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Audrey Coutens

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A Review on the Controlling Parameters and Their Implications from Snowlines to Chemical Complexity

Review (2022) - Marco Minissale, Yuri Aikawa, Edwin Bergin, Mathieu Bertin, Wendy A. Brown, Stephanie Cazaux, Steven B. Charnley, Audrey Coutens, Herma M. Cuppen, More Authors...
The evolution of star-forming regions and their thermal balance are strongly influenced by their chemical composition, which, in turn, is determined by the physicochemical processes that govern the transition between the gas phase and the solid state, specifically icy dust grains (e.g., particle adsorption and desorption). Gas-grain and grain-gas transitions as well as formation and sublimation of interstellar ices are thus essential elements of understanding astrophysical observations of cold environments (e.g., prestellar cores) where unexpected amounts of a large variety of chemical species have been observed in the gas phase. Adsorbed atoms and molecules also undergo chemical reactions that are not efficient in the gas phase. Therefore, the parametrization of the physical properties of atoms and molecules interacting with dust grain particles is clearly a key aspect to interpret astronomical observations and to build realistic and predictive astrochemical models. In this consensus evaluation, we focus on parameters controlling the thermal desorption of ices and how these determine pathways toward molecular complexity and define the location of snowlines, which ultimately influence the planet formation process. We review different crucial aspects of desorption parameters both from a theoretical and experimental points of view. We critically assess the desorption parameters (the binding energies, Eb, and the pre-exponential factor, ν) commonly used in the astrochemical community for astrophysically relevant species and provide tables with recommended values. The aim of these tables is to provide a coherent set of critically assessed desorption parameters for common use in future work. In addition, we show that a nontrivial determination of the pre-exponential factor ν using transition state theory can affect the binding energy value. The primary focus is on pure ices, but we also discuss the desorption behavior of mixed, that is, astronomically more realistic, ices. This allows discussion of segregation effects. Finally, we conclude this work by discussing the limitations of theoretical and experimental approaches currently used to determine the desorption properties with suggestions for future improvements. ...

I. An investigation of the isomers CH3NCO and HOCH2CN

Journal article (2021) - N. F. W. Ligterink, A. Ahmadi, A. Coutens, Ł. Tychoniec, H. Calcutt, E. F. van Dishoeck, H. Linnartz, J. K. Jørgensen, R. T. Garrod, J. Bouwman
Aims. Methyl isocyanate (CH3NCO) and glycolonitrile (HOCH2CN) are isomers and prebiotic molecules that are involved in the formation of peptide structures and the nucleobase adenine, respectively. These two species are investigated to study the interstellar chemistry of cyanides (CN) and isocyanates (NCO) and to gain insight into the reservoir of interstellar prebiotic molecules.Methods. ALMA observations of the intermediate-mass Class 0 protostar Serpens SMM1-a and ALMA-PILS data of the low-mass Class 0 protostar IRAS 16293B are used. Spectra are analysed with the CASSIS line analysis software package in order to identify and characterise molecules.Results. CH3NCO, HOCH2CN, and various other molecules are detected towards SMM1-a. HOCH2CN is identified in the PILS data towards IRAS 16293B in a spectrum extracted at a half-beam offset position from the peak continuum. CH3NCO and HOCH2CN are equally abundant in SMM1-a at [X]/[CH3OH] of 5.3 × 10−4 and 6.2 × 10−4, respectively. A comparison between SMM1-a and IRAS 16293B shows that HOCH2CN and HNCO are more abundant in the former source, but CH3NCO abundances do not differ significantly. Data from other sources are used to show that the [CH3NCO]/[HNCO] ratio is similar in all these sources within ~10%.Conclusions. The new detections of CH3NCO and HOCH2CN are additional evidence for a large interstellar reservoir of prebiotic molecules that can contribute to the formation of biomolecules on planets. The equal abundances of these molecules in SMM1-a indicate that their formation is driven by kinetic processes instead of thermodynamic equilibrium, which would drive the chemistry to one product. HOCH2CN is found to be much more abundant in SMM1-a than in IRAS 16293B. From the observational data, it is difficult to indicate a formation pathway for HOCH2CN, but the thermal Strecker-like reaction of CN− with H2CO is a possibility. The similar [CH3NCO]/[HNCO] ratios found in the available sample of studied interstellar sources indicate that these two species are either chemically related or their formation is affected by physical conditions in the same way. Both species likely form early during star formation, presumably via ice mantle reactions taking place in the dark cloud or when ice mantles are being heated in the hot core. The relatively high abundances of HOCH2CN and HNCO in SMM1-a may be explained by a prolonged stage of relatively warm ice mantles, where thermal and energetic processing of HCN in the ice results in the efficient formation of both species.</jats:p> ...
Journal article (2020) - S. Manigand, J. K. Jørgensen, H. Calcutt, H. S. P. Müller, N. F. W. Ligterink, A. Coutens, M. N. Drozdovskaya, E. F. van Dishoeck, S. F. Wampfler
Context. Complex organic molecules are detected in many sources in the warm inner regions of envelopes surrounding deeply embedded protostars. Exactly how these species form remains an open question. Aims. This study aims to constrain the formation of complex organic molecules through comparisons of their abundances towards the Class 0 protostellar binary IRAS 16293-2422. Methods. We utilised observations from the ALMA Protostellar Interferometric Line Survey of IRAS 16293-2422. The species identification and the rotational temperature and column density estimation were derived by fitting the extracted spectra towards IRAS 16293-2422 A and IRAS 16293-2422 B with synthetic spectra. The majority of the work in this paper pertains to the analysis of IRAS 16293-2422 A for a comparison with the results from the other binary component, which have already been published. Results. We detect 15 different complex species, as well as 16 isotopologues towards the most luminous companion protostar IRAS 16293-2422 A. Tentative detections of an additional 11 isotopologues are reported. We also searched for and report on the first detections of methoxymethanol (CH3OCH2OH) and trans-ethyl methyl ether (t-C2H5OCH3) towards IRAS 16293-2422 B and the follow-up detection of deuterated isotopologues of acetaldehyde (CH2DCHO and CH3CDO). Twenty-four lines of doubly-deuterated methanol (CHD2OH) are also identified. Conclusions. The comparison between the two protostars of the binary system shows significant differences in abundance for some of the species, which are partially correlated to their spatial distribution. The spatial distribution is consistent with the sublimation temperature of the species; those with higher expected sublimation temperatures are located in the most compact region of the hot corino towards IRAS 16293-2422 A. This spatial differentiation is not resolved in IRAS 16293-2422 B and will require observations at a higher angular resolution. In parallel, the list of identified CHD2OH lines shows the need of accurate spectroscopic data including their line strength. ...
Journal article (2019) - A. Coutens, N. F. W. Ligterink, J.-C. Loison, V. Wakelam, H. Calcutt, M. N. Drozdovskaya, J. K. Jørgensen, H. S. P. Müller, E. F. van Dishoeck, S. F. Wampfler
Nitrogen oxides are thought to play a significant role as a nitrogen reservoir and to potentially participate in the formation of more complex species. Until now, only NO, NO, and HNO have been detected in the interstellar medium. We report the first interstellar detection of nitrous acid (HONO). Twelve lines were identified towards component B of the low-mass protostellar binary IRAS 16293-2422 with the Atacama Large Millimeter/submillimeter Array, at the position where NO and NO have previously been seen. A local thermodynamic equilibrium model was used to derive the column density (∼9 × 1014 cm in a 0 .″5 beam) and excitation temperature (∼100 K) of this molecule. HNO, NO, NO+, and HNO3 were also searched for in the data, but not detected. We simulated the HONO formation using an updated version of the chemical code Nautilus and compared the results with the observations. The chemical model is able to reproduce satisfactorily the HONO, NO, and NO abundances, but not the NO, HNO, and NHOH abundances. This could be due to some thermal desorption mechanisms being destructive and therefore limiting the amount of HNO and NHOH present in the gas phase. Other options are UV photodestruction of these species in ices or missing reactions potentially relevant at protostellar temperatures. ...
Journal article (2018) - N. F. W. Ligterink, H. Calcutt, A. Coutens, L. E. Kristensen, T. L. Bourke, M. N. Drozdovskaya, H. S. P. Müller, S. F. Wampfler, M. H. D. van der Wiel, More Authors...
Journal article (2017) - Niels Ligterink, A. Coutens, V. Kofman, H. S. P. Müller, R. T. Garrod, H. Calcutt, S. F. Wampfler, J. K. Jørgensen, H. Linnartz, E. F. van Dishoeck
Journal article (2013) - A. Coutens, C. Vastel, S. Cazaux, S. Bottinelli, E. Caux, C. Ceccarelli, K. Demyk, V. Taquet, Valentine Wakelam
Context. Despite the low elemental deuterium abundance in the Galaxy, enhanced molecular deuterium fractionation has been found in the environments of low-mass star-forming regions and, in particular, the Class 0 protostar IRAS 16293-2422. Aims. The key program Chemical HErschel Surveys of Star forming regions (CHESS) aims at studying the molecular complexity of the interstellar medium. The high sensitivity and spectral resolution of the Herschel/HIFI (Heterodyne Instrument for Far-Infrared) instrument provide a unique opportunity to observe the fundamental 11,1-00,0 transition of ortho-D2O at 607 GHz and the higher energy 21,2-1 0,1 transition of para-D2O at 898 GHz, both of which are inaccessible from the ground. Methods. The ortho-D2O transition at 607 GHz was previously detected. We present in this paper the first tentative detection for the para-D2O transition at 898 GHz. The spherical Monte Carlo radiative transfer code RATRAN was used to reproduce the observed line profiles of D2O with the same method that was used to reproduce the HDO and H218O line profiles in IRAS 16293-2422. Results. As for HDO, the absorption component seen on the D2O lines can only be reproduced by adding an external absorbing layer, possibly created by the photodesorption of the ices at the edges of the molecular cloud. The D 2O column density is found to be about 2.5 × 1012 cm-2 in this added layer, leading to a D2O/H2O ratio of about 0.5%. At a 3σ uncertainty, upper limits of 0.03% and 0.2% are obtained for this ratio in the hot corino and the colder envelope of IRAS 16293-2422, respectively. Conclusions. The deuterium fractionation derived in our study suggests that the ices present in IRAS 16293-2422 formed on warm dust grains (~15-20 K) in dense (~104-5 × 104 cm -3) translucent clouds. These results allow us to address the earliest phases of star formation and the conditions in which ices form. ...