522 research outputs found

    Interplay of gas and ice during cloud evolution

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    During the evolution of diffuse clouds to molecular clouds, gas-phase molecules freeze out on surfaces of small dust particles to form ices. On dust surfaces, water is the main constituent of the icy mantle in which a complex chemistry is taking place. We aim to study the formation pathways and the composition of the ices throughout the evolution of diffuse clouds. For this purpose, we use time-dependent rate equations to calculate the molecular abundances in both gas phase and on solid surfaces (onto dust grains). We fully consider the gas-dust interplay by including the details of freeze-out, chemical and thermal desorption, as well as the most important photo-processes on grain surfaces. The difference in binding energies of chemical species on bare and icy surfaces is also incorporated into our equations. Using the numerical code FLASH, we perform a hydrodynamical simulation of a gravitationally bound diffuse cloud and follow its contraction. We find that while the dust grains are still bare, water formation is enhanced by grain surface chemistry which is subsequently released into the gas phase, enriching the molecular medium. The CO molecules, on the other hand, tend to freeze out gradually on bare grains. This causes CO to be well mixed and strongly present within the first ice layer. Once one monolayer of water ice has formed, the binding energy of the grain surface changes significantly and an immediate and strong depletion of gas-phase water and CO molecules occur. While hydrogenation converts solid CO into formaldehyde (H2_2CO) and methanol (CH3_3OH), water ice becomes the main constituent of the icy grains. Inside molecular clumps formaldehyde is more abundant than water and methanol in the gas phase owing its presence in part to chemical desorption.Comment: 19 pages, 10 figures, 9 tables, 23 equations. Accepted for publication Astronomy & Astrophysics. In version 3: Language edit, added gas-phase reaction tables, title has change

    The impact of freeze-out on collapsing molecular clouds

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    Atoms and molecules, and in particular CO, are important coolants during the evolution of interstellar star-forming gas clouds. The presence of dust grains, which allow many chemical reactions to occur on their surfaces, strongly impacts the chemical composition of a cloud. At low temperatures, dust grains can lock-up species from the gas phase which freeze out and form ices. In this sense, dust can deplete important coolants. Our aim is to understand the effects of freeze-out on the thermal balance and the evolution of a gravitationally bound molecular cloud. For this purpose, we perform 3D hydrodynamical simulations with the adaptive mesh code FLASH. We simulate a gravitationally unstable cloud under two different conditions, with and without grain surface chemistry. We let the cloud evolve until one free-fall time is reached and track the thermal evolution and the abundances of species during this time. We see that at a number density of 104^4 cm3^{-3} most of the CO molecules are frozen on dust grains in the run with grain surface chemistry, thereby depriving the most important coolant. As a consequence, we find that the temperature of the gas rises up to \sim25 K. The temperature drops once again due to gas-grain collisional cooling when the density reaches a few×\times104^4 cm3^{-3}. We conclude that grain surface chemistry not only affects the chemical abundances in the gas phase, but also leaves a distinct imprint in the thermal evolution that impacts the fragmentation of a star-forming cloud. As a final step, we present the equation of state of a collapsing molecular cloud that has grain surface chemistry included.Comment: Increased the number of significant digits in EQ 2. It mattered. Accepted for publication in MNRAS letter

    The Snow Border

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    Context. The study of the snow line is an important topic in several domains of astrophysics, and particularly for the evolution of proto-stellar environments and the formation of planets. Aims. The formation of the first layer of ice on carbon grains requires low temperatures compared to the temperature of evaporation (T > 100 K). This asymmetry generates a zone in which bare and icy dust grains coexist. Methods. We use Monte-Carlo simulations to describe the formation time scales of ice mantles on bare grains in protostellar disks and massive protostars environments. Then we analytically describe these two systems in terms of grain populations subject to infall and turbulence, and assume steady-state. Results. Our results show that there is an extended region beyond the snow line where icy and bare grains can coexist, in both proto-planetary disks and massive protostars. This zone is not negligible compared to the total size of the objects: on the order of 0.4 AU for proto-planetary disks and 5400 AU for high-mass protostars. Times to reach the steady-state are respectively es- timated from 10^2 to 10^5 yr. Conclusions. The presence of a zone, a so-called snow border, in which bare and icy grains co- exist can have a major impact on our knowledge of protostellar environments. From a theoretical point of view, the progression of icy grains to bare grains as the temperature increases, could be a realistic way to model hot cores and hot corinos. Also, in this zone, the formation of planetesimals will require the coagulation of bare and icy grains. Observationally, this zone allows high abundances of gas phase species at large scales, for massive protostars particularly, even at low temperatures (down to 50 K).Comment: accepted in A&

    Dust as interstellar catalyst I. Quantifying the chemical desorption process

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    Context. The presence of dust in the interstellar medium has profound consequences on the chemical composition of regions where stars are forming. Recent observations show that many species formed onto dust are populating the gas phase, especially in cold environments where UV and CR induced photons do not account for such processes. Aims. The aim of this paper is to understand and quantify the process that releases solid species into the gas phase, the so-called chemical desorption process, so that an explicit formula can be derived that can be included into astrochemical models. Methods. We present a collection of experimental results of more than 10 reactive systems. For each reaction, different substrates such as oxidized graphite and compact amorphous water ice are used. We derive a formula to reproduce the efficiencies of the chemical desorption process, which considers the equipartition of the energy of newly formed products, followed by classical bounce on the surface. In part II we extend these results to astrophysical conditions. Results. The equipartition of energy describes correctly the chemical desorption process on bare surfaces. On icy surfaces, the chemical desorption process is much less efficient and a better description of the interaction with the surface is still needed. Conclusions. We show that the mechanism that directly transforms solid species to gas phase species is efficient for many reactions.Comment: Accepted for publication in A&

    Effective grain surface area in the formation of molecular hydrogen in interstellar clouds

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    In the interstellar clouds, molecular hydrogens are formed from atomic hydrogen on grain surfaces. An atomic hydrogen hops around till it finds another one with which it combines. This necessarily implies that the average recombination time, or equivalently, the effective grain surface area depends on the relative numbers of atomic hydrogen influx rate and the number of sites on the grain. Our aim is to discover this dependency. We perform a numerical simulation to study the recombination of hydrogen on grain surfaces in a variety of cloud conditions. We use a square lattice (with a periodic boundary condition) of various sizes on two types of grains, namely, amorphous carbon and olivine. We find that the steady state results of our simulation match very well with those obtained from a simpler analytical consideration provided the `effective' grain surface area is written as Sα\sim S^{\alpha}, where, SS is the actual physical grain area and α\alpha is a function of the flux of atomic hydrogen which is determined from our simulation. We carry out the simulation for various astrophysically relevant accretion rates. For high accretion rates, small grains tend to become partly saturated with HH and H2H_2 and the subsequent accretion will be partly inhibited. For very low accretion rates, the number of sites to be swept before a molecular hydrogen can form is too large compared to the actual number of sites on the grain, implying that α\alpha is greater than unity.Comment: 8 pages, 5 figures in eps forma

    Pore evolution in interstellar ice analogues: simulating the effects of temperature increase

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    Context. The level of porosity of interstellar ices - largely comprised of amorphous solid water (ASW) - contains clues on the trapping capacity of other volatile species and determines the surface accessibility that is needed for solid state reactions to take place. Aims. Our goal is to simulate the growth of amorphous water ice at low temperature (10 K) and to characterize the evolution of the porosity (and the specific surface area) as a function of temperature (from 10 to 120 K). Methods. Kinetic Monte Carlo simulations are used to mimic the formation and the thermal evolution of pores in amorphous water ice. We follow the accretion of gas-phase water molecules as well as their migration on surfaces with different grid sizes, both at the top growing layer and within the bulk. Results. We show that the porosity characteristics change substantially in water ice as the temperature increases. The total surface of the pores decreases strongly while the total volume decreases only slightly for higher temperatures. This will decrease the overall reaction efficiency, but in parallel, small pores connect and merge, allowing trapped molecules to meet and react within the pores network, providing a pathway to increase the reaction efficiency. We introduce pore coalescence as a new solid state process that may boost the solid state formation of new molecules in space and has not been considered so far.Comment: 9 pages, 8 figures Accepted for publication in A&

    Water formation on bare grains: When the chemistry on dust impacts interstellar gas

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    Context. Water together with O2 are important gas phase ingredients to cool dense gas in order to form stars. On dust grains, H2 O is an important constituent of the icy mantle in which a complex chemistry is taking place, as revealed by hot core observations. The formation of water can occur on dust grain surfaces, and can impact gas phase composition. Aims. The formation of molecules such as OH, H2 O, HO2, H2 O2, as well as their deuterated forms and O2 and O3 is studied in order to assess how the chemistry varies in different astrophysical environments, and how the gas phase is affected by grain surface chemistry. Methods. We use Monte Carlo simulations to follow the formation of molecules on bare grains as well as the fraction of molecules released into the gas phase. We consider a surface reaction network, based on gas phase reactions, as well as UV photo-dissociation of the chemical species. Results. We show that grain surface chemistry has a strong impact on gas phase chemistry, and that this chemistry is very different for different dust grain temperatures. Low temperatures favor hydrogenation, while higher temperatures favor oxygenation. Also, UV photons dissociate the molecules on the surface, that can reform subsequently. The formation-destruction cycle increases the amount of species released into the gas phase. We also determine the time scales to form ices in diffuse and dense clouds, and show that ices are formed only in shielded environments, as supported by observations.Comment: Accepted in A&

    Interstellar ices as witnesses of star formation: selective deuteration of water and organic molecules unveiled

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    Observations of star forming environments revealed that the abundances of some deuterated interstellar molecules are markedly larger than the cosmic D/H ratio of 10-5. Possible reasons for this pointed to grain surface chemistry. How- ever, organic molecules and water, which are both ice constituents, do not enjoy the same deuteration. For example, deuterated formaldehyde is very abundant in comets and star forming regions, while deuterated water rarely is. In this article, we explain this selective deuteration by following the formation of ices (using the rate equation method) in translucent clouds, as well as their evolu- tion as the cloud collapses to form a star. Ices start with the deposition of gas phase CO and O onto dust grains. While reaction of oxygen with atoms (H or D) or molecules (H2) yields H2O (HDO), CO only reacts with atoms (H and D) to form H2CO (HDCO, D2CO). As a result, the deuteration of formaldehyde is sensitive to the gas D/H ratio as the cloud undergoes gravitational collapse, while the deuteration of water strongly depends on the dust temperature at the time of ice formation. These results reproduce well the deuterium fractionation of formaldehyde observed in comets and star forming regions and can explain the wide spread of deuterium fractionation of water observed in these environments.Comment: 4 pages, 3 figures, Accepted in ApJ letter; Astrophysical Journal LET26536R1 201

    Molecular hydrogen formation in the interstellar medium

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    We have developed a model for molecular hydrogen formation under astrophysically relevant conditions. This model takes fully into account the presence of both physisorbed and chemisorbed sites on the surface, allows quantum mechanical diffusion as well as thermal hopping for absorbed H-atoms, and has been benchmarked versus recent laboratory experiments on H2 formation on silicate surfaces. The results show that H2 formation on grain surface is efficient in the interstellar medium up to some 300K. At low temperatures (<100K), H2 formation is governed by the reaction of a physisorbed H with a chemisorbed H. At higher temperatures, H2 formation proceeds through reaction between two chemisorbed H atoms. We present simple analytical expressions for H2 formation which can be adopted to a wide variety of surfaces once their surfaces characteristics have been determined experimentally.Comment: 4 pages, 1 figur
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