arXiv subjects

E. Roueff

Publications and source records attributed to E. Roueff.

At least 73 records · Page 4Linked to original sources

arXiv2014

H$_2$ Lyman and Werner band lines and their sensitivity for a variation of the proton-electron mass ratio in the gravitational potential of white dwarfs

Recently an accurate analysis of absorption spectra of molecular hydrogen, observed with the Cosmic Origins Spectrograph aboard the Hubble Space Telescope, in the photosphere of white dwarf stars GD133 and GD29-38 was published in a Letter [Phys. Rev. Lett. 113, 123002 (2014)], yielding a constraint on a possible dependence of the proton-electron mass ratio on a gravitational field of strength 10,000 times that at the Earth's surface. In the present paper further details of that study are presented, in particular a re-evaluation of the spectrum of the $B^1Σ_u^+ - X^1Σ_g^+ (v',v'')$ Lyman bands relevant for the prevailing temperatures (12,000 - 14,000 K) of the photospheres. An emphasis is on the calculation of so-called $K_i$-coefficients, that represent the sensitivity of each individual line to a possible change in the proton-electron mass ratio. Such calculations were performed by semi-empirical methods and by ab initio methods providing accurate and consistent values. A full listing is provided for the molecular physics data on the Lyman bands (wavelengths $λ_i$, line oscillator strengths $f_i$, radiative damping rates $Γ_i$, and sensitivity coefficients $K_i$) as required for the analyses of H$_2$-spectra in hot dwarf stars. A similar listing of the molecular physics parameters for the $C^1Π_u - X^1Σ_g^+ (v',v'')$ Werner bands is provided for future use in the analysis of white dwarf spectra.

physics.atom-ph↗

arXiv2014

Tentative Detection of the Nitrosylium Ion in Space

We report the tentative detection in space of the nitrosylium ion, NO$^+$. The observations were performed towards the cold dense core Barnard 1-b. The identification of the NO$^+$ $J$=2--1 line is supported by new laboratory measurements of NO$^+$ rotational lines up to the $J$=8--7 transition (953207.189\,MHz), which leads to an improved set of molecular constants: $B_0 = 59597.1379(62)$\,MHz, $D_0 = 169.428(65)$\,kHz, and $eQq_0(\textrm{N}) = -6.72(15)$\,MHz. The profile of the feature assigned to NO$^+$ exhibits two velocity components at 6.5 and 7.5 km s$^{-1}$, with column densities of $1.5 \times 10^{12}$ and $6.5\times10^{11}$ cm$^{-2}$, respectively. New observations of NO and HNO, also reported here, allow to estimate the following abundance ratios: $X$(NO)/$X$(NO$^+$)$\simeq511$, and $X$(HNO)/$X$(NO$^+$)$\simeq1$. This latter value provides important constraints on the formation and destruction processes of HNO. The chemistry of NO$^+$ and other related nitrogen-bearing species is investigated by the means of a time-dependent gas phase model which includes an updated chemical network according to recent experimental studies. The predicted abundance for NO$^+$ and NO is found to be consistent with the observations. However, that of HNO relative to NO is too high. No satisfactory chemical paths have been found to explain the observed low abundance of HNO. HSCN and HNCS are also reported here with an abundance ratio of $\simeq1$. Finally, we have searched for NNO, NO$_2$, HNNO$^+$, and NNOH$^+$, but only upper limits have been obtained for their column density, except for the latter for which we report a tentative 3-$σ$ detection.

astro-ph.GA↗

arXiv2014

Collisional excitation of singly deuterated ammonia NH$_2$D by H$_2$

The availability of collisional rate coefficients with H$_2$ is a pre-requisite for interpretation of observations of molecules whose energy levels are populated under non local thermodynamical equilibrium conditions. In the current study, we present collisional rate coefficients for the NH$_2$D / para--H$_2$($J_2 = 0,2$) collisional system, for energy levels up to $J_τ= 7_7$ ($E_u$$\sim$735 K) and for gas temperatures in the range $T = 5-300$K. The cross sections are obtained using the essentially exact close--coupling (CC) formalism at low energy and at the highest energies, we used the coupled--states (CS) approximation. For the energy levels up to $J_τ= 4_2$ ($E_u$$\sim$215 K), the cross sections obtained through the CS formalism are scaled according to a few CC reference points. These reference points are subsequently used to estimate the accuracy of the rate coefficients for higher levels, which is mainly limited by the use of the CS formalism. Considering the current potential energy surface, the rate coefficients are thus expected to be accurate to within 5\% for the levels below $J_τ= 4_2$, while we estimate an accuracy of 30\% for higher levels.

astro-ph.GA↗

arXiv2014

Deuteration around the ultracompact HII region Mon R2

The massive star-forming region Mon R2 hosts the closest ultra-compact HII region that can be spatially resolved with current single-dish telescopes. We used the IRAM-30m telescope to carry out an unbiased spectral survey toward two important positions (namely IF and MP2), in order to studying the chemistry of deuterated molecules toward Mon R2. We found a rich chemistry of deuterated species at both positions, with detections of C2D, DCN, DNC, DCO+, D2CO, HDCO, NH2D, and N2D+ and their corresponding hydrogenated species and isotopologs. Our high spectral resolution observations allowed us to resolve three velocity components: the component at 10 km/s is detected at both positions and seems associated with the layer most exposed to the UV radiation from IRS 1; the component at 12 km/s is found toward the IF position and seems related to the molecular gas; finally, a component at 8.5 km/s is only detected toward the MP2 position, most likely related to a low-UV irradiated PDR. We derived the column density of all the species, and determined the deuterium fractions (Dfrac). The values of Dfrac are around 0.01 for all the observed species, except for HCO+ and N2H+ which have values 10 times lower. The values found in Mon R2 are well explained with pseudo-time-dependent gas-phase model in which deuteration occurs mainly via ion-molecule reactions with H2D+, CH2D+ and C2HD+. Finally, the [H13CN]/[HN13C] ratio is very high (~11) for the 10 km/s component, which also agree with our model predictions for an age of ~0.01-0.1 Myr. The deuterium chemistry is a good tool for studying star-forming regions. The low-mass star-forming regions seem well characterized with Dfrac(N2H+) or Dfrac(HCO+), but it is required a complete chemical modeling to date massive star-forming regions, because the higher gas temperature together with the rapid evolution of massive protostars.

astro-ph.GA↗

arXiv2014

Photodissociation of interstellar ArH+

Aims. Following the recent detection of 36ArH+ in the Crab nebula spectrum, we have computed the photodissociation rate of ArH+ in order to constrain the physical processes at work in this environment. Methods. Photodissociation cross sections of ArH+ are computed in an ab initio approach including explicit account of spin-orbit coupling. Results. We report the photodissociation cross section of ArH+ as a function of wavelength. Photodissociation probabilities are derived for different impinging radiation fields.The photodissociation probability of for a very small unshielded cloud surrounded on all sides by the unshielded InterStellar Radiation Field (ISRF) model described by Draine (1978) is equal to 9.9e-12 s-1 and 1.9e-9 s-1 in the Crab nebula conditions. The dependence on the visual extinction is obtained by using the Meudon Photon Dominated Region (PDR) code and corresponding analytical fits are provided. Conclusions. These data will help to produce a realistic chemical network to interpret the observations. Photodissociation of ArH+ is found to be moderate and the presence of this molecular ion is mainly dependent on the molecular fraction

astro-ph.GA↗

arXiv2013

The IRAM-30m line survey of the Horsehead PDR: IV. Comparative chemistry of H2CO and CH3OH

Aims. We investigate the dominant formation mechanism of H2CO and CH3OH in the Horsehead PDR and its associated dense core. Methods. We performed deep integrations of several H2CO and CH3OH lines at two positions in the Horsehead, namely the PDR and dense core, with the IRAM-30m telescope. In addition, we observed one H2CO higher frequency line with the CSO telescope at both positions. We determine the H2CO and CH3OH column densities and abundances from the single-dish observations complemented with IRAM-PdBI high-angular resolution maps (6") of both species. We compare the observed abundances with PDR models including either pure gas-phase chemistry or both gas-phase and grain surface chemistry. Results. We derive CH3OH abundances relative to total number of hydrogen atoms of ~1.2e-10 and ~2.3e-10 in the PDR and dense core positions, respectively. These abundances are similar to the inferred H2CO abundance in both positions (~2e-10). We find an abundance ratio H2CO/CH3OH of ~2 in the PDR and ~1 in the dense core. Pure gas-phase models cannot reproduce the observed abundances of either H2CO or CH3OH at the PDR position. Both species are therefore formed on the surface of dust grains and are subsequently photodesorbed into the gas-phase at this position. At the dense core, on the other hand, photodesorption of ices is needed to explain the observed abundance of CH3OH, while a pure gas-phase model can reproduce the observed H2CO abundance. The high-resolution observations show that CH3OH is depleted onto grains at the dense core. CH3OH is thus present in an envelope around this position, while H2CO is present in both the envelope and the dense core itself. Conclusions. Photodesorption is an efficient mechanism to release complex molecules in low FUV-illuminated PDRs, where thermal desorption of ice mantles is ineffective.

astro-ph.GA↗

arXiv2013

Nitrogen isotopic ratios in Barnard 1: a consistent study of the N2H+, NH3, CN, HCN and HNC isotopologues

The 15N isotopologue abundance ratio measured today in different bodies of the solar system is thought to be connected to 15N-fractionation effects that would have occured in the protosolar nebula. The present study aims at putting constraints on the degree of 15N-fractionation that occurs during the prestellar phase, through observations of D, 13C and 15N-substituted isotopologues towards B1b. Both molecules from the nitrogen hydride family, i.e. N2H+ and NH3, and from the nitrile family, i.e. HCN, HNC and CN, are considered in the analysis. As a first step, we model the continuum emission in order to derive the physical structure of the cloud, i.e. gas temperature and H2 density. These parameters are subsequently used as an input in a non-local radiative transfer model to infer the radial abundances profiles of the various molecules. Our modeling shows that all the molecules are affected by depletion onto dust grains, in the region that encompasses the B1-bS and B1-bN cores. While high levels of deuterium fractionation are derived, we conclude that no fractionation occurs in the case of the nitrogen chemistry. Independently of the chemical family, the molecular abundances are consistent with 14N/15N~300, a value representative of the elemental atomic abundances of the parental gas. The inefficiency of the 15N-fractionation effects in the B1b region can be linked to the relatively high gas temperature ~17K which is representative of the innermost part of the cloud. Since this region shows signs of depletion onto dust grains, we can not exclude the possibility that the molecules were previously enriched in 15N, earlier in the B1b history, and that such an enrichment could have been incorporated into the ice mantles. It is thus necessary to repeat this kind of study in colder sources to test such a possibility.

astro-ph.GA↗

arXiv2013

CH2D+, the Search for the Holy Grail

CH2D+, the singly deuterated counterpart of CH3+, offers an alternative way to mediate formation of deuterated species at temperatures of several tens of K, as compared to the release of deuterated species from grains. We report a longstanding observational search for this molecular ion, whose rotational spectroscopy is not yet completely secure. We summarize the main spectroscopic properties of this molecule and discuss the chemical network leading to the formation of CH2D+, with explicit account of the ortho/para forms of H2, H3+ and CH3+. Astrochemical models support the presence of this molecular ion in moderately warm environments at a marginal level.

astro-ph.GA↗

arXiv2013

Detection of the Ammonium Ion in Space

We report on the detection of a narrow feature at 262816.73 MHz towards Orion and the cold prestellar core B1-bS, that we attribute to the 1(0)-0(0) line of the deuterated Ammonium ion, NH3D+. The observations were performed with the IRAM 30m radio telescope. The carrier has to be a light molecular species as it is the only feature detected over 3.6 GHz of bandwidth. The hyperfine structure is not resolved indicating a very low value for the electric quadrupolar coupling constant of Nitrogen which is expected for NH3D+ as the electric field over the N nucleus is practically zero. Moreover, the feature is right at the predicted frequency for the 1(0)-0(0) transition of the Ammonium ion, 262817(6) MHz (3sigma), using rotational constants derived from new infrared data obtained in our laboratory in Madrid. The estimated column density is 1.1(0.2)e12 cm-2. Assuming a deuterium enhancement similar to that of NH2D, we derive N(NH4+) sim 2.6e13 cm-2, i.e., an abundance for Ammonium of a few 1e(-11).

astro-ph.GA↗

arXiv2013

The IRAM-30m line survey of the Horsehead PDR: III. High abundance of complex (iso-)nitrile molecules in UV-illuminated gas

Complex (iso-)nitrile molecules, such as CH3CN and HC3N, are relatively easily detected in our Galaxy and in other galaxies. We constrain their chemistry through observations of two positions in the Horsehead edge: the photo-dissociation region (PDR) and the dense, cold, and UV-shielded core just behind it. We systematically searched for lines of CH3CN, HC3N, C3N, and some of their isomers in our sensitive unbiased line survey at 3, 2, and 1mm. We derived column densities and abundances through Bayesian analysis using a large velocity gradient radiative transfer model. We report the first clear detection of CH3NC at millimeter wavelength. We detected 17 lines of CH3CN at the PDR and 6 at the dense core position, and we resolved its hyperfine structure for 3 lines. We detected 4 lines of HC3N, and C3N is clearly detected at the PDR position. We computed new electron collisional rate coefficients for CH3CN, and we found that including electron excitation reduces the derived column density by 40% at the PDR position. While CH3CN is 30 times more abundant in the PDR than in the dense core, HC3N has similar abundance at both positions. The isomeric ratio CH3NC/CH3CN is 0.15+-0.02. In the case of CH3CN, pure gas phase chemistry cannot reproduce the amount of CH3CN observed in the UV-illuminated gas. We propose that CH3CN gas phase abundance is enhanced when ice mantles of grains are destroyed through photo-desorption or thermal-evaporation in PDRs, and through sputtering in shocks. (abridged)

astro-ph.GA↗

arXiv2013

Hydrogen chloride in diffuse interstellar clouds along the line of sight to W31C (G10.6-0.4)

We report the detection of hydrogen chloride, HCl, in diffuse molecular clouds on the line of sight towards the star-forming region W31C (G10.6-0.4). The J = 1-0 lines of the two stable HCl isotopologues, H35Cl and H37Cl, are observed using the 1b receiver of the Heterodyne Instrument for the Far-Infrared (HIFI) aboard the Herschel Space Observatory. The HCl line is detected in absorption, over a wide range of velocities associated with diffuse clouds along the line of sight to W31C. The analysis of the absorption strength yields a total HCl column density of few 10^13 cm^-2, implying that HCl accounts for ~0.6 % of the total gasphase chlorine, which exceeds by a factor of ~6 the theoretical model predictions. This result is comparable to those obtained from the chemically-related species H2Cl+ and HCl+, for which large column densities have also been reported on the same line of sight. The source of discrepancy between models and observations is still unknown; however, the detection of these Cl-bearing molecules, provides key constraints for the chlorine chemistry in the diffuse gas.

astro-ph.GA↗

arXiv2012

The hyperfine structure in the rotational spectrum of CF+

Context. CF+ has recently been detected in the Horsehead and Orion Bar photo-dissociation regions. The J=1-0 line in the Horsehead is double-peaked in contrast to other millimeter lines. The origin of this double-peak profile may be kinematic or spectroscopic. Aims. We investigate the effect of hyperfine interactions due to the fluorine nucleus in CF+ on the rotational transitions. Methods. We compute the fluorine spin rotation constant of CF+ using high-level quantum chemical methods and determine the relative positions and intensities of each hyperfine component. This information is used to fit the theoretical hyperfine components to the observed CF+ line profiles, thereby employing the hyperfine fitting method in GILDAS. Results. The fluorine spin rotation constant of CF+ is 229.2 kHz. This way, the double-peaked CF+ line profiles are well fitted by the hyperfine components predicted by the calculations. The unusually large hyperfine splitting of the CF+ line therefore explains the shape of the lines detected in the Horsehead nebula, without invoking intricate kinematics in the UV-illuminated gas.

astro-ph.GA↗

arXiv2012

The IRAM-30m line survey of the Horsehead PDR: II. First detection of the l-C3H+ hydrocarbon cation

We present the first detection of the l-C3H+ hydrocarbon in the interstellar medium. The Horsehead WHISPER project, a millimeter unbiased line survey at two positions, namely the photo-dissociation region (PDR) and the nearby shielded core, revealed a consistent set of eight unidentified lines toward the PDR position. Six of them are detected with a signal-to-noise ratio from 6 to 19, while the two last ones are tentatively detected. Mostly noise appears at the same frequency toward the dense core, located less than 40" away. We simultaneously fit 1) the rotational and centrifugal distortion constants of a linear rotor, and 2) the Gaussian line shapes located at the eight predicted frequencies. The observed lines can be accurately fitted with a linear rotor model, implying a 1Sigma ground electronic state. The deduced rotational constant value is Be= 11244.9512 +/- 0.0015 MHz, close to that of l-C3H. We thus associate the lines to the l-C3H+ hydrocarbon cation, which enables us to constrain the chemistry of small hydrocarbons. A rotational diagram is then used to infer the excitation temperature and the column density. We finally compare the abundance to the results of the Meudon PDR photochemical model.

astro-ph.GA↗

arXiv2012

The IRAM-30m line survey of the Horsehead PDR: I. CF+ as a tracer of C+ and a measure of the Fluorine abundance

C+ is a key species in the interstellar medium but its 158 μm fine structure line cannot be observed from ground-based telescopes. Current models of fluorine chemistry predict that CF+ is the second most important fluorine reservoir, in regions where C+ is abundant. We detected the J = 1-0 and J = 2-1 rotational lines of CF+ with high signal-to-noise ratio towards the PDR and dense core positions in the Horsehead. Using a rotational diagram analysis, we derive a column density of N(CF+) = (1.5 - 2.0) \times 10^12 cm^-2. Because of the simple fluorine chemistry, the CF+ column density is proportional to the fluorine abundance. We thus infer the fluorine gas-phase abundance to be F/H = (0.6 - 1.5) \times 10^-8. Photochemical models indicate that CF+ is found in the layers where C+ is abundant. The emission arises in the UV illuminated skin of the nebula, tracing the outermost cloud layers. Indeed, CF+ and C+ are the only species observed to date in the Horsehead with a double peaked line profile caused by kinematics. We therefore propose that CF+, which is detectable from the ground, can be used as a proxy of the C+ layers.

astro-ph.GA↗

arXiv2012

Multi-line detection of O2 toward rho Oph A

Models of pure gas-phase chemistry in well-shielded regions of molecular clouds predict relatively high levels of molecular oxygen, O2, and water, H2O. Contrary to expectation, the space missions SWAS and Odin found only very small amounts of water vapour and essentially no O2 in the dense star-forming interstellar medium. Only toward rho Oph A did Odin detect a weak line of O2 at 119 GHz in a beam size of 10 arcmin. A larger telescope aperture such as that of the Herschel Space Observatory is required to resolve the O2 emission and to pinpoint its origin. We use the Heterodyne Instrument for the Far Infrared aboard Herschel to obtain high resolution O2 spectra toward selected positions in rho Oph A. These data are analysed using standard techniques for O2 excitation and compared to recent PDR-like chemical cloud models. The 487.2GHz line was clearly detected toward all three observed positions in rho Oph A. In addition, an oversampled map of the 773.8GHz transition revealed the detection of the line in only half of the observed area. Based on their ratios, the temperature of the O2 emitting gas appears to vary quite substantially, with warm gas (> 50 K) adjacent to a much colder region, where temperatures are below 30 K. The exploited models predict O2 column densities to be sensitive to the prevailing dust temperatures, but rather insensitive to the temperatures of the gas. In agreement with these model, the observationally determined O2 column densities seem not to depend strongly on the derived gas temperatures, but fall into the range N(O2) = (3 to >6)e15/cm^2. Beam averaged O2 abundances are about 5e-8 relative to H2. Combining the HIFI data with earlier Odin observations yields a source size at 119 GHz of about 4 - 5 arcmin, encompassing the entire rho Oph A core.

astro-ph.GA↗

arXiv2011

Observing a column-dependent zeta in dense interstellar sources: the case of the Horsehead Nebula

Context: Observations of small carbon-bearing molecules such as CCH, C4H, c-C3H2, and HCO in the Horsehead Nebula have shown these species to have higher abundances towards the edge of the source than towards the center. Aims: Given the determination of a wide range of values for zeta (s-1), the total ionization rate of hydrogen atoms, and the proposal of a column-dependent zeta(N_H), where N_H is the total column of hydrogen nuclei, we desire to determine if the effects of zeta(N_H) in a single object with spatial variation can be observable. We chose the Horsehead Nebula because of its geometry and high density. Method: We model the Horsehead Nebula as a near edge-on photon dominated region (PDR), using several choices for zeta, both constant and as a function of column. The column-dependent zeta functions are determined by a Monte Carlo model of cosmic ray penetration, using a steep power-law spectrum and accounting for ionization and magnetic field effects. We consider a case with low-metal elemental abundances as well as a sulfur-rich case. Results: We show that use of a column-dependent zeta(N_H) of 5(-15) s-1 at the surface and 7.5(-16) s-1 at Av = 10 on balance improves agreement between measured and theoretical molecular abundances, compared with constant values of zeta.

astro-ph.GA↗

arXiv2011

H2CO in the Horsehead PDR: Photo-desorption of dust grain ice mantles

Aims: For the first time we investigate the role of the grain surface chemistry in the Horsehead Photo-dissociation region (PDR). Methods: We performed deep observations of several H2CO rotational lines toward the PDR and its associated dense-core in the Horsehead nebula, where the dust is cold ($\Td \simeq 20-30$ K). We complemented these observations with a map of the p-H2CO $~3_{03}-2_{02}$ line at 218.2 GHz (with 12" angular resolution). We determine the H2CO abundances using a detailed radiative transfer analysis and compare these results with PDR models that include either pure gas-phase chemistry or both gas-phase and grain surface chemistry. Results: The H2CO abundances ($\simeq 2-3 \times 10^{-10}$) with respect to H-nuclei are similar in the PDR and dense-core. In the dense-core the pure gas-phase chemistry model reproduces the observed H2CO abundance. Thus, surface processes do not contribute significantly to the gas-phase H2CO abundance in the core. In contrast, the formation of H2CO on the surface of dust grains and subsequent photo-desorption into the gas-phase are needed in the PDR to explain the observed gas-phase H2CO abundance, because the gas-phase chemistry alone does not produce enough H2CO. The assignments of different formation routes are strengthen by the different measured ortho-to-para ratio of H2CO: the dense-core displays the equilibrium value ($\sim3$) while the PDR displays an out-of-equilibrium value ($\sim2$). Conclusions: Photo-desorption of H2CO ices is an efficient mechanism to release a significant amount of gas-phase H2CO into the Horsehead PDR.

astro-ph.GA↗

arXiv2010

Reaction Networks For Interstellar Chemical Modelling: Improvements and Challenges

We survey the current situation regarding chemical modelling of the synthesis of molecules in the interstellar medium. The present state of knowledge concerning the rate coefficients and their uncertainties for the major gas-phase processes -- ion-neutral reactions, neutral-neutral reactions, radiative association, and dissociative recombination -- is reviewed. Emphasis is placed on those reactions that have been identified, by sensitivity analyses, as 'crucial' in determining the predicted abundances of the species observed in the interstellar medium. These sensitivity analyses have been carried out for gas-phase models of three representative, molecule-rich, astronomical sources: the cold dense molecular clouds TMC-1 and L134N, and the expanding circumstellar envelope IRC +10216. Our review has led to the proposal of new values and uncertainties for the rate coefficients of many of the key reactions. The impact of these new data on the predicted abundances in TMC-1 and L134N is reported. Interstellar dust particles also influence the observed abundances of molecules in the interstellar medium. Their role is included in gas-grain, as distinct from gas-phase only, models. We review the methods for incorporating both accretion onto, and reactions on, the surfaces of grains in such models, as well as describing some recent experimental efforts to simulate and examine relevant processes in the laboratory. These efforts include experiments on the surface-catalysed recombination of hydrogen atoms, on chemical processing on and in the ices that are known to exist on the surface of interstellar grains, and on desorption processes, which may enable species formed on grains to return to the gas-phase.

astro-ph.GA↗