Ankan Das

Abstract: We present the results of 0.1-pc-scale observations in 250 GHz and 350GHz towards a newly-discovered hot molecular core in a nearby low-metallicity galaxy, the Large Magellanic Cloud (LMC), with the Atacama Large Millimeter/submillimeter Array. A variety of C/N/O/Si/S-bearing molecules are detected towards the high-mass young stellar object, ST16. A rotating protostellar envelope is for the first time detected outside our Galaxy by SO2 and 34SO lines. An outflow cavity is traced by CCH and CN. The isotope abundance of sulfur in the source is estimated to be 32S/34S = 17 and 32S/33S = 53 based on SO, SO2, and CS isotopologues, suggesting that both 34S and 33S are overabundant in the LMC. Rotation diagram analyses show that the source is associated with hot gas (>100K) traced by high-excitation lines of CH3OH and SO2, as well as warm gas (~50K) traced by CH3OH, SO2, 34SO, OCS, CH3CN lines. A comparison of molecular abundances between LMC and Galactic hot cores suggests that organic molecules (e.g., CH3OH, a classical hot core tracer) show a large abundance variation in low metallicity, where the present source is classified into an organic-poor hot core. Our astrochemical simulations suggest that different grain temperature during the initial ice-forming stage would contribute to the chemical differentiation. In contrast, SO2 shows similar abundances within all the known LMC hot cores and the typical abundance roughly scales with the LMC's metallicity. Nitrogen-bearing molecules are generally less abundant in LMC hot cores, except for NO. The present results suggest that chemical compositions of hot cores do not always simply scale with the metallicity.

Abstract: We present the results of 0.1-pc-scale observations in 250 GHz and 350GHz towards a newly-discovered hot molecular core in a nearby low-metallicity galaxy, the Large Magellanic Cloud (LMC), with the Atacama Large Millimeter/submillimeter Array. A variety of C/N/O/Si/S-bearing molecules are detected towards the high-mass young stellar object, ST16. A rotating protostellar envelope is for the first time detected outside our Galaxy by SO2 and 34SO lines. An outflow cavity is traced by CCH and CN. The isotope abundance of sulfur in the source is estimated to be 32S/34S = 17 and 32S/33S = 53 based on SO, SO2, and CS isotopologues, suggesting that both 34S and 33S are overabundant in the LMC. Rotation diagram analyses show that the source is associated with hot gas (>100K) traced by high-excitation lines of CH3OH and SO2, as well as warm gas (~50K) traced by CH3OH, SO2, 34SO, OCS, CH3CN lines. A comparison of molecular abundances between LMC and Galactic hot cores suggests that organic molecules (e.g., CH3OH, a classical hot core tracer) show a large abundance variation in low metallicity, where the present source is classified into an organic-poor hot core. Our astrochemical simulations suggest that different grain temperature during the initial ice-forming stage would contribute to the chemical differentiation. In contrast, SO2 shows similar abundances within all the known LMC hot cores and the typical abundance roughly scales with the LMC's metallicity. Nitrogen-bearing molecules are generally less abundant in LMC hot cores, except for NO. The present results suggest that chemical compositions of hot cores do not always simply scale with the metallicity.

Abstract: Spices not only help imparting taste, flavour, aroma and colour but also act as a preservative by preventing the spoilage of various food and beverage products. They are huge reservoir of essential oils and aromatic constituents which are of great demand in pharmaceutical and cosmetic industries, both in national and international trade. They also possess nutritional, antimicrobial, antioxidant and pharmaceutical properties and, hence, regarded as one of the most functionally important food ingredients. Efforts are, therefore, directed towards enhancing area, increasing productivity and improving quality of spices. However, in today’s scenario, real challenges confronting us not only on how to sustain the productivity of spices but also on how to minimize their losses. Post harvest management of spices appears to be more crucial here. Most of the freshly harvested spices are very high in their moisture content, highly perishable and susceptible to microbial contamination. Steps like harvesting at optimum stage, proper transportation to processing units, cleaning, blanching, treating with recommended chemicals, dehydration, packaging and storage or processing leading those to value added products etc. are very much crucial so far as reduction of post harvest losses are concerned. The irony is that due to lack of proper knowledge, awareness and improper technology dissemination, the post-harvest management, especially in the developing countries is still not up to the mark. Therefore it is necessary to process the spices by exploiting both classical and innovative post-harvest technology to ensure their long term preservation and optimum utilization.

Abstract: Phosphorus related species are not known to be as omnipresent in space as hydrogen, carbon, nitrogen, oxygen, and sulfur-bearing species. Astronomers spotted very few P-bearing molecules in the interstellar medium and circumstellar envelopes. Limited discovery of the P-bearing species imposes severe constraints in modeling the P-chemistry. In this paper, we carry out extensive chemical models to follow the fate of P-bearing species in diffuse clouds, photon-dominated or photodissociation regions (PDRs), and hot cores/corinos. We notice a curious correlation between the abundances of PO and PN and atomic nitrogen. Since N atoms are comparatively abundant in diffuse clouds and PDRs than in the hot core/corino region, PO/PN reflects 1 in the late warm-up evolutionary phase of the hot core/corino regions. During the end of the post-warm-up phase, we obtain PO/PN > 1 for hot core and < 1 for its low mass analog. We employ a radiative transfer model to investigate the transitions of some of the P-bearing species in diffuse cloud and hot core regions and estimate the line profiles. Our study estimates the required integration time to observe these transitions with ground-based and space-based telescopes. We also carry out quantum chemical computation of the infrared features of PH3 along with various impurities. We notice that SO2 overlaps with the PH3 bending-scissoring modes around ~ (1000 - 1100) cm-1. We also find that the presence of CO2 can strongly influence the intensity of the stretching modes around ~ 2400 cm-1 of PH3 .

Abstract: Phosphorus related species are not known to be as omnipresent in space as hydrogen, carbon, nitrogen, oxygen, and sulfur-bearing species. Astronomers spotted very few P-bearing molecules in the interstellar medium and circumstellar envelopes. Limited discovery of the P-bearing species imposes severe constraints in modeling the P-chemistry. In this paper, we carry out extensive chemical models to follow the fate of P-bearing species in diffuse clouds, photon-dominated or photodissociation regions (PDRs), and hot cores/corinos. We notice a curious correlation between the abundances of PO and PN and atomic nitrogen. Since N atoms are comparatively abundant in diffuse clouds and PDRs than in the hot core/corino region, PO/PN reflects 1 in the late warm-up evolutionary phase of the hot core/corino regions. During the end of the post-warm-up phase, we obtain PO/PN > 1 for hot core and < 1 for its low mass analog. We employ a radiative transfer model to investigate the transitions of some of the P-bearing species in diffuse cloud and hot core regions and estimate the line profiles. Our study estimates the required integration time to observe these transitions with ground-based and space-based telescopes. We also carry out quantum chemical computation of the infrared features of PH3 along with various impurities. We notice that SO2 overlaps with the PH3 bending-scissoring modes around ~ (1000 - 1100) cm-1. We also find that the presence of CO2 can strongly influence the intensity of the stretching modes around ~ 2400 cm-1 of PH3 .

Abstract: 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.

Abstract: We report the first extragalactic detection of the complex organic molecules (COMs) dimethyl ether (CH3OCH3) and methyl formate (CH3OCHO) with the Atacama Large Millimeter/submillimeter Array (ALMA). These COMs, together with their parent species methanol (CH3OH), were detected toward two 1.3 mm continuum sources in the N 113 star-forming region in the low-metallicity Large Magellanic Cloud (LMC). Rotational temperatures (Trot approx. 130 K) and total column densities (Nrot 10 approx. 16 cm−2) have been calculated for each source based on multiple transitions of CH3OH. We present the ALMA molecular emission maps for COMs and measured abundances for all detected species. The physical and chemical properties of two sources with COMs detection, and the association with H2O and OH maser emission, indicate that they are hot cores. The fractional abundances of COMs scaled by a factor of 2.5 to account for the lower metallicity in the LMC are comparable to those found at the lower end of the range in Galactic hot cores. Our results have important implications for studies of organic chemistry at higher redshift.

Abstract: Hot corino chemistry and warm carbon chain chemistry (WCCC) are driven by gas-grain interactions in star-forming cores: radical-radical recombination reactions to form complex organic molecules (COMs) in the ice mantle, sublimation of CH$_4$ and COMs, and their subsequent gas-phase reactions. These chemical features are expected to depend on the composition of ice mantle which is set in the prestellar phase. We calculated the gas-grain chemical reaction network considering a layered ice-mantle structure in star-forming cores, to investigate how the hot corino chemistry and WCCC depend on the physical condition of the static phase before the onset of gravitational collapse. We found that WCCC becomes more active, if the temperature is lower, or the visual extinction is lower in the static phase, or the static phase is longer. Dependence of hot corino chemistry on the static-phase condition is more complex. While CH$_3$OH is less abundant in the models with warmer static phase, some COMs are formed efficiently in those warm models, since there are various formation paths of COMs. If the visual extinction is lower, photolysis makes COMs less abundant in the static phase. Once the collapse starts and visual extinction increases, however, COMs can be formed efficiently. Duration of the static phase does not largely affect COM abundances. Chemical diversity between prototypical hot corinos and hybrid sources, in which both COMs and carbon chains are reasonably abundant, can be explained by the variation of prestellar conditions. Deficiency of gaseous COMs in prototypical WCCC sources is, however, hard to reproduce within our models.

Abstract: Hot corino chemistry and warm carbon chain chemistry (WCCC) are driven by gas-grain interactions in star-forming cores: radical-radical recombination reactions to form complex organic molecules (COMs) in the ice mantle, sublimation of CH$_4$ and COMs, and their subsequent gas-phase reactions These chemical features are expected to depend on the composition of ice mantle which is set in the prestellar phase We calculated the gas-grain chemical reaction network considering a layered ice-mantle structure in star-forming cores, to investigate how the hot corino chemistry and WCCC depend on the physical condition of the static phase before the onset of gravitational collapse We found that WCCC becomes more active, if the temperature is lower, or the visual extinction is lower in the static phase, or the static phase is longer Dependence of hot corino chemistry on the static-phase condition is more complex While CH$_3$OH is less abundant in the models with warmer static phase, some COMs are formed efficiently in those warm models, since there are various formation paths of COMs If the visual extinction is lower, photolysis makes COMs less abundant in the static phase Once the collapse starts and visual extinction increases, however, COMs can be formed efficiently Duration of the static phase does not largely affect COM abundances Chemical diversity between prototypical hot corinos and hybrid sources, in which both COMs and carbon chains are reasonably abundant, can be explained by the variation of prestellar conditions Deficiency of gaseous COMs in prototypical WCCC sources is, however, hard to reproduce within our models

Abstract: Straight-chain (normal-propyl cyanide, $\rm {n-C_3H_7CN}$) and branched-chain (iso-propyl cyanide, $\rm {i-C_3H_7CN}$) alkyl cyanides are recently identified in the massive star-forming regions (Sgr B2(N) and Orion). These branched-chain molecules indicate that the key amino acids (side-chain structures) may also be present in a similar region. The process by which this branching could propagate towards the higher order (butyl cyanide, $\rm {C_4H_9CN}$) is an active field of research. Since the grain catalysis process could have formed a major portion of these species, considering a realistic set of binding energies are indeed essential. We employ quantum chemical calculations to estimate the binding energy of these species considering water as a substrate because water is the principal constituent of this interstellar ice. We find significantly lower binding energy values for these species than were previously used. It is noticed that the use of realistic binding energy values can significantly change the abundance of these species. The branching is more favourable for the higher order alkyl cyanides with the new binding energies. With the inclusion of our new binding energy values and one essential destruction reaction ($\rm {i-C_3H_7CN+H \rightarrow CH_3C(CH_3)CN + H_2}$, having an activation barrier of 947 K), abundances of $\rm {t-C_4H_9CN}$ dramatically increased.