分类： 天文学 >> 天文学 提交时间： 2023-02-19
摘要： We investigate how the existence of hydrogen molecules on grain surfaces may affect H$_2$ formation efficiency in diffuse and translucent clouds. Hydrogen molecules are able to reduce the desorption energy of H atoms on grain surfaces in models. The detailed microscopic Monte Carlo method is used to perform model simulations. We found that the impact of the existence of H$_2$ on H$_2$ formation efficiency strongly depends on the diffusion barriers of H$_2$ on grain surfaces. Diffuse cloud models that do not consider surface H$_2$ predict that H atom recombination efficiency is above 0.5 over a grain temperature (T) range 10 K and 14 K. The adopted H$_2$ diffusion barriers in diffuse cloud models that consider surface H$_2$ are 80$\%$ H$_2$ desorption energies so that H$_2$ can be trapped in stronger binding sites. Depending on model parameters, these diffuse cloud models predict that the recombination efficiency is between nearly 0 and 0.5 at 10 K $\leq$ T $\leq$ 14 K. Translucent cloud model results show that H$_2$ formation efficiency is not affected by the existence of surface H$_2$ if the adopted average H$_2$ diffusion barrier on grain surfaces is low (194 K) so that H$_2$ can diffuse rapidly on grain surfaces. However, the recombination efficiency can drop to below 0.002 at T $\geq$ 10 K if higher average H$_2$ diffusion barrier is used (255 K) in translucent cloud models.
分类： 天文学 >> 天文学 提交时间： 2023-02-19
摘要： Cyanamide (NH2CN) and its isomer, carbodiimide (HNCNH), may form adenine in the interstellar medium (ISM) via a series of reactions. Therefore, they are considered key prebiotic molecules in the study of the origin of life. We used the three-phase NAUTILUS chemical code, which includes the gas, the dust surface, and the icy mantle, to investigate the formation and destruction of cyanamide and carbodiimide. We added over 200 new chemical reactions of the two isomers and related species, and established a relatively complete network. We applied cold core, hot corino/core and shock models to simulate the different physical environments, and found that the two isomers are mainly produced by the free radical reactions on grain surfaces. Our simulated results suggest that cyanamide and carbodiimide molecules come from surface chemistry at early evolutionary stages. Then they are released back to the gas phase, either by thermal process (in hot cores, hot corinos) or shock-induced desorption (in shock regions).We speculate that it is an inefficient route to form a tautomer of adenine by starting from molecules cyanoacetylene (C3NH), cyanamide and carbodiimide in ISM.
分类： 天文学 >> 天文学 提交时间： 2023-02-19
摘要： We investigated the chemical evolutions of gas phase and grain surface species across the Taurus molecular cloud-1 (TMC-1) filament from translucent phase to dense phase. By comparing observations with modeling results from an up-to-date chemical network, we examined the conversion processes for the carbon-, oxygen-, nitrogen- and sulfur-bearing species, i.e.from their initial atomic form to their main molecular reservoir form both in the gas phase and on the grain surface. The conversion processes were found to depend on the species and A$_V$. The effect of initial carbon to oxygen elemental abundances ratio (C/O) by varying O on the chemistry was explored, and an initial carbon elemental abundance of 2.5 $\times$ 10$^{-4}$ and a C/O ratio of 0.5 could best reproduce the abundances of most observed molecules at TMC-1 CP, where more than 90 molecules have been identified. Based on the TMC-1 condition, we predicted a varied grain ice composition during the evolutions of molecular clouds, with H$_2$O ice as the dominant ice composition at A$_V$ $>$ 4 mag, CO$_2$ ice as the dominant ice composition at A$_V$ $<$ 4 mag, while CO ice severely decreased at A$_V$ around 4--5 mag.
分类： 天文学 >> 天文学 提交时间： 2023-02-19
摘要： Cyanamide (NH2CN) and its isomer, carbodiimide (HNCNH), may form adenine in the interstellar medium (ISM) via a series of reactions. Therefore, they are considered key prebiotic molecules in the study of the origin of life. We used the three-phase NAUTILUS chemical code, which includes the gas, the dust surface, and the icy mantle, to investigate the formation and destruction of cyanamide and carbodiimide. We added over 200 new chemical reactions of the two isomers and related species, and established a relatively complete network. We applied cold core, hot corino/core and shock models to simulate the different physical environments, and found that the two isomers are mainly produced by the free radical reactions on grain surfaces. Our simulated results suggest that cyanamide and carbodiimide molecules come from surface chemistry at early evolutionary stages. Then they are released back to the gas phase, either by thermal process (in hot cores, hot corinos) or shock-induced desorption (in shock regions).We speculate that it is an inefficient route to form a tautomer of adenine by starting from molecules cyanoacetylene (C3NH), cyanamide and carbodiimide in ISM.
分类： 天文学 >> 天文学 提交时间： 2023-02-19
Juan Li
Junzhi Wang
Xing Lu
Vadim Ilyushin
Roman A. Motiyenko
Qian Gou
Eugene A. Alekseev
Donghui Quan
Laurent Margules
Feng Gao
Frank J. Lovas
Yajun Wu
Edwin Bergin
Shanghuo Li
Zhiqiang Shen
Fujun Du
Meng Li
Siqi Zheng
Xingwu Zheng
摘要： Peptide bonds, as the molecular bridges that connect amino acids, are crucial to the formation of proteins. Searches and studies of molecules with embedded peptide-like bonds are thus important for the understanding of protein formation in space. Here we report the first tentative detection of propionamide (C2H5CONH2), the largest peptide-like molecule detected in space toward Sagittarius B2(N1) at a position called N1E that is slightly offset from the continuum peak. A new laboratory measurements of the propionamide spectrum were carried out in the 9-461 GHz, which provide good opportunity to check directly for the transition frequencies of detected interstellar lines of propionamide. Our observing result indicates that propionamide emission comes from the warm, compact cores in Sagittarius B2, in which massive protostellars are forming. The column density of propionamide toward Sgr B2(N1E) was derived to be 1.5\times 10^{16} cm^-2, which is three fifths of that of acetamide, and one nineteenth of that of formamide. This detection suggests that large peptide-like molecules can form and survive during star-forming process and may form more complex molecules in the interstellar medium. The detection of propionamide bodes well for the presence of polypeptides, as well as other complex prebiotic molecules in the interstellar medium.
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