Ortho-para-H2 conversion processes in astrophysical media

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TitreOrtho-para-H2 conversion processes in astrophysical media
Type de publicationJournal Article
Year of Publication2014
AuteursLique F, Honvault P, Faure A
JournalINTERNATIONAL REVIEWS IN PHYSICAL CHEMISTRY
Volume33
Pagination125-149
Date PublishedJAN 2
Type of ArticleReview
ISSN0144-235X
Mots-clésastrochemistry, chemical reaction, reactive scattering
Résumé

We report in this review recent fully quantum time-independent calculations of cross sections and rate constants for the gas phase ortho-to-para conversion of H-2 by H and H+. Such processes are of crucial interest and importance in various astrophysical environments. The investigated temperature ranges were 10-1500 K for H+H-2 and 10-100 K for H+ + H-2. Calculations were based on highly accurate H-3 and H-3(+) global potential energy surfaces. Comparisons with previous calculations and with available measurements are presented and discussed. It is shown that the existence of a long-lived intermediate complex H-3(+) in the (barrierless) H+ + H-2 reaction give rise to a pronounced resonance structure and a statistical behaviour, in contrast to H + H-2 which proceeds through a barrier of similar to 5000K. In the cold interstellar medium (T <= 100 K), the ortho-to-para conversion is thus driven by proton exchange while above similar to 300K, the contribution of hydrogen atoms become significant or even dominant. Astrophysical applications are briefly discussed by comparing, in particular, the relative role of the conversion processes in the gas phase (via H, H+, H-2 and H-3(+)) and on the surface of dust particles. Perspectives concerning future calculations at higher temperatures are outlined.

DOI10.1080/0144235X.2014.897443