arXiv subjects

J. R. Pardo

Publications and source records attributed to J. R. Pardo.

At least 19 recordsLinked to original sources

arXiv2024

Validation of millimetre and submillimetre atmospheric collision induced absorption at Chajnantor

Due to the importance of a reference atmospheric radiative transfer model for both planning and calibrating ground-based observations at millimetre and submillimetre wavelengths, we have undertaken a validation campaign consisting of acquiring atmospheric spectra under different weather conditions, in different diurnal moments and seasons, with the Atacama Pathfinder EXperiment (APEX), due to the excellent stability of its receivers and the very high frequency resolution of its backends. As a result, a data set consisting of 56 spectra within the 157.3-742.1 GHz frequency range, at kHz resolution (smoothed to $\sim$2-10 MHz for analysis), and spanning one order of magnitude ($\sim$ 0.35-3.5 mm) in precipitable water vapour columns, has been gathered from October 2020 to September 2022. These data are unique for their quality and completeness and, due to the proximity of APEX to the Atacama Large Millimetre/Submillimetre Array (ALMA), they provide an excellent opportunity to validate the atmospheric radiative transfer model currently installed in the ALMA software. The main issues addressed in the study are possible missing lines in the model, line shapes, vertical profiles of atmospheric physical parameters and molecular abundances, seasonal and diurnal variations and collision induced absorption (CIA), to which this paper is devoted, in its N$_2$-N$_2$ + N$_2$-O$_2$ + O$_2$-O$_2$ (dry), and N$_2$-H$_2$O + O$_2$-H$_2$O (``foreign'' wet) mechanisms. All these CIA terms should remain unchanged in the above mentioned ALMA atmospheric model as a result of this work.

astro-ph.IM↗

arXiv2024

Discovery of HCCCH2CCH in TMC-1 with the QUIJOTE line survey

We present the first detection in space of 1,4-pentadiyne. It has been found towards TMC-1 with the QUIJOTE line survey in the 31-50 GHz range. We observed a total of 17 transitions with J = 2 up to 13 and Ka = 0, 1 and 2. The observed transitions allowed us to derive a rotational temperature of 9.5 +- 0.5 K and a column density of (5.0 +- 0.5) x 10^12 cm-2. This molecule was the last non-cyclic isomer of the C5H4 family that could be detected via radio astronomy. A computational chemistry study was performed to determine the energies of the five most stable isomers. The isomer (c-C3H3CCH) has a considerably higher energy than the others, and it has not yet been detected. To better understand the chemical reactions involving these species, we compared the ethynyl and cyano derivatives. The observed abundances of these species are in good agreement with the branching ratios of the formation reactions studied with our chemical model of TMC-1.

astro-ph.GA↗

arXiv2024

Multi-line study of the radial extent of SiO, CS, and SiS in AGB envelopes

The spatial distribution of molecules in AGB circumstellar envelopes is regulated by different processes. In the outer layers all molecules are destroyed due to the interaction with interstellar ultraviolet photons. Here we aim to characterize in a coherent and uniform way the radial extent of three molecules (SiO, CS, and SiS) in envelopes around AGB stars of O- and C-rich character, and to study their dependence with mass loss rate. To that purpose, we used the Yebes 40m and IRAM 30m telescopes to observe 7 M-type and 7 C-type AGB envelopes covering a wide range of mass loss rates (1e-7 - 1e-5 Msun/yr) in lines of SiO, CS, and SiS spanning a range of upper level energies of 2-130 K. We carried out excitation and radiative transfer calculations over a wide parameter space to characterize the molecular abundance and radial extent. A chi2 analysis indicates that the abundance is well constrained while the radial extent is more difficult to constrain. The radial extent increases with increasing envelope density, in agreement with previous observational findings. At high envelope densities, Mdot/vexp > 1e-6 (Msun/yr)/(km/s), the radial extent of SiO, CS, and SiS are similar, while at low envelope densities, Mdot/vexp < 1e-7 (Msun/yr)/(km/s), the radial extent differ among the three molecules, in agreement with theoretical expectations based on destruction due to photodissociation. At low envelope densities we find a sequence of increasing radial extent, SiS -> CS -> SiO. We also find a tentative dependence of the radial extent with the chemical type (O- or C-rich) of the star for SiO and CS. Interferometric observations and further investigation of the photodissociation of SiO, CS, and SiS should allow to clarify the situation on the relative photodissociation radius of SiO, CS, and SiS in AGB envelopes and the dependence with envelope density and C/O ratio.

astro-ph.SR↗

arXiv2023

The magnesium paradigm in IRC+10216: Discovery of MgC$_4$H$^+$, MgC$_3$N$^+$, MgC$_6$H$^+$, and MgC$_5$N$^+$

We found four series of harmonically related lines in IRC\,+10216 with the Yebes\,40m and IRAM\,30m telescopes. The first series corresponds to a molecule with a rotational constant, $B$, of 1448.5994$\pm$0.0013 MHz and a distortion constant, $D$, of 63.45$\pm$1.15 Hz and covers upper quantum numbers from $J_u$=11 up to 33 (B1449). The second series is fitted with $B$=1446.9380$\pm$0.0098 MHz and $D$=91$\pm$23 Hz and covers upper quantum numbers from $J_u$=11 up to 17 (B1447). The third series is fitted with $B$=598.7495$\pm$0.0011 MHz and D=6.13$\pm$0.43 Hz and covers quantum numbers from $J_u$=26 up to 41 (B599). Finally, the frequencies of the last series of lines can be reproduced with $B$=594.3176$\pm$0.0026 MHz and $D$=4.92$\pm$1.16 Hz (B594). The large values of $D$ point toward four metal-bearing carriers. After exploring all plausible candidates containing Na, Al, Mg, and other metals, our ab initio calculations indicate that the cations MgC$_4$H$^+$, MgC$_3$N$^+$, MgC$_6$H$^+$, and MgC$_5$N$^+$ must be the carriers of B1449, B1447, B599, and B594, respectively. These cations could be formed by the radiative association of Mg$^+$ with C$_4$H, C$_3$N, C$_6$H, and C$_5$N, respectively. We calculated the radiative association rate coefficient of Mg$^+$ with C$_4$H, C$_3$N, C$_6$H, and C$_5$N and incorporated them in our chemical model. The results confirm that the Mg-bearing cations can be formed through these radiative association reactions in the outer layers of IRC\,+10216. This is the first time that cationic metal-bearing species have been found in space. These results provide a new paradigm on the reactivity of ionized metals with abundant radicals and open the door for further characterization of similar species in metal-rich astrophysical environments.

astro-ph.GA↗

arXiv2023

Discovery of two metallic cyanoacetylides in IRC+10216: HMgCCCN and NaCCCN

We report on the detection of a series of six lines in the ultra-deep Q-band integration toward IRC+10216 carried out with the Yebes 40m telescope, which are in harmonic relation with integer quantum numbers J from 12 to 18. After a detailed analysis of all possible carriers, guided by high-level quantum chemical calculations, we conclude that the lines belong to HMgCCCN, named hydromagnesium cyanoacetylide. The rotational temperature and column density derived for HMgCCCN are 17.1 +/- 2.8K and (3.0 +/- 0.6) e12 cm-2, respectively. The observed abundance ratio between MgCCCN and HMgCCCN is 3. In addition, we report the discovery in space, also toward IRC+10216, of sodium cyanoacetylide, NaCCCN, for which accurate laboratory data are available. For this species we derive a rotational temperature of 13.5 +/- 1.7K and a column density of (1.2 +/- 0.2) e11 cm-2.

astro-ph.GA↗

arXiv2023

Discovery of CH3CHCO in TMC-1 with the QUIJOTE line survey

We report the detection of methyl ketene towards TMC-1 with the QUIJOTE line survey. Nineteen rotational transitions with rotational quantum numbers ranging from J = 3 up to J = 5 and Ka =< 2 were identified in the frequency range 32.0-50.4 GHz, 11 of which arise above the 3σ level. We derived a column density for CH3CHCO of N=1.5x10^11 cm-2 and a rotational temperature of 9 K. Hence, the abundance ratio between ketene and methyl ketene, CH2CO/CH3CHCO, is 93. This species is the second C3H4O isomer detected. The other, trans-propenal (CH2CHCHO), corresponds to the most stable isomer and has a column density of N=(2.2+-0.3)x10^11 cm-2, which results in an abundance ratio CH2CHCHO/CH3CHCO of 1.5. The next non-detected isomer with the lowest energy is cis-propenal, which is therefore a good candidate for future discovery. We have carried out an in-depth study of the possible gas-phase chemical reactions involving methyl ketene to explain the abundance detected, achieving good agreement between chemical models and observations.

astro-ph.GA↗

arXiv2023

Discovery of the C7N- anion in TMC-1 and IRC+10216

We report on the discovery of the C7N- anion towards the starless core TMC-1 and towards the carbon-rich evolved star IRC+10216. We used the data of the QUIJOTE line survey towards TMC-1 and found six lines in perfect harmonic frequency relation from J=27-26 up to J=32-31. The frequency of the lines can be reproduced with a rotational constant and a distortion constant of B=582.68490+/-0.00024 MHz and D=4.01+/-0.13 Hz, respectively. The standard deviation of the fit is 4 kHz. Towards IRC+10216, we identify 17 lines from J=27-26 up to J=43-42; their frequencies are also in harmonic relation, providing B=582.6827+/-0.00085 MHz and D=3.31+/-0.31 Hz. The nearly exact coincidence of the rotational and distortion constants in both sources points unambiguously to a common molecular carrier. Taking into account the chemical peculiarities of both sources, the carrier could be a radical or an anion. The radical can be discarded, as the observed lines belong to a singlet species. Hence, the most plausible carrier is an anion. High-level ab initio calculations indicate that C7N-, for which we compute a rotational constant of B=582.0 MHz and a dipole moment of 7.5 D, is the carrier of the lines in both sources. We predict the neutral C7N to have a ground electronic state 2Pi and a dipole moment around 1 D. Because of this low dipole moment value and to its much larger rotational partition function, its lines are expected to be well below the sensitivity of our data for both sources.

astro-ph.GA↗

arXiv2022

Laboratory and astronomical discovery of magnesium dicarbide, MgC$_2$

We report the detection of magnesium dicarbide, MgC$_2$, in the laboratory at centimeter wavelengths and assign $^{24}$MgC$_2$, $^{25}$MgC$_2$, and $^{26}$MgC$_2$ to 14 unidentified lines in the radio spectrum of the circumstellar envelope of the evolved carbon star IRC+10216. The structure of MgC$_2$ is found to be T-shaped with a highly ionic bond between the metal atom and the C$_2$ unit, analogous to other dicarbides containing electropositive elements. A two-temperature excitation model of the MgC$_2$ emission lines observed in IRC+10216 yields a very low rotational temperature of $6\pm1$ K, a kinetic temperature of $22\pm13$ K, and a column density of $(1.0 \pm 0.3) \times 10^{12}$ cm$^{-2}$. The abundance of MgC$_2$ relative to the magnesium-carbon chains MgCCH, MgC$_4$H, and MgC$_6$H is $1{:}2{:}22{:}20$ and provides a new constraint on the sequential radiative association-dissociative recombination mechanisms implicated in the production of metal-bearing molecules in circumstellar environments.

astro-ph.SR↗

arXiv2022

Discovery of two new interstellar molecules with QUIJOTE: HCCCHCCC and HCCCCS

We report on the discovery of two new molecules, HCCCHCCC and HCCCCS, towards the starless core TMC-1 in the Taurus region from the QUIJOTE line survey in the 31.1-50.2 GHz frequency range. We identify a total of twenty-nine lines of HCCCHCCC and six rotational transitions of HCCCCS. The rotational quantum numbers range from Ju=10 up to 15 and Ka <=2 for HCCCHCCC and Ju=21/2 up to 31/2 for HCCCCS. We derived a column density for HCCCHCCC of N=(1.3+/-0.2)x10^11 cm-2 with a rotational temperature of 6+/-1 K, while for HCCCCS we derived N=(9.5+/-0.8)x10^10 cm-2 and Trot =10+/-1 K. The abundance of HCCCHCCC is higher than that of its recently discovered isomer, l-H2C6. If we compare HCCCCS with its related molecules, HCS and HCCS, we obtain abundance ratios HCS/HCCCCS=58 and HCCS/HCCCCS=7.2. We investigated the formation of these two molecules using chemical modelling calculations. The observed abundances can be accounted for by assuming standard gas-phase formation routes involving neutral-neutral reactions and ion-neutral reactions.

astro-ph.GA↗

arXiv2022

Discovery of CH2CCHC4H and a rigorous detection of CH2CCHC3N in TMC-1 with the QUIJOTE line survey

Using the QUIJOTE line survey in the 32.0-50.4 GHz range, we report the discovery of the molecule CH2CCHC4H towards the prestellar cold core TMC-1 in the Taurus region. We also present a rigorous detection of CH2CCHC3N, along with its detailed analysis. We identified a total of twenty rotational transitions for each one of these molecules. The rotational quantum numbers range from Ju=17 up to 24 and Ka<=3. The column density for CH2CCHC4H is N=(2.2+/-0.2)x 1E12 cm-2, while for CH2CCHC3N, we derived N=(1.2+/-0.15) x 1E11 cm-2. The rotational temperature is 9.0+/-0.5 K for both species. The abundance ratio between CH2CCHC4H and CH2CCHC3N is 18+/-4. We also compared the column densities of these species with those of their isomers CH3C6H and CH3C5N, derived from their J=20-19 up to J=30-29 rotational transitions observed with the QUIJOTE line survey. The observed abundances for all these species are reasonably well explained by state-of-the-art chemical models of TMC-1. The observed astronomical frequencies were merged with laboratory frequencies from the literature to derive improved spectroscopic parameters.

astro-ph.GA↗

arXiv2022

Discovery of C5H+ and detection of C3H+ in TMC-1 with the QUIJOTE line survey

We report the discovery of the C5H+ cation toward TMC-1 with the QUIJOTE line survey. Four lines from J=7-6 up to J=10-9 have been identified in perfect harmonic frequency relation that can be fit with B=2411.94397 +/-0.00055 MHz and D=138+/-3 Hz. The standard deviation of the fit is 4.4 kHz. After discarding potential candidates, C5H- among them, we conclude that the carrier is C5H+, for which accurate ab initio calculations provide B=2410.3 MHz. We also report for the first time in a cold starless core the detection of the C3H+ cation. The column densities we derive for C5H+ and C3H+ are (8.8+/-0.5)e10 cm-2 and (2.4+/-0.2)e10 cm-2, respectively. Hence, the C5H+/C3H+ abundance ratio is 3.7+/-0.5. The fact that C5H+ is more abundant than C3H+ is well explained by dedicated chemical models and is due to the slow reactivity of C5H+ with H2, while C3H+ reacts with H2.

astro-ph.GA↗

arXiv2021

Discovery of the elusive thioketenylium, HCCS+, in TMC-1

We report the detection in TMC-1 of the cation HCCS+ (3Sigma-), which is the protonated form of the widespread radical CCS. This is the first time that a protonated radical has been detected in a cold dark cloud. Twenty-six hyperfine components from twelve rotational transitions have been observed with the Yebes 40m and IRAM 30m radio telescopes. We confidently assign the characteristic rotational spectrum pattern to HCCS+ based on the good agreement between the astronomical and theoretical spectroscopic parameters. The column density of HCCS+ is (1.1+/-0.1)e12 cm-2, and the CCS/HCCS+ abundance ratio is 50+/-10, which is very similar to that of CS/HCS+ (35+/-8) and CCCS/HCCCS+ (65+/-20). From a state-of-the-art gas-phase chemical model, we conclude that HCCS+ is mostly formed by reactions of proton transfer from abundant cations such as HCO+, H3O+, and H3+ to the radical CCS.

astro-ph.GA↗

arXiv2021

New deuterated species in TMC-1: Detection of CH2DC4H with the QUIJOTE line survey

We report the first detection in space of the single deuterated isotopologue of methyldiacetylene, CH2DC4H. A total of 12 rotational transitions, with J = 8-12 and Ka = 0 and 1, were identified for this species in TMC-1 in the 31.0-50.4 GHz range using the Yebes 40m radio telescope. The observed frequencies allowed us to obtain, for the first time, the spectroscopic parameters of this deuterated isotopologue. We derived a column density of (5.5+/-0.2)e11 cm-2. The abundance ratio between CH3C4H and CH2DC4H is 24+/-2. This ratio is similar to that found for the CH3C3N/CH2DC3N analogue system, which is 22+/-2.We did not detect the deuterated species CH3C4D, which has already been observed in laboratory experiments. The detection of deuterated CH3C4H allows us to extend the discussion on the chemical mechanisms of deuterium fractionation at work in TMC-1 using a new gas-phase chemical model with multiply deuterated molecules. Introducing a possible deuterium exchange reaction between CH3CCH and atomic deuterium allows us to account for the CH3C4H/CH2DC4H abundance ratio.

astro-ph.GA↗

arXiv2021

Discovery of HCCCO and C5O in TMC-1 with the QUIJOTE line survey

We report on the detection, for the first time in space, of the radical HCCCO and of pentacarbon monoxide, C5O. The derived column densities are (1.6+/-0.2)e11 cm-2 and (1.5+/-0.2)e10 cm-2, respectively. We have also analysed the data for all the molecular species of the families HCnO and CnO within our QUIJOTE line survey. Upper limits are obtained for HC4O, HC6O, C4O, and C6O. We report a robust detection of HC5O and HC7O based on 14 and 12 rotational lines detected with a signal-to-noise ratio >30 and >5,respectively. The derived N(HC3O)/N(HC5O) abundance ratio is 0.09+/-0.03, while N(C3O)/N(C5O) is 80+/-2, and N(HC5O)/N(HC7O) is 2.2+/-0.3. As opposed to the cyanopolyyne family, HC2n+1N, which shows a continuous decrease in the abundances with increasing n, the CnO and HCnO species show a clear abundance maximum for n=3 and 5, respectively. They also show an odd and even abundance alternation, with odd values of n being the most abundant, which is reminiscent of the behaviour of CnH radicals, where in that case species with even values of n are more abundant. We explored the formation of these species through two mechanisms previously proposed, which are based on radiative associations between CnHm+ ions with CO and reactions of Cn- and CnH- anions with O atoms, and we found that several species, such as C5O, HC4O, and HC6O, are significantly overestimated. Our understanding of how these species are formed is incomplete as of yet. Other routes based on neutral-neutral reactions such as those of Cn and CnH carbon chains with O, OH, or HCO, could be behind the formation of these species.

astro-ph.GA↗

arXiv2021

Ultra-deep 31.0-50.3 GHz spectral survey of IRC+10216

Context. IRC+10216, the carbon-rich envelope of the asymptotic giant branch (AGB) star CW Leo, is one of the richest molecular sources in the sky. Available spectral surveys below 51 GHz are more than 25 years old and new work is needed. Aims. Characterizing the rich molecular content of this source, specially for heavy species, requires to carry out very sensitive spectral surveys at low frequencies. In particular in this work we have achieved an rms in the range 0.2-0.6 mK per MHz. Methods. long Q-band (31.0-50.3 GHz) single dish integrations were carried out with the Yebes 40m telescope using specifically built receivers. State of the art line catalogs are used for line identification. Results. A total of 652 spectral features corresponding to 713 transitions from 81 species (we count as different the isomers, isotopologues and ortho/para species) are present in the data. Only 57 unidentified lines remain with signal to noise ratios >3. Some new species and/or vibrational modes have been discovered for the first time with this survey. Conclusions. This IRC+10216 spectral survey is, by far, the most sensitive one carried out to this date in the Q-band. It therefore provides the most complete view of IRC+10216 from 31.0 to 50.3 GHz, giving unique information on its molecular content, specially for heavy species. Rotational diagrams built from the data provide valuable information on the physical conditions and chemical content of this circumstellar envelope.

astro-ph.GA↗

arXiv2021

Discovery of two isomers of ethynyl cyclopentadiene in TMC-1: Abundances of CCH and CN derivatives of hydrocarbon cycles

We report the detection of two isomers of ethynyl cyclopentadiene (c-C5H5CCH), namely 1- and 2-ethynyl-1,3-cyclopentadiene, in the direction of TMC-1. We derive column densities of (1.4 +/- 0.2)e12 cm-2, and (2.0 +/- 0.4)e12 cm-2, respectively, for these two cyclopentadiene derivatives, which imply that they are about ten times less abundant than cyclopentadiene. We also report the tentative detection of ethynyl benzene (C6H5CCH), for which we estimate a column density of (2.5 +/-0.4)e12 cm-2. We derived abundances for the corresponding cyano derivatives of cyclopentadiene and benzene and found values significantly lower than previously reported. The rotational temperature of the ethynyl and cyano derivatives of these cycles is about 9 K, that is, very close to the gas kinetic temperature of the cloud. The abundance ratio of the 1- and 2- isomers of ethynyl cyclopentadiene is 1.4 +/-0.5, while for the two isomers of cyano cyclopentadiene it is 2.4 +/- 0.6. The relative abundances of CCH over CN derivatives is 7.7 +/- 2.2 for cyclopentadiene, which probably reflects the abundance ratio of the radicals CCH and CN; this ratio is only 2.1 +/- 0.5 for benzene, which suggests that additional reactions besides cyano radicals with benzene are involved in the formation of benzonitrile. The formation of these cycles is reasonably well accounted for through a chemical scheme based on neutral-neutral reactions. It is predicted that benzene should be as abundant as cyclopentadiene in TMC-1.

astro-ph.GA↗

arXiv2021

Discovery of benzyne, o-C6H4, in TMC-1 with the QUIJOTE line survey

We report the detection, for the first time in space, of a new non-functionalised hydrocarbon cycle in the direction of TMC-1: o-C6H4 (ortho-benzyne). We derive a column density for this hydrocarbon cycle of (5 +/- 1)e11 cm-2. The abundance of this species is around 30 times lower than that of cyclopentadiene and indene. We compare the abundance of benzyne with that of other pure hydrocarbons, cycles or chains, and find that it could be formed from neutral-radical reactions such as C2H + CH2CHCCH and C + C5H5, and possibly through C4H + C2H4, C3H + CH2CCH2, and C3H2 + C3H3. Hence, the rich content of hydrocarbon cycles observed in TMC-1 could arise through a bottom-up scenario involving reactions of a few radicals with the abundant hydrocarbons recently revealed by the QUIJOTE line survey.

astro-ph.GA↗

arXiv2021

Magnesium radicals MgC$_5$N and MgC$_6$H in IRC+10216

After the previous discovery of MgC$_3$N and MgC$_4$H in IRC+10216, a deeper Q-band (31.0-50.3 GHz) integration on this source had revealed two additional series of harmonically related doublets that we assigned on the basis of quantum mechanical calculations to the larger radicals MgC$_5$N and MgC$_6$H. The results presented here extend and confirm previous results on magnesium-bearing molecules in IRC\,+10216. We derived column densities of (4.7$\pm$1.3)$\times$10$^{12}$ for MgC$_5$N and (2.0$\pm$0.9)$\times$10$^{13}$ for MgC$_6$H, which imply that MgC$_5$N/MgC$_3$N=0.5 and MgC$_6$H/MgC$_4$H = 0.9. Therefore, MgC$_5$N and MgC$_6$H are present with column densities not so different from those of the immediately shorter analogs. The synthesis of these large magnesium cyanides and acetylides in IRC+10216 can be explained for their shorter counterparts by a two-step process initiated by the radiative association of Mg$^+$ with large cyanopolyynes and polyynes, which are still quite abundant in this source, followed by the dissociative recombination of the ionic complexes.

astro-ph.GA↗