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A&A 483, 495-508 (2008)
DOI: 10.1051/0004-6361:20078612

The role of carbon grains in the deuteration of H2

S. Cazaux1, P. Caselli2, V. Cobut3, and J. Le Bourlot4

1  Kapteyn Astronomical Institute, PO box 800, 9700AV Groningen, The Netherlands
    e-mail: [cazaux;S.M.Cazaux]@astro.rug.nl
2  School of Physics and Astronomy, University of Leeds, LS2 9JT, Leeds, UK
3  Laboratoire pour l'Étude du Rayonnement et de la Matière, UMR 8112 du CNRS, Observatoire de Paris et Université de Cergy-Pontoise, 5 mail Gay-Lussac, 95031 Cergy-Pontoise Cedex, France
4  LUTH, UMR 8102 CNRS, Universite Paris 7 and Observatoire de Paris, Place J. Janssen, 92195 Meudon, France

(Received 4 September 2007 / Accepted 19 February 2008)

Abstract
Aims. The production of molecular hydrogen and its deuterated forms onto carbonaceous dust grains is investigated in detail. The goal of this study is to estimate the importance of the chemistry occuring on grain surfaces for the deuteration of H2. Furthermore, we aim to find a robust and general surface chemical model that can be used in different astrophysical environments.
Methods. Surface processes are described for the cases of graphitic and amorphous-carbon grains, where laboratory work is available. Langmuir-Hinshelwood, as well as Eley-Rideal surface chemistries are included in the model and their relative contributions highlighted. Analytic expressions are derived for H2, HD, and D2 formation efficiencies for both types of grains. Rate equations are tested against stochastic methods.
Results. As expected, rate equations and stochastic methods diverge for grain sizes below a critical value $a_{\rm crit}$. For these sizes, D2 formation decreases to favour HD formation. The formation efficiencies of H2 and D2 can be calculated by adding a correction factor to the rate equations methods (this factor is a simple exponential factor that becomes unity when $a > a_{\rm crit}$). We find that, because of the presence of chemisorbed sites, which can store atoms to form molecules up to high grain temperatures, the formation efficiency of HD and D2 is very high compared to models where only physisorption sites are taken into account. When considering a realistic distribution of dust grains, we find that the formation rates of H2 and HD are enhanced by an order of magnitude if small grains are taken into account. The formation of D2, on the other hand, comes from the contribution of small ($\le$100 Å) and big ($\ge$100 Å) grains, depending on the D/H ratio, the grain temperature, and the volume density. The processes described in this paper, which allow a strong enhancement of the deuterated forms of molecular hydrogen, could explain the high degree of deuterium fractionation observed in protostellar environments.


Key words: ISM: dust, extinction -- ISM: molecules



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