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Chemistry in Disks. IV. Benchmarking gas-grain chemical models with surface reactions

hal.structure.identifierMax-Planck-Institut für Astronomie [MPIA]
dc.contributor.authorSEMENOV, D.
hal.structure.identifierLaboratoire d'Astrophysique de Bordeaux [Pessac] [LAB]
hal.structure.identifierObservatoire aquitain des sciences de l'univers [OASU]
hal.structure.identifierUniversité Sciences et Technologies - Bordeaux 1 [UB]
hal.structure.identifierLaboratoire d'astrodynamique, d'astrophysique et d'aéronomie de bordeaux [L3AB]
dc.contributor.authorHERSANT, F.
hal.structure.identifierLaboratoire d'Astrophysique de Bordeaux [Pessac] [LAB]
hal.structure.identifierObservatoire aquitain des sciences de l'univers [OASU]
hal.structure.identifierUniversité Sciences et Technologies - Bordeaux 1 [UB]
hal.structure.identifierLaboratoire d'astrodynamique, d'astrophysique et d'aéronomie de bordeaux [L3AB]
dc.contributor.authorWAKELAM, Valentine
hal.structure.identifierLaboratoire d'Astrophysique de Bordeaux [Pessac] [LAB]
hal.structure.identifierObservatoire aquitain des sciences de l'univers [OASU]
hal.structure.identifierUniversité Sciences et Technologies - Bordeaux 1 [UB]
hal.structure.identifierLaboratoire d'astrodynamique, d'astrophysique et d'aéronomie de bordeaux [L3AB]
hal.structure.identifierLaboratoire d'Astrophysique de Grenoble [LAOG]
dc.contributor.authorDUTREY, Anne
hal.structure.identifierLaboratoire d'Astrophysique de Bordeaux [Pessac] [LAB]
hal.structure.identifierObservatoire aquitain des sciences de l'univers [OASU]
hal.structure.identifierUniversité Sciences et Technologies - Bordeaux 1 [UB]
hal.structure.identifierLaboratoire d'astrodynamique, d'astrophysique et d'aéronomie de bordeaux [L3AB]
hal.structure.identifierInstitut de RadioAstronomie Millimétrique [IRAM]
dc.contributor.authorCHAPILLON, E.
hal.structure.identifierLaboratoire d'Astrophysique de Bordeaux [Pessac] [LAB]
hal.structure.identifierObservatoire aquitain des sciences de l'univers [OASU]
hal.structure.identifierUniversité Sciences et Technologies - Bordeaux 1 [UB]
hal.structure.identifierLaboratoire d'astrodynamique, d'astrophysique et d'aéronomie de bordeaux [L3AB]
dc.contributor.authorGUILLOTEAU, S.
hal.structure.identifierMax-Planck-Institut für Astronomie [MPIA]
dc.contributor.authorHENNING, Th.
hal.structure.identifierMax-Planck-Institut für Astronomie [MPIA]
dc.contributor.authorLAUNHARDT, R.
hal.structure.identifierLaboratoire d'Astrophysique de Grenoble [LAOG]
dc.contributor.authorPIETU, V.
dc.contributor.authorSCHREYER, K.
dc.date.created2010
dc.date.issued2010
dc.identifier.issn0004-6361
dc.description.abstractEnAbridged: We detail and benchmark two sophisticated chemical models developed by the Heidelberg and Bordeaux astrochemistry groups. The main goal of this study is to elaborate on a few well-described tests for state-of-the-art astrochemical codes covering a range of physical conditions and chemical processes, in particular those aimed at constraining current and future interferometric observations of protoplanetary disks. We consider three physical models: a cold molecular cloud core, a hot core, and an outer region of a T Tauri disk. Our chemical network (for both models) is based on the original gas-phase osu_03_2008 ratefile and includes gas-grain interactions and a set of surface reactions for the H-, O-, C-, S-, and N-bearing molecules. The benchmarking is performed with the increasing complexity of the considered processes: (1) the pure gas-phase chemistry, (2) the gas-phase chemistry with accretion and desorption, and (3) the full gas-grain model with surface reactions. Using atomic initial abundances with heavily depleted metals and hydrogen in its molecular form, the chemical evolution is modeled within 10^9 years. The time-dependent abundances calculated with the two chemical models are essentially the same for all considered physical cases and for all species, including the most complex polyatomic ions and organic molecules. This result however required a lot of efforts to make all necessary details consistent through the model runs, e.g. definition of the gas particle density, density of grain surface sites, the strength and shape of the UV radiation field, etc. The reference models and the benchmark setup, along with the two chemical codes and resulting time-dependent abundances are made publicly available in the Internet: http://www.mpia.de/homes/semenov/Chemistry_benchmark/home.html
dc.language.isoen
dc.publisherEDP Sciences
dc.subject.enGalaxy Astrophysics
dc.subject.enAstrophysics
dc.subject.enInstrumentation and Methods for Astrophysics
dc.title.enChemistry in Disks. IV. Benchmarking gas-grain chemical models with surface reactions
dc.typeArticle de revue
dc.identifier.doi10.1051/0004-6361/201015149
dc.subject.halPhysique [physics]/Astrophysique [astro-ph]/Instrumentation et méthodes pour l'astrophysique [astro-ph.IM]
dc.subject.halPlanète et Univers [physics]/Astrophysique [astro-ph]/Instrumentation et méthodes pour l'astrophysique [astro-ph.IM]
dc.identifier.arxiv1007.2302
bordeaux.journalAstronomy and Astrophysics - A&A
bordeaux.pageid.A42
bordeaux.volume522
bordeaux.peerReviewedoui
hal.identifierhal-00521687
hal.version1
hal.popularnon
hal.audienceInternationale
hal.origin.linkhttps://hal.archives-ouvertes.fr//hal-00521687v1
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