Binding energies: new values and impact on the efficiency of chemical desorption
arXiv:1701.06492 · doi:10.1016/j.molap.2017.01.002
Abstract
Recent laboratory measurements have confirmed that chemical desorption (desorption of products due to exothermic surface reactions) can be an efficient process. The impact of including this process into gas-grain chemical models entirely depends on the formalism used and the associated parameters. Among these parameters, binding energies are probably the most uncertain ones for the moment. We propose a new model to compute binding energy of species to water ice surfaces. We have also compared the model results using either the new chemical desorption model proposed by Minissale et al. (2016) or the one of Garrod et al. (2007). The new binding energies have a strong impact on the formation of complex organic molecules. In addition, the new chemical desorption model from Minissale produces a much smaller desorption of these species and also of methanol. Combining the two effects, the abundances of CH3OH and COMs observed in cold cores cannot be reproduced by astrochemical models anymore.
References in corpus (9)
- Formation of methyl formate and other organic species in the warm-up phase of hot molecular cores
- Non-thermal desorption from interstellar dust grains via exothermic surface reactions
- The 2014 KIDA network for interstellar chemistry
- Simulation of the Formation and Morphology of Ice Mantles on Interstellar Grains
- The origin of complex organic molecules in prestellar cores
- Desorption From Interstellar Ices
- Hydrogenation at low temperatures does not always lead to saturation: the case of HNCO
- A New Determination of the Binding Energy of Atomic Oxygen on Dust Grain Surfaces: Experimental Results and Simulations
- Chemical modeling of water deuteration in IRAS16293-2422
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- Molecules with ALMA at Planet-forming Scales (MAPS) I: Program Overview and Highlights
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- The Perseus ALMA Chemistry Survey (PEACHES). I. The Complex Organic Molecules in Perseus Embedded Protostars
- The interstellar chemistry of C3H and C3H2 isomers
- Gas phase Elemental abundances in Molecular cloudS (GEMS). II. On the quest for the sulphur reservoir in molecular clouds: the case
- Reactivity of HCO with CH3 and NH2 on Water Ice Surfaces. A Comprehensive Accurate Quantum Chemistry Study
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- The ALMA-PILS survey: First detection of the unsaturated 3-carbon molecules Propenal (CHCHO) and Propylene (CH) towards IRAS 162932422 B
- Gas phase Elemental abundances in Molecular cloudS (GEMS). IV. Observational results and statistical trends
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- Binding Energy Evaluation Platform: A database of quantum chemical binding energy distributions for the astrochemical community
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- Surface Diffusion of Carbon Atoms as a Driver of Interstellar Organic Chemistry
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- Transmission Electron Microscopy Study of the Morphology of Ices Composed of H2O, CO2, and CO on Refractory Grains
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- Dust-gas chemistry in AGB outflows: Chemical modelling of dust-gas chemistry within AGB outflows I. Effect on the gas-phase chemistry
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- Is there any linkage between interstellar aldehyde and alcohol?
- Cosmic ray sputtering yield of interstellar ice mantles: CO and CO2 ice thickness dependence
- AB Aur, a Rosetta stone for studies of planet formation (II): HS detection and sulfur budget
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- The KOSMA- PDR Model -- I. Recent updates to the numerical model of photo-dissociated regions
- Modeling chemistry during star formation: Water deuteration in dynamic star-forming regions
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