We present the fifth release of the UMIST Database for Astrochemistry (UDfA). The new reaction network contains 6173 gas-phase reactions, involving 467 species, 47 of which are new to this release. ...We have updated rate coefficients across all reaction types. We have included 1171 new anion reactions and updated and reviewed all photorates. In addition to the usual reaction network, we also now include, for download, state-specific deuterated rate coefficients, deuterium exchange reactions and a list of surface binding energies for many neutral species. Where possible, we have referenced the original source of all new and existing data. We have tested the main reaction network using a dark cloud model and a carbon-rich circumstellar envelope model. We present and briefly discuss the results of these models.
Remote and in situ observations of cometary gases have revealed the presence of a wealth of complex organic molecules, including carbon chains, alcohols, imines, and the amino acid glycine. Such ...chemical complexity in cometary material implies that impacts by comets could have supplied reagents for prebiotic chemistry to young planetary surfaces. However, the assumption that some of the molecules observed in cometary comae at millimetre wavelengths originate from ices stored inside the nucleus has not yet been proven. In fact, the comae of moderately-active comets reach sufficient densities within a few thousand kilometres of the nucleus for an active (solar radiation-driven) photochemistry to ensue. Here, we present results from our latest chemical-hydrodynamic models incorporating an updated reaction network, and show that the commonly-observed HC3N (cyanoacetylene) and NH2CHO (formamide) molecules can be efficiently produced in cometary comae as a result of two-body, neutral–neutral, gas-phase reactions involving well-known coma species. In the presence of a near-nucleus distributed source of CN (similar to that observed by the Rosetta spacecraft at comet 67P), we find that sufficient HC3N and NH2CHO can be synthesized to match the abundances of these molecules observed previously in Oort cloud comets. The precise coma origins of these (and other) complex organic molecules can be verified through radio interferometric mapping observations, for example using the Atacama Large Millimeter/submillimeter Array.
Results are presented from the first cometary observations using the Atacama Large Millimeter/Submillimeter Array (ALMA), including measurements of the spatially resolved distributions of HCN, HNC, H ...sub(2)CO, and dust within the comae of two comets: C/2012 F6 (Lemmon) and C/2012 S1 (ISON), observed at heliocentric distances of 1.5 AU and 0.54 AU, respectively. These observations (with angular resolution approximate0".5), reveal an unprecedented level of detail in the distributions of these fundamental cometary molecules, and demonstrate the power of ALMA for quantitative measurements of the distributions of molecules and dust in the inner comae of typical bright comets. In both comets, HCN is found to originate from (or within a few hundred kilometers of) the nucleus, with a spatial distribution largely consistent with spherically symmetric, uniform outflow. By contrast, the HNC distributions are clumpy and asymmetrical, with peaks at cometocentric radii ~500-1000 km, consistent with release of HNC in collimated outflow(s). Compared to HCN, the H sub(2)CO distribution in comet Lemmon is very extended. The interferometric visibility amplitudes are consistent with coma production of H sub(2)CO and HNC from unidentified precursor material(s) in both comets. Adopting a Haser model, the H sub(2)CO parent scale length is found to be a few thousand kilometers in Lemmon and only a few hundred kilometers in ISON, consistent with the destruction of the precursor by photolysis or thermal degradation at a rate that scales in proportion to the solar radiation flux.
We present the results of millimetre-wave spectroscopic and continuum observations of the comet C/2020 F3 (NEOWISE) undertaken with the Institut de RadioAstronomie Millimétrique (IRAM) 30-m and the ...NOrthern Extended Millimeter Array (NOEMA) telescopes on 22, 25–27 July, and 7 August 2020. Production rates of HCN, HNC, CH
3
OH CS, H
2
CO, CH
3
CN, H
2
S, and CO were determined with upper limits on six other species. The comet shows abundances within the range observed for other comets. The CO abundance is low (3.2% relative to water), while H
2
S is relatively abundant (1.1% relative to water). The H
2
CO abundance shows a steep variation with heliocentric distance, possibly related to a distributed production from the dust or macro-molecular source. The CH
3
OH and H
2
S production rates show a slower decrease post-perihelion than water. There was no detection of the nucleus point source contribution based on the interferometric map of the continuum (implying a size of
r <
4.7 km), but this yielded an estimate of the dust production rate, leading to a relatively low dust-to-gas ratio of 0.7 ± 0.3 on 22.4 July 2020.
ABSTRACT We present sub-millimeter spectra of HCN isotopologues on Titan, derived from publicly available ALMA flux calibration observations of Titan taken in early 2014. We report the detection of a ...new HCN isotopologue on Titan, H13C15N, and confirm an earlier report of detection of DCN. We model high signal-to-noise observations of HCN, H13CN, HC15N, DCN, and H13C15N to derive abundances and infer the following isotopic ratios: 12C/13C = 89.8 2.8, 14N/15N = 72.3 2.2, D/H = (2.5 0.2) × 10−4, and HCN/H13C15N = 5800 270 (1 errors). The carbon and nitrogen ratios are consistent with and improve on the precision of previous results, confirming a factor of ∼2.3 elevation in 14N/15N in HCN compared to N2 and a lack of fractionation in 12C/13C from the protosolar value. This is the first published measurement of D/H in a nitrile species on Titan, and we find evidence for a factor of ∼2 deuterium enrichment in hydrogen cyanide compared to methane. The isotopic ratios we derive may be used as constraints for future models to better understand the fractionation processes occurring in Titan's atmosphere.
ABSTRACT
An abundance of CO significantly surpassing the abundance of H2O is observed in the comae of comets at large heliocentric distances. In these environments, CO molecules can be the most ...abundant species and they may be therefore the dominant projectiles inducing collisional excitation of the cometary molecules. It is thus of high interest to investigate the excitation of CO by CO. This article provides a new set of CO–CO collisional rate coefficients for temperatures up to 150 K and for CO rotational levels j1 up to 10. These data are obtained from quantum scattering calculations using the coupled states approximation. They are used in a simple radiative transfer model in order to test their impact on the excitation of cometary CO. Because mutual (de-)excitations of the target and projectile are important, the CO projectile was assumed to be thermalized at the kinetic temperature. We found that the non-local thermodynamical equilibrium regime extends for CO densities in the range 103–107 cm−3. We also observed that as soon as the CO/H2O ratio is larger than 70 per cent/30 per cent, the contribution of H2O collisions can be neglected. Similarly, the excitation of CO by CO may be ignored for relatively low CO/H2O density ratios (≤30 per cent/70 per cent). Finally, when the coma is a ∼50 per cent/50 per cent mixture of CO and H2O, the contribution of both colliders is similar and has to be considered.
Abstract
Recent advances in laboratory spectroscopy lead to the claim of ionized Buckminsterfullerene (C
) as the carrier of two diffuse interstellar bands (DIBs) in the near-infrared. However, ...irrefutable identification of interstellar C
requires a match between the wavelengths and the expected strengths of all absorption features detectable in the laboratory and in space. Here we present
Hubble Space Telescope
(
HST
) spectra of the region covering the C
9348, 9365, 9428, and 9577 Å absorption bands toward seven heavily reddened stars. We focus in particular on searching for the weaker laboratory C
bands, the very presence of which has been a matter for recent debate. Using the novel STIS-scanning technique to obtain ultra-high signal-to-noise spectra without contamination from telluric absorption that afflicted previous ground-based observations, we obtained reliable detections of the (weak) 9365, 9428 Å and (strong) 9577 Å C
bands. The band wavelengths and strength ratios are sufficiently similar to those determined in the latest laboratory experiments that we consider this the first robust identification of the 9428 Å band, and a conclusive confirmation of interstellar
.
The 100 m Robert C. Byrd Green Bank Telescope K-band (KFPA) receiver was used to perform a high-sensitivity search for rotational emission lines from complex organic molecules in the cold ...interstellar medium toward TMC-1 (cyanopolyyne peak), focussing on the identification of new carbon-chain-bearing species as well as molecules of possible prebiotic relevance. We report a detection of the carbon-chain oxide species HC7O and derive a column density of cm−2. This species is theorized to form as a result of associative electron detachment reactions between oxygen atoms and C7H−, and/or reaction of C6H2+ with CO (followed by dissociative electron recombination). Upper limits are given for the related HC6O, C6O, and C7O molecules. In addition, we obtained the first detections of emission from individual 13C isotopologues of HC7N, and derive abundance ratios HC7N/HCCC13CCCCN = 110 16 and HC7N/HCCCC13CCCN = 96 11, indicative of significant 13C depletion in this species relative to the local interstellar elemental 12C/13C ratio of 60-70. The observed spectral region covered two transitions of HC11N, but emission from this species was not detected, and the corresponding column density upper limit is (at 95% confidence). This is significantly lower than the value of previously claimed by Bell et al. and confirms the recent nondetection of HC11N in TMC-1 by Loomis et al. Upper limits were also obtained for the column densities of malononitrile and the nitrogen heterocycles quinoline, isoquinoline, and pyrimidine.
Gas phase spectroscopic laboratory experiments for the buckminsterfullerene cation C60+ have resulted in accurate rest wavelengths for five C60+ transitions that have been compared with diffuse ...interstellar bands (DIBs) in the near infra-red. Detecting these in astronomical spectra is difficult because of the strong contamination of ground-based spectra by atmospheric water vapor, to the presence of weak and shallow stellar lines and/or blending with other weak DIBs. The detection of the two strong bands has been claimed by several teams, and the three additional and weaker bands have been detected in a few sources. Certain recent papers have argued against the identification of C60+ based on spectral analyses claiming (i) a large variation in the ratio of the equivalent widths of the 9632 and 9577 Å bands, (ii) a large redshift of the 9632 Å band for the Orion star HD 37022, and (iii) the non-detection of the weaker 9428 Å DIB. Here we address these three points: (i) We show that the model stellar line correction for the 9632 Å DIB overestimates the difference between the strengths of the lines in giant and dwarf star spectra, casting doubts on the conclusions about the ratio variability. (ii) Using high quality stellar spectra from the ESO Diffuse Interstellar Bands Large Exploration Survey (EDIBLES), recorded with the ESO/Paranal Ultraviolet Echelle Spectrograph (UVES) in about the same atmospheric conditions, we find no wavelength shift in the 9632 Å band toward HD 37022. (iii) Using EDIBLES spectra and data from the Echelle SpectroPolarimetric Device for the Observation of Stars (ESPaDOnS) at CFHT we show that the presence of a weak 9428 Å band cannot be ruled out, even in the same observations that a previous study claimed it was not present.
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