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Formation of carbon monoxide by radiative association: a quantum dynamical study

Abstract

Rate coefficients for the formation of carbon monoxide (CO) by radiative association of carbon and oxygen atoms are computed using quantum dynamical simulations. At temperatures above 10 K CO radiative association is dominated by C(3P) and O(3P) approaching on the A1Π potential energy curve. The rate coefficient is estimated as k=A(T/300 K)αexp−β/T with A= 1.39 × 10−18 cm3 s−1, α=−0.016 and β= 92.2 for temperatures between 6 and 127.2 K, and A= 1.36 × 10−17 cm3 s−1, α= 0.41 and β= 340 for temperatures between 127.2 and 15 000 K. Furthermore we computed the rate coefficients for approaching on the X1Σ+ curve. For temperatures below 200 K it is between 0.7 × 10−22 and 4 × 10−22 cm3 s−1.

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Authors (3)

  • Photo of dr hab. Jan Franz

    Jan Franz dr hab.

    • University of Gothenburg Department of Chemistry
  • Photo of  Magnus Gustafsson

    Magnus Gustafsson

    • University of Gothenburg Department of Chemistry and Molecular Biology
  • Photo of  Gunnar Nyman

    Gunnar Nyman

    • University of Gothenburg Department of Chemistry and Molecular Biology

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Details

Category:
Articles
Type:
artykuł w czasopiśmie wyróżnionym w JCR
Published in:
MONTHLY NOTICES OF THE ROYAL ASTRONOMICAL SOCIETY no. 414, edition 4, pages 3547 - 3550,
ISSN: 0035-8711
Language:
English
Publication year:
2011
Bibliographic description:
Franz J., Gustafsson M., Nyman G.: Formation of carbon monoxide by radiative association: a quantum dynamical study// MONTHLY NOTICES OF THE ROYAL ASTRONOMICAL SOCIETY. -Vol. 414, iss. 4 (2011), s.3547-3550
DOI:
Digital Object Identifier (open in new tab) 10.1111/j.1365-2966.2011.18654.x
Verified by:
Gdańsk University of Technology

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