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Register a new userModeling deuterium chemistry in starless cores: full scrambling versus proton hop
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We constructed two new models for deuterium and spin-state chemistry for the purpose of modeling the low-temperature environment prevailing in starless and pre-stellar cores. The fundamental difference between the two models is in the treatment of ion-molecule proton-donation reactions of the form $rm XH^+ + Y longrightarrow X + YH^+$, which are allowed to proceed either via full scrambling or via direct proton hop, i.e., disregarding proton exchange. The choice of the reaction mechanism affects both deuterium and spin-state chemistry, and in this work our main interest is on the effect on deuterated ammonia. We applied the new models to the starless core H-MM1, where several deuterated forms of ammonia have been observed. Our investigation slightly favors the proton hop mechanism over full scrambling because the ammonia D/H ratios are better fit by the former model, although neither model can reproduce the observed $rm NH_2D$ ortho-to-para ratio of 3 (the models predict a value of $sim$2). Extending the proton hop scenario to hydrogen atom abstraction reactions yields a good agreement for the spin-state abundance ratios, but greatly overestimates the deuterium fractions of ammonia. However, one can find a reasonably good agreement with the observations with this model by increasing the cosmic-ray ionization rate over the commonly-adopted value of $sim$$10^{-17},rm s^{-1}$. We also find that the deuterium fractions of several other species, such as $rm H_2CO$, $rm H_2O$, and $rm CH_3$, are sensitive to the adopted proton-donation reaction mechanism. Whether the full scrambling or proton hop mechanism dominates may be dependent on the reacting system, and new laboratory and theoretical studies for various reacting systems are needed to constrain chemical models.
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We study deuterium fractionation in two massive starless/early-stage cores C1-N and C1-S in Infrared Dark Cloud (IRDC) G028.37+00.07, first identified by Tan et al. (2013) with ALMA. Line emission from multiple transitions of $rm N_2H^+$ and $rm N_2D^+$ were observed with the ALMA, CARMA, SMA, JCMT, NRO 45m and IRAM 30m telescopes. By simultaneously fitting the spectra, we estimate the excitation conditions and deuterium fraction, $D_{rm frac}^{rm N_2H^+} equiv [rm N_2D^+]/[N_2H^+]$, with values of $D_{rm frac}^{rm N_2H^+} simeq 0.2$--$0.7$, several orders of magnitude above the cosmic [D]/[H] ratio. Additional observations of o-H$_2$D$^+$ are also presented that help constrain the ortho-to-para ratio of $rm H_2$, which is a key quantity affecting the degree of deuteration. We then present chemodynamical modeling of the two cores, exploring especially the implications for the collapse rate relative to free-fall, $alpha_{rm ff}$. In order to reach the high level of observed deuteration of $rm N_2H^+$, we find that the most likely evolutionary history of the cores involves collapse at a relatively slow rate, $lesssim1/10$th of free-fall.
High levels of deuterium fractionation in gas-phase molecules are usually associated with cold regions, such as prestellar cores. Significant fractionation ratios are also observed in hot environments such as hot cores or hot corinos, where they are believed to be produced by the evaporation of the icy mantles surrounding dust grains, and thus are remnants of a previous cold (either gas-phase or grain surface) chemistry. The recent detection of DCN towards the Orion Bar, in a clump at a characteristic temperature of 70K, has shown that high deuterium fractionation can also be detected in PDRs. The Orion Bar clumps thus appear as a good environment for the observational study of deuterium fractionation in luke-warm gas, allowing to validate chemistry models in a different temperature range, where dominating fractionation processes are predicted to be different than in cold gas (< 20K). We aimed at studying observationally in detail the chemistry at work in the Orion Bar PDR, to understand if DCN is produced by ice mantle evaporation, or is the result of warm gas-phase chemistry, involving the CH2D+ precursor ion (which survives higher temperatures than the usual H2D+ precursor). Using the APEX and the IRAM 30m telescopes, we targetted selected deuterated species towards two clumps in the Orion Bar. We confirmed the detection of DCN and detected two new deuterated molecules (DCO+ and HDCO) towards one clump in the Orion Bar PDR. Significant deuterium fractionations are found for HCN and H2CO, but a low fractionation in HCO+. We also give upper limits for other molecules relevant for the deuterium chemistry. (...) We show evidence that warm deuterium chemistry driven by CH2D+ is at work in the clumps.
In order to understand the collapse dynamics of observed low-mass starless cores, we revise the conventional stability condition of hydrostatic Bonnor-Ebert spheres to take internal motions into account. Because observed starless cores resemble Bonnor-Ebert density structures, the stability and dynamics of the starless cores are frequently analyzed by comparing to the conventional stability condition of a hydrostatic Bonnor-Ebert sphere. However, starless cores are not hydrostatic but have observed internal motions. In this study, we take gaseous spheres with a homologous internal velocity field and derive stability conditions of the spheres utilizing a virial analysis. We propose two limiting models of spontaneous gravitational collapse: the collapse of critical Bonnor-Ebert spheres and uniform density spheres. The collapse of these two limiting models are intended to provide the lower and the upper limits, respectively, of the infall speeds for a given density structure. The results of our study suggest that the stability condition sensitively depends on internal motions. A homologous inward motion with a transonic speed can reduce the critical size compared to the static Bonnor-Ebert sphere by more than a factor of two. As an application of the two limiting models of spontaneous gravitational collapse, we compare the density structures and infall speeds of the observed starless cores L63, L1544, L1689B, and L694-2 to the two limiting models. L1689B and L694-2 seem to have been perturbed to result in faster infall motions than for spontaneous gravitational collapse.
In a previous paper we identified cores within infrared dark clouds (IRDCs). We regarded those without embedded sources as the least evolved, and labelled them starless. Here we identify the most isolated starless cores and model them using a three-dimensional, multi-wavelength, Monte Carlo, radiative transfer code. We derive the cores physical parameters and discuss the relation between the mass, temperature, density, size and the surrounding interstellar radiation field (ISRF) for the cores. The masses of the cores were found not to correlate with their radial size or central density. The temperature at the surface of a core was seen to depend almost entirely on the level of the ISRF surrounding the core. No correlation was found between the temperature at the centre of a core and its local ISRF. This was seen to depend, instead, on the density and mass of the core.
SWAS and Odin provided stringent upper limits on the gas phase water abundance of dark clouds (x(H2O) < 7x10^-9). We investigate the chemistry of water vapor in starless cores beyond the previous upper limits using the highly improved angular resolution and sensitivity of Herschel and measure the abundance of water vapor during evolutionary stages just preceding star formation. High spectral resolution observations of the fundamental ortho water (o-H2O) transition (557 GHz) were carried out with Herschel HIFI toward two starless cores: B68, a Bok globule, and L1544, a prestellar core embedded in the Taurus molecular cloud complex. The rms in the brightness temperature measured for the B68 and L1544 spectra is 2.0 and 2.2 mK, respectively, in a velocity bin of 0.59 km s^-1. The continuum level is 3.5+/-0.2 mK in B68 and 11.4+/-0.4 mK in L1544. No significant feature is detected in B68 and the 3 sigma upper limit is consistent with a column density of o-H2O N(o-H2O) < 2.5x10^13 cm^-2, or a fractional abundance x(o-H2O) < 1.3x10^-9, more than an order of magnitude lower than the SWAS upper limit on this source. The L1544 spectrum shows an absorption feature at a 5 sigma level from which we obtain the first value of the o-H2O column density ever measured in dark clouds: N(o-H2O) = (8+/-4)x10^12 cm^-2. The corresponding fractional abundance is x(o-H2O) ~ 5x10^-9 at radii > 7000 AU and ~2x10^-10 toward the center. The radiative transfer analysis shows that this is consistent with a x(o-H2O) profile peaking at ~10^-8, 0.1 pc away from the core center, where both freeze-out and photodissociation are negligible. Herschel has provided the first measurement of water vapor in dark regions. Prestellar cores such as L1544 (with their high central densities, strong continuum, and large envelopes) are very promising tools to finally shed light on the solid/vapor balance of water in molecular clouds.
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