth's atmosphere and it is a molecule of proven astrophysical importance. In the present work we have determined the self-broadening and integrated absorption coefficients for several lines in the nu(1) band spectral region around 9.2 mum. Besides the parameters of the lines belonging to the nu(1) fundamental of (32)SO(2), also those for some rovibrational lines of the nu(1)+nu(2)-nu(2) hot band of the (32)SO(2) isotopologue and the nu(1) band of the (34)SO(2) isotopic species have been determined. The measurements have been carried out at 297 K using a tunable diode laser spectrometer. The self-broadening parameters have also been theoretically determined employing a semiclassical formalism based on the Anderson-Tsao-Curnutte approximation. The study has been completed with the determination of the vibrational cross sections of the three fundamental bands measured from the spectra recorded at a resolution of 0.2 cm(-1) using a Fourier transform infrared spectrometer.

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Year:  2010        PMID: 20113041     DOI: 10.1063/1.3299274

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


  5 in total

1.  Anharmonic theoretical simulations of infrared spectra of halogenated organic compounds.

Authors:  Ivan Carnimeo; Cristina Puzzarini; Nicola Tasinato; Paolo Stoppa; Andrea Pietropolli Charmet; Malgorzata Biczysko; Chiara Cappelli; Vincenzo Barone
Journal:  J Chem Phys       Date:  2013-08-21       Impact factor: 3.488

2.  The Spectroscopic Characterization of Halogenated Pollutants through the Interplay between Theory and Experiment: Application to R1122.

Authors:  Andrea Pietropolli Charmet; Giorgia Ceselin; Paolo Stoppa; Nicola Tasinato
Journal:  Molecules       Date:  2022-01-24       Impact factor: 4.411

3.  In Vitro and In Silico Vibrational-Rotational Spectroscopic Characterization of the Next-Generation Refrigerant HFO-1123.

Authors:  Nicola Tasinato; Andrea Pietropolli Charmet; Giorgia Ceselin; Zoi Salta; Paolo Stoppa
Journal:  J Phys Chem A       Date:  2022-08-05       Impact factor: 2.944

4.  An integrated experimental and quantum-chemical investigation on the vibrational spectra of chlorofluoromethane.

Authors:  Andrea Pietropolli Charmet; Paolo Stoppa; Nicola Tasinato; Santi Giorgianni; Vincenzo Barone; Malgorzata Biczysko; Julien Bloino; Chiara Cappelli; Ivan Carnimeo; Cristina Puzzarini
Journal:  J Chem Phys       Date:  2013-10-28       Impact factor: 3.488

5.  Accuracy Meets Interpretability for Computational Spectroscopy by Means of Hybrid and Double-Hybrid Functionals.

Authors:  Vincenzo Barone; Giorgia Ceselin; Marco Fusè; Nicola Tasinato
Journal:  Front Chem       Date:  2020-10-23       Impact factor: 5.221

  5 in total

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