arXiv subjects

Cecilia Ceccarelli

Publications and source records attributed to Cecilia Ceccarelli.

At least 37 records · Page 2Linked to original sources

arXiv2023

SUNRISE: The rich molecular inventory of high-redshift dusty galaxies revealed by broadband spectral line surveys

Understanding the nature of high-$z$ dusty galaxies requires a comprehensive view of their ISM and molecular complexity. However, the molecular ISM at high-$z$ is commonly studied using only a few species beyond CO, limiting our understanding. In this paper, we present the results of deep 3 mm spectral line surveys using the NOEMA targeting two lensed dusty galaxies: APM 08279+5255 (APM), a quasar at redshift $z=3.911$, and NCv1.143 (NC), a $z=3.565$ starburst galaxy. The spectral line surveys cover rest-frame frequencies from about 330-550 GHz. We report the detection of 38 and 25 emission lines in APM and NC, respectively. The spectra reveal the chemical richness and the complexity of the physical properties of the ISM. By comparing the spectra of the two sources and combining the gas excitation analysis, we find that the physical properties and the chemical imprints of the ISM are different between them: the molecular gas is more excited in APM, exhibiting higher molecular-gas temperatures and densities compared to NC; the chemical abundances in APM are akin to the values of local AGN, showing boosted relative abundances of the dense gas tracers that might be related to high-temperature chemistry and/or XDRs, while NC more closely resembles local starburst galaxies. The most significant differences are found in H2O, where the 448GHz H2O line is significantly brighter in APM, likely linked to the intense far-infrared radiation from the dust powered by AGN. Our astrochemical model suggests that at such high column densities, FUV radiation is less important in regulating the ISM, while CRs (X-rays/shocks) are the key players in shaping the abundance of the molecules and the initial conditions of star formation. Such deep spectral line surveys open a new window to study the physical and chemical properties of the ISM and the radiation field of galaxies in the early Universe. (abridged)

astro-ph.GA↗

arXiv2023

Revised gas-phase formation network of methyl cyanide: the origin of methyl cyanide and methanol abundance correlation in hot corinos

Methyl cyanide (CH$_3$CN) is one of the most abundant and widely spread interstellar complex organic molecules (iCOMs). Several studies found that, in hot corinos, methyl cyanide and methanol abundances are correlated suggesting a chemical link, often interpreted as a synthesis of them on the interstellar grain surfaces. In this article, we present a revised network of the reactions forming methyl cyanide in the gas-phase. We carried out an exhaustive review of the gas-phase CH$_3$CN formation routes, propose two new reactions and performed new quantum mechanics computations of several reactions. We found that 13 of the 15 reactions reported in the databases KIDA and UDfA have incorrect products and/or rate constants. The new corrected reaction network contains 10 reactions leading to methyl cyanide. We tested the relative importance of those reactions in forming CH$_3$CN using our astrochemical model. We confirm that the radiative association of CH${_3}{^+}$ and HCN, forming CH$_{3}$CNH$^{+}$, followed by the electron recombination of CH$_{3}$CNH$^{+}$, is the most important CH$_3$CN formation route in both cold and warm environments, notwithstanding that we significantly corrected the rate constants and products of both reactions. The two newly proposed reactions play an important role in warm environments. Finally, we found a very good agreement between the CH$_3$CN predicted abundances with those measured in cold ($\sim$10 K) and warm ($\sim$90 K) objects. Unexpectedly, we also found a chemical link between methanol and methyl cyanide via the CH$_{3}^{+}$ ion, which can explain the observed correlation between the CH$_3$OH and CH$_3$CN abundances measured in hot corinos.

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arXiv2023

FAUST X: Formaldehyde in the Protobinary System [BHB2007] 11: Small Scale Deuteration

Context. Deuterium in H-bearing species is enhanced during the early stages of star formation, however, only a small number of high spatial resolution deuteration studies exist towards protostellar objects, leaving the small-scale structures unrevealed and understudied. Aims. We aim to constrain the deuterium fractionation ratios in a Class 0/I protostellar object in formaldehyde (H2CO), which has abundant deuterated isotopologues in this environment. Methods. We observed the Class 0/I protobinary system [BHB2007] 11, whose emission components are embedded in circumstellar disks that have radii of 2-3 au, using ALMA within the context of the Large Program FAUST. The system is surrounded by a complex filamentary structure connecting to the larger circumbinary disk. In this work we present the first study of formaldehyde D-fractionation towards this source with detections of H2CO 3(0,3)-2(0,2), combined with HDCO 4(2,2)-3(2,1), HDCO 4(1,4)-3(1,3) and D2CO 4(0,4)-3(0,3). These observations enable multiple velocity components associated with the methanol hotspots also uncovered by FAUST data, as well as the external envelope, to be resolved. In addition, based on the kinematics seen in the observations of the H2CO emission, we propose the presence of a second large scale outflow. Results. HDCO and D2CO are only found in the central regions of the core while H2CO is found more ubiquitously. From radiative transfer modelling, the column densities ranges found for H2CO, HDCO and D2CO are (3-8)x10$^{14}$ cm$^{-2}$, (0.8-2.9)x10$^{13}$ cm$^{-2}$ and (2.6-4.3)x10$^{12}$ cm$^{-2}$, respectively, yielding an average D/H ratio of 0.01-0.04. Following the results of kinematic modelling, the second large scale feature is inconsistent with a streamer-like nature and we thus tentatively conclude that the feature is an asymmetric molecular outflow launched by a wide-angle disk wind.

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arXiv2023

Quantum mechanical modeling of the grain-surface formation of acetaldehyde on H$_2$O:CO dirty ice surfaces

Acetaldehyde (CH$_3$CHO) is one of the most detected interstellar Complex Organic Molecule (iCOM) in the interstellar medium (ISM). These species have a potential biological relevance, as they can be precursors of more complex species from which life could have emerged. The formation of iCOMs in the ISM is a challenge and a matter of debate, whether gas-phase, grain-surface chemistry or both are needed for their synthesis. In the gas-phase, CH$_3$CHO can be efficiently synthesized from ethanol and/or ethyl radical. On the grain-surfaces, radical-radical recombinations were traditionally invoked. However, several pitfalls have been recently identified, such as the presence of energy barriers and competitive side reactions (i.e., H abstractions). Here we investigate a new grain-surface reaction pathway for the formation of acetaldehyde, namely the reaction between CH$_3$ and a CO molecule of a dirty water/CO ice followed by hydrogenation of its product, CH$_3$CO. To this end, we carried out \textit{ab initio} computations of the reaction occurring on an ice composed by 75% water and 25% CO molecules. We found that the CH$_3$ + CO$_{(ice)}$ reaction exhibits barriers difficult to overcome in the ISM, either adopting a Langmuir-Hinshelwood or an Eley-Rideal mechanism. The subsequent hydrogenation step is found to be barrierless, provided that the two reacting species have the correct orientation. Therefore, this pathway seems unlikely to occur in the ISM.

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arXiv2023

Streamers feeding the SVS13-A protobinary system: astrochemistry reveals accretion shocks?

We report ALMA high-angular resolution (~ 50 au) observations of the binary system SVS13-A. More specifically, we analyse deuterated water (HDO) and sulfur dioxide (SO2) emission. The molecular emission is associated with both the components of the binary system, VLA4A and VLA4B. The spatial distribution is compared to that of formamide (NH2CHO), previously analysed in the system. Deuterated water reveals an additional emitting component spatially coincident with the dust accretion streamer, at a distance larger than 120 au from the protostars, and at blue-shifted velocities (> 3 km/s from the systemic velocities). We investigate the origin of the molecular emission in the streamer, in light of thermal sublimation temperatures calculated using updated binding energies (BE) distributions. We propose that the observed emission is produced by an accretion shock at the interface between the accretion streamer and the disk of VLA4A. Thermal desorption is not completely excluded in case the source is actively experiencing an accretion burst.

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arXiv2023

Formation of complex organic molecules on interstellar CO ices? Insights from computational chemistry simulations

Carbon ($^3$P) atom is a reactive species that, according to laboratory experiments and theoretical calculations, condensates with interstellar ice components. This fact is of uttermost importance for the chemistry in the interstellar medium (ISM) because the condensation reaction is barrierless and the subsequent species formed are still reactive given their open-shell character. Carbon condensation on CO-rich ices forms the \ch{C=C=O} ($^3$$Σ$$^-$) species, which can be easily hydrogenated twice to form ketene (H$_2$CCO). Ketene is very reactive in terrestrial conditions, usually found as an intermediate hard to be isolated in chemical synthesis laboratories. These characteristics suggest that ketene can be a good candidate to form interstellar complex organic molecules (iCOMs) via a two-step process, i.e., its activation followed by a radical-radical coupling. In this work, reactions between ketene and atomic H, and the OH and NH$_2$ radicals on a CO-rich ice model have been explored by means of quantum chemical calculations complemented by kinetic calculations to evaluate if they are favourable in the ISM. Results indicate that H addition to ketene (helped by tunneling) to form the acetyl radical (CH$_3$CO) is the most preferred path, as the reactions with OH and NH$_2$ possess activation energies ($\geq$ 9kJ/mol) hard to surmount in the ISM conditions, unless external processes provide energy to the system. Thus, acetaldehyde (CH$_3$CHO) and, probably, ethanol (CH$_3$CH$_2$OH) formation via further hydrogenations are the possible unique operating synthetic routes. Moreover, from the computed relatively large binding energies of OH and NH$_2$ on CO ice, slow diffusion is expected, hampering possible radical-radical couplings with CH$_3$CO. The astrophysical implications of these findings are discussed considering the incoming James Webb Space Telescope observations.

astro-ph.GA↗

arXiv2023

FAUST VII. Detection of A Hot Corino in the Prototypical Warm Carbon-Chain Chemistry Source IRAS 15398-3359

We have observed the low-mass protostellar source, IRAS 15398$-$3359, at a resolution of 0.$''$2-0.$''$3, as part of the Atacama Large Millimeter/Submillimeter Array Large Program FAUST, to examine the presence of a hot corino in the vicinity of the protostar. We detect nine CH$_3$OH lines including the high excitation lines with upper state energies up to 500 K. The CH$_3$OH rotational temperature and the column density are derived to be 119$^{+20}_{-26}$ K and 3.2$^{+2.5}_{-1.0}\times$10$^{18}$ cm$^{-2}$, respectively. The beam filling factor is derived to be 0.018$^{+0.005}_{-0.003}$, indicating that the emitting region of CH$_3$OH is much smaller than the synthesized beam size and is not resolved. The emitting region of three high excitation lines, 18$_{3,15}-18_{2,16}$, A ($E_u=$447 K), 19$_{3,16}-19_{2,17}$, A ($E_u=$491 K), and 20$_{3,17}-20_{2,18}$, A ($E_u=$537 K), is located within the 50 au area around the protostar, and seems to have a slight extension toward the northwest. Toward the continuum peak, we also detect one emission line from CH$_2$DOH and two features of multiple CH$_3$OCHO lines. These results, in combination with previous reports, indicate that IRAS 15398$-$3359 is a source with hybrid properties showing both hot corino chemistry rich in complex organic molecules on small scales $\sim$10 au) and warm carbon-chain chemistry (WCCC) rich in carbon-chain species on large scales ($\sim$100-1000 au). A possible implication of the small emitting region is further discussed in relation to the origin of the hot corino activity.

astro-ph.SR↗

arXiv2023

The GRETOBAPE gas-phase reaction network: the importance of being exothermic

The gas-phase reaction networks are the backbone of astrochemical models. However, due to their complexity and non-linear impact on the astrochemical modeling, they can be the first source of error in the simulations if incorrect reactions are present. Over time, following the increasing number of species detected, astrochemists have added new reactions, based on laboratory experiments and quantum mechanics (QM) computations as well as reactions inferred by chemical intuition and similarity principle. However, sometimes no verification of their feasibility in the interstellar conditions, namely their exothermicity, was performed. In this work, we present a new gas-phase reaction network, GRETOBAPE, based on the KIDA2014 network and updated with several reactions, cleaned from endothermic reactions not explicitly recognized as such. To this end, we characterized all the species in the GRETOBAPE network with accurate QM calculations. We found that 5% of the reactions in the original network are endothermic although most of them are reported as barrierless. The reaction network of Si-bearing species is the most impacted by the endothermicity cleaning process. We also produced a cleaned reduced network, GRETOBAPE-red, to be used to simulate astrochemical situations where only C-, O-, N- and S- bearing species with less than 6 atoms are needed. Finally, the new GRETOBAPE network, its reduced version, as well as the database with all the molecular properties are made publicly available. The species properties database can be used in the future to test the feasibility of possibly new reactions.

astro-ph.GA↗

arXiv2023

Cyanopolyyne chemistry in the L1544 prestellar core: new insights from GBT observations

We report a comprehensive study of the cyanopolyyne chemistry in the prototypical prestellar core L1544. Using the 100m Robert C. Byrd Green Bank Telescope (GBT) we observe 3 emission lines of HC$_3$N, 9 lines of HC$_5$N, 5 lines of HC$_7$N, and 9 lines of HC$_9$N. HC$_9$N is detected for the first time towards the source. The high spectral resolution ($\sim$ 0.05 km s$^{-1}$) reveals double-peak spectral line profiles with the redshifted peak a factor 3-5 brighter. Resolved maps of the core in other molecular tracers indicates that the southern region is redshifted. Therefore, the bulk of the cyanopolyyne emission is likely associated with the southern region of the core, where free carbon atoms are available to form long chains, thanks to the more efficient illumination of the interstellar field radiation. We perform a simultaneous modelling of the HC$_5$N, HC$_7$N, and HC$_9$N lines, to investigate the origin of the emission. To enable this analysis, we performed new calculation of the collisional coefficients. The simultaneous fitting indicates a gas kinetic temperature of 5--12 K, a source size of 80$\arcsec$, and a gas density larger than 100 cm$^{-3}$. The HC$_5$N:HC$_7$N:HC$_9$N abundance ratios measured in L1544 are about 1:6:4. We compare our observations with those towards the the well-studied starless core TMC-1 and with the available measurements in different star-forming regions. The comparison suggests that a complex carbon chain chemistry is active in other sources and it is related to the presence of free gaseous carbon. Finally, we discuss the possible formation and destruction routes in the light of the new observations.

astro-ph.GA↗

arXiv2022

Where does the energy go during the interstellar NH$_3$ formation on water ice? A computational study

In the coldest (10--20 K) regions of the interstellar medium, the icy surfaces of interstellar grains serve as solid-state supports for chemical reactions. Among their plausible roles, that of third body is advocated, in which the reaction energies of surface reactions dissipate throughout the grain, stabilizing the product. This energy dissipation process is poorly understood at the atomic scale, although it can have a high impact on Astrochemistry. Here, we study, by means of quantum mechanical simulations, the formation of NH3 via successive H-additions to atomic N on water ice surfaces, paying special attention to the third body role. We first characterize the hydrogenation reactions and the possible competitive processes (i.e., H-abstractions), in which the H-additions are more favourable than the H-abstractions. Subsequently, we study the fate of the hydrogenation reaction energies by means of ab initio molecular dynamics simulations. Results show that around 58--90\% of the released energy is quickly absorbed by the ice surface, inducing a temporary increase of the ice temperature. Different energy dissipation mechanisms are distinguished. One mechanism, more general, is based on the coupling of the highly excited vibrational modes of the newly formed species and the libration modes of the icy water molecules. A second mechanism, exclusive during the NH$_3$ formation, is based on the formation of a transient H$_3$O$^+$/NH$_2^-$ ion pair, which significantly accelerates the energy transfer to the surface. Finally, the astrophysical implications of our findings relative to the interstellar synthesis of NH$_3$ and its chemical desorption into the gas are discussed.

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arXiv2022

We Drink Good 4.5-Billion-Year-Old Water

Water is crucial for the emergence and evolution of life on Earth. Recent studies of the water content in early forming planetary systems similar to our own show that water is an abundant and ubiquitous molecule, initially synthesized on the surfaces of tiny interstellar dust grains by the hydrogenation of frozen oxygen. Water then enters a cycle of sublimation/freezing throughout the successive phases of planetary system formation, namely, hot corinos and protoplanetary disks, eventually to be incorporated into planets, asteroids, and comets. The amount of heavy water measured on Earth and in early forming planetary systems suggests that a substantial fraction of terrestrial water was inherited from the very first phases of the Solar System formation and is 4.5 billion years old.

astro-ph.EP↗

arXiv2022

Stratified Distribution of Organic Molecules at the Planet-Formation Scale in the HH 212 Disk Atmosphere

Formamide (NH2CHO) is considered an important prebiotic molecule because of its potential to form peptide bonds. It was recently detected in the atmosphere of the HH 212 protostellar disk on the Solar-System scale where planets will form. Here we have mapped it and its potential parent molecules HNCO and H2CO, along with other molecules CH3OH and CH3CHO, in the disk atmosphere, studying its formation mechanism. Interestingly, we find a stratified distribution of these molecules, with the outer emission radius increasing from ~ 24 au for NH2CHO and HNCO, to 36 au for CH3CHO, to 40 au for CH3OH, and then to 48 au for H2CO. More importantly, we find that the increasing order of the outer emission radius of NH2CHO, CH3OH, and H2CO is consistent with the decreasing order of their binding energies, supporting that they are thermally desorbed from the ice mantle on dust grains. We also find that HNCO, which has much lower binding energy than NH2CHO, has almost the same spatial distribution, kinematics, and temperature as NH2CHO, and is thus more likely a daughter species of desorbed NH2CHO. On the other hand, we find that H2CO has a more extended spatial distribution with different kinematics from NH2CHO, thus questioning whether it can be the gas-phase parent molecule of NH2CHO.

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arXiv2022

Tracking the ice mantle history in the Solar-type Protostars of NGC 1333 IRAS 4

To understand the origin of the diversity observed in exoplanetary systems, it is crucial to characterize the early stages of their formation, represented by Solar-type protostars. Likely, the gaseous chemical content of these objects directly depends on the composition of the dust grain mantles formed before the collapse. Directly retrieving the ice mantle composition is challenging, but it can be done indirectly by observing the major components, such as NH3 and CH3OH at cm wavelengths, once they are released into the gas-phase during the warm protostellar stage. We observed several CH3OH and NH3 lines toward three Class 0 protostars in NGC1333 (IRAS 4A1, IRAS 4A2, and IRAS 4B), at high angular resolution (1"; ~300 au) with the VLA interferometer at 24-26 GHz. Using a non-LTE LVG analysis, we derived a similar NH3/CH3OH abundance ratio in the three protostars (<0.5, 0.015-0.5, and 0.003-0.3 for IRAS 4A1, 4A2, and 4B, respectively). Hence, we infer they were born from pre-collapse material with similar physical conditions. Comparing the observed abundance ratios with astrochemical model predictions, we constrained the dust temperature at the time of the mantle formation to be ~17 K, which coincides with the average temperature of the southern NGC 1333 diffuse cloud. We suggest that a brutal event started the collapse that eventually formed IRAS 4A1, 4A2 and 4B, which,therefore, did not experience the usual pre-stellar core phase. This event could be the clash of a bubble with NGC 1333 south, that has previously been evoked in the literature.

astro-ph.SR↗

arXiv2022

Theoretical distribution of the ammonia binding energy at interstellar icy grains: a new computational framework

The binding energies (BE) of molecules on the interstellar grains are crucial in the chemical evolution of the interstellar medium (ISM). Both temperature programmed desorption (TPD) laboratory experiments and quantum chemistry computations have often provided, so far, only single values of the BE for each molecule. This is a severe limitation, as the ices enveloping the grain mantles are structurally amorphous, giving rise to a manifold of possible adsorption sites, each with different BEs. However, the ice amorphous nature prevents the knowledge of structural details, hindering the development of a common accepted atomistic icy model. In this work, we propose a computational framework that closely mimics the formation of the interstellar grain mantle through a water by water accretion. On that grain, an unbiased random (but well reproducible) positioning of the studied molecule is then carried out. Here we present the test case of NH$_3$, an ubiquitous species in the molecular ISM. We provide the BE distribution computed by a hierarchy approach, using the semiempirical xTB-GFN2 as low-level method to describe the whole icy cluster combined with the B97D3 DFT functional as high-level method on the local zone of the NH$_3$ interaction. The final ZPE corrected BE is computed at ONIOM(DLPNO-CCSD(T)//B97D3:xTB-GFN2) level, ensuring the best cost/accuracy ratio. The main peak of the predicted NH$_3$ BE distribution is in agreement with experimental TPD and literature computed data. A second broad peak at very low BE values is also present, never detected before. It may provide the solution to a long-standing puzzle about the presence of gaseous NH$_3$ observed also in cold ISM objects.

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arXiv2022

CH$_3$CN deuteration in the SVS13-A Class I hot-corino. SOLIS XV

We studied the line emission from CH3CN and its deuterated isotopologue CH$_2$DCN towards the prototypical Class I object SVS13-A, where the deuteration of a large number of species has already been reported. Our goal is to measure the CH$_3$CN deuteration in a Class I protostar, for the first time, in order to constrain the CH$_3$CN formation pathways and the chemical evolution from the early prestellar core and Class 0 to the evolved Class I stages. We imaged CH2DCN towards SVS13-A using the IRAM NOEMA interferometer at 3mm in the context of the Large Program SOLIS (with a spatial resolution of 1.8"x1.2"). The NOEMA images have been complemented by the CH$_3$CN and CH$_2$DCN spectra collected by the IRAM-30m Large Program ASAI, that provided an unbiased spectral survey at 3mm, 2mm, and 1.3mm. The observed line emission has been analysed using LTE and non-LTE LVG approaches. The NOEMA/SOLIS images of CH2DCN show that this species emits in an unresolved area centered towards the SVS13-A continuum emission peak, suggesting that methyl cyanide and its isotopologues are associated with the hot corino of SVS13-A, previously imaged via other iCOMs. In addition, we detected 41 and 11 ASAI transitions of CH$_3$CN and CH2DCN, respectively, which cover upper level energies (Eup) from 13 to 442 K and from 18 K to 200 K, respectively. The derived [CH2DCN]/[CH3CN] ratio is $\sim$9\%. This value is consistent with those measured towards prestellar cores and a factor 2-3 higher than those measured in Class 0 protostars. Contrarily to what expected for other molecular species, the CH3CN deuteration does not show a decrease in SVS13-A with respect to measurements in younger prestellar cores and Class 0 protostars. Finally, we discuss why our new results suggest that CH3CN was likely synthesised via gas-phase reactions and frozen onto the dust grain mantles during the cold prestellar phase.

astro-ph.SR↗

arXiv2022

The two hot corinos of the SVS13-A protostellar binary system: counterposed siblings

We present ALMA high-angular resolution ($\sim$ 50 au) observations of the Class I binary system SVS13-A. We report images of SVS13-A in numerous interstellar complex organic molecules: CH$_{\rm 3}$OH, $^{13}$CH$_{\rm 3}$OH, CH$_{\rm 3}$CHO, CH$_{\rm 3}$OCH$_{\rm 3}$, and NH$_{\rm 2}$CHO. Two hot corinos at different velocities are imaged in VLA4A (V$_{sys}$= +7.7 km s$^{-1}$) and VLA4B (V$_{sys}$= +8.5 km s$^{-1}$). From a non-LTE analysis of methanol lines we derive a gas density of 3 $\times$ 10$^8$ cm$^{-3}$, and gas temperatures of 140 K and 170 K for VLA4A and VLA4B, respectively. For the other species the column densities are derived from a LTE analysis. Formamide, which is the only N-bearing species detected in our observations, is more prominent around VLA4A, while dimethyl ether, methanol and acetaldehyde are associated with both VLA4A and VLA4B. We derive in the two hot corinos abundance ratios of $\sim$ 1 for CH$_{\rm 3}$OH, $^{13}$CH$_{\rm 3}$OH, and CH$_{\rm 3}$OCH$_{\rm 3}$, $\sim$ 2 for CH$_{\rm 3}$CHO, and $\sim$ 4 for NH$_{\rm 2}$CHO. The present dataset supports a chemical segregation between the different species inside the binary system. The emerging picture is that of an onion-like structure of the two SVS13-A hot corinos, caused by the different binding energies of the species, also supported by ad hoc quantum chemistry calculations. In addition, the comparison between molecular and dust maps suggests that the interstellar complex organic molecules emission originates from slow shocks produced by accretion streamers impacting the VLA4A and VLA4B disks and enriching the gas-phase component.

astro-ph.SR↗

arXiv2022

Non-Energetic Formation of Ethanol via CCH Reaction with Interstellar H2O Ices. A Computational Chemistry Study

Ethanol (CH$_3$CH$_2$OH) is a relatively common molecule, often found in star forming regions. Recent studies suggest that it could be a parent molecule of several so-called interstellar complex organic molecules (iCOMs). Yet, the formation route of this species remains debated. In the present work, we study the formation of ethanol through the reaction of CCH with one H$_2$O molecule belonging to the ice, as a test case to investigate the viability of chemical reactions based on a "radical + ice component" scheme as an alternative mechanism for the synthesis of iCOMs, beyond the usual radical-radical coupling. This has been done by means of DFT calculations adopting two clusters of 18 and 33 water molecules as ice models. Results indicate that CH$_3$CH$_2$OH can potentially be formed by this proposed reaction mechanism. The reaction of CCH with H$_2$O on the water ice clusters can be barrierless (thanks to the help of boundary icy water molecules acting as proton transfer assistants) leading to the formation of vinyl alcohol precursors (H$_2$CCOH and CHCHOH). Subsequent hydrogenation of vinyl alcohol yielding ethanol is the only step presenting a low activation energy barrier. We finally discuss the astrophysical implications of these findings.

astro-ph.GA↗

arXiv2022

A train of shocks at 3000 au scale? Exploring the clash of an expanding bubble into the NGC 1333 IRAS 4 region. SOLIS XIV

There is evidence that the star formation process is linked to the intricate net of filaments in molecular clouds, which may be also due to gas compression from external triggers. We studied the southern region of the Perseus NGC 1333 molecular cloud, known to be heavily shaped by similar external triggers, to shed light on the process that perturbed the filament where the Class 0 IRAS4 protostars lie. We use new IRAM-NOEMA observations of SiO and CH3OH, both known to trace violent events as shocks, toward IRAS 4A as part of the Large Program Seeds Of Life in Space (SOLIS). We detected three parallel elongated ($>$6000 au) structures, called fingers, with narrow line profiles (~1.5 $km s^{-1}$) peaked at the cloud systemic velocity, tracing gas with high density (5-20 $10^5 cm^{-3}$) and high temperature (80-160 K). They are chemically different, with the northern finger traced by both SiO and CH3OH ([CH3OH]/[SiO]~160-300), while the other two only by SiO ([CH3OH]/[SiO]$<$ 40). Among various possibilities, a train of three shocks, distanced by $>$5000 yr, would be consistent with the observations if a substantial fraction of silicon, frozen onto the grain mantles, is released by the shocks.We suggest that the shock train is due to an expanding gas bubble, coming behind NGC 1333 from the southwest and clashing against the filament, where IRAS 4A lies. Finally, we propose a solution to the two-decades long debate on the nature and origin of the widespread narrow SiO emission observed in the south part of NGC 1333, namely that it is due to unresolved trains of shocks.

astro-ph.GA↗