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Polycyclic Aromatic Hydrocarbons (PAHs) are widespread across the Universe and influence many stages of the Galactic lifecycle. The presence of PAHs has been well established and the rich mid-IR PAH spectrum is now commonly used as a probe into (inter)stellar envi- ronments. The NASA Ames PAH IR Spectroscopic Database has been key to test and refine the "PAH hypothesis". This database is a large coherent set (>600 spectra) of laboratory measured and DFT computed infrared spectra of PAHs from C10H8 to C130H28 and has been made available on the web at (http://www.astrochem.org/pahdb). With a new spectral window opening up; the far-IR, the study of PAH far-IR spectra and the quest for identifying a unique member of the interstel- lar PAH family has begun. To guide this research, the far-IR (>20 µm) spectra of different sets of PAHs are investigated using the NASA Ames PAH IR Spectroscopic Database. These sets explore the influence of size, shape, charge and composition on the far-IR PAH spectrum. The far-IR is also the domain of the so-called "drumhead" modes and other molecular vibrations involving low order bending vibrations of the car- bon skeleton as a whole. As with drums, these are molecule and shape specific and promise to be a key diagnostic for specific PAHs. Here, the sensitivity of these "drumhead" modes to size and shape is assessed by comparing the frequencies of the lowest drumhead modes of a family of circular shaped (the coronene "family") and rhombus shaped (the pyrene "family") PAH molecules. From this study, some consequences for an observing strategy are drawn.

We use the NASA Ames Polycyclic Aromatic Hydrocarbon (PAH) infrared spectroscopic database to model infared emission of PAHs following absorption of a UV photon. We calculate emission spectra resulting from the full cooling cascade for each species in the database. Using a least squares approach, we can find out what PAH mixtures best reproduce a few typical astronomical observations representing the different classes of UIR spectra. We find that we can reproduce the observed UIR spectra in the wavelength range 6–14 μ m, offering support for the hypothesis that the UIR bands are indeed due to vibrational modes of PAHs and related molecular species. Spectral decompositions of our best fit models confirm and reinforce several earlier results: (i) the 6.2 μ m band requires a significant contribution of nitrogen-substituted PAHs (PANHs); (ii) the reported components and their variations in the 7.7 μ m band are indicative of changes in the size distribution of the contributing molecules; (iii) there is a significant contribution of anions to the 7.7 μ m band; (iv) the 11.2 μ m band is due to large, neutral and pure PAHs; (v) the 11.0 μ m band is due to large PAH cations.

The so-called C2-DIBs are a class of very weak bands that fall in the blue part of the optical spectrum and are associated with high column densities of the C2 molecule. DIB profile structures constrain potential molecular carriers, but their measurement requires high S/N and spectra and the use of sightlines without Doppler splitting, as typical for a single-cloud situation. Spectra from the ESO Diffuse Interstellar Bands Large Exploration Survey (EDIBLES) conducted at the VLT (ESO/Paranal) were explored to identify single-cloud and high C2 column sightlines, extract the corresponding C2-DIBs and study their strengths and profiles, and to investigate in detail any sub-structures. The target selection was made based on profile-fitting of the Sodium doublets and the detection of C2 lines. The C2 (2-0) Phillips system was fitted using a physical model of the host cloud. C2 column densities, temperatures as well as gas densities were derived for each sightline. 18 known C2-DIBs and 8 strong non-C2 DIBs were extracted towards 8 targets, comprising 7 single-cloud and one multi-cloud line-of-sights. Correlational studies revealed a tight association of the former group with the C2 columns, whereas the non-C2 DIBs are primarily correlated with reddening. We report three new weak diffuse band candidates. We show for the first time that at least 14 C2-DIBs exhibit spectral sub-structures which are consistent with unresolved rotational branches of molecular carriers. The variability of their peak separations among the bands for a given sightline implies that their carriers are different molecules with quite different sizes. We also illustrate how profiles of the same DIB vary among targets and as a function of physical parameters and provide tables defining the sub-structures to be compared with future models and experimental results., 19 pages, 15 figures, accepted for publication in A&A

It is well known that the dust properties of the diffuse interstellar medium exhibit variations towards different sight-lines on a large scale. We have investigated the variability of the dust characteristics on a small scale, and from cloud-to-cloud. We use low-resolution spectro-polarimetric data obtained in the context of the Large Interstellar Polarisation Survey (LIPS) towards 59 sight-lines in the Southern Hemisphere, and we fit these data using a dust model composed of silicate and carbon particles with sizes from the molecular to the sub-micrometre domain. Large (> 6 nm) silicates of prolate shape account for the observed polarisation. For 32 sight-lines we complement our data set with UVES archive high-resolution spectra, which enable us to establish the presence of single-cloud or multiple-clouds towards individual sight-lines. We find that the majority of these 35 sight-lines intersect two or more clouds, while eight of them are dominated by a single absorbing cloud. We confirm several correlations between extinction and parameters of the Serkowski law with dust parameters, but we also find previously undetected correlations between these parameters that are valid only in single-cloud sight-lines. We find that interstellar polarisation from multiple-clouds is smaller than from single-cloud sight-lines, showing that the presence of a second or more clouds depolarises the incoming radiation. We find large variations of the dust characteristics from cloud-to-cloud. However, when we average a sufficiently large number of clouds in single-cloud or multiple-cloud sight-lines, we always retrieve similar mean dust parameters. The typical dust abundances of the single-cloud cases are [C]/[H] = 92 ppm and [Si]/[H] = 20 ppm., A&A accepted

In this paper we study the extended atmosphere of the late-type supergiant Alpha Orionis. Infrared spectroscopy of red supergiants reveals strong molecular bands, some of which do not originate in the photosphere but in a cooler layer of molecular material above it. Lately, these layers have been spatially resolved by near and mid-IR interferometry. In this paper, we try to reconcile the IR interferometric and ISO-SWS spectroscopic results on Alpha Orionis with a thorough modelling of the photosphere, molecular layer(s) and dust shell. From the ISO and near-IR interferometric observations, we find that Alpha Orionis has only a very low density water layer close above the photosphere. However, mid-IR interferometric observations and a narrow-slit N-band spectrum suggest much larger extra-photospheric opacity close to the photosphere at those wavelengths, even when taking into account the detached dust shell. We argue that this cannot be due to the water layer, and that another source of mid-IR opacity must be present. We show that this opacity source is probably neither molecular nor chromospheric. Rather, we present amorphous alumina (Al2O3) as the best candidate and discuss this hypothesis in the framework of dust-condensation scenarios., 15 pages, 18 figures, accepted for publication in A&A

We provide direct observational evidence for a link between photospheric activity and perturbations in the dense inner-most stellar wind regions of the B supergiant starOri. The results, which are relevant to our understanding of the origin of wind structure, are based on a multi-spectral line analysis of optical time-series data secured in 1998 using the HEROS spectrograph on the ESO Dutch 0.9-m telescope in La Silla. A period of ∼1.9 days is consistently identified in Balmer, He  absorption, and weak metal lines such as Si  and C . The primary characteristic is a large-amplitude swaying of the central absorption trough of the line, with differential velocities in lines formed at varying depths in the atmosphere. The variance resulting from the "S-wave" velocity behaviour of the lines is constrained within ± the projected rotation velocity (∼80 km s −1 ) in the weakest absorption lines, but extends blue-ward to over −200 km s −1 in Hα. A second (superimposed) 1.9 day signal is present at more extended blue-ward velocities (to ∼−300 km s −1 ) in lines containing stronger circumstellar components. Inspection of archival optical data from 1996 provides evidence that this modulation signal has persisted for at least 2.5 years. Non-radial pulsational modelling is carried out in an attempt to reproduce the key observational characteristics of the line profile variability. Only limited success is obtained with prograde (m = −1) modes. The principal S-wave pattern cannot be matched by these models and remains enigmatic.

We analyse ISO-SWS01 (R ∼ 1500) 12-27.5 μm (band 3) spectra of the 10 standard calibration stars with the highest flux using synthetic spectra generated from (MARCS) atmosphere models. The comparison between the observed and synthetic spectra reveals the quality of (1) the atmospheric model construction and subsequent synthetic spectra computation and of (2) the (OLP 10.1) calibration and data reduction of the spectrometer at these wavelengths. The models represent the general features of the observations, but the synthetic spectrum computation is hampered by the lack of comprehensive molecular and atomic line lists. We also suspect some problems with the temperature distribution in the outer layers of the model and inaccuracies in the extrapolation of the collision-induced absorption coefficients of H 2 pairs. We detect baseline ripples and fringes in the observed spectra, that survive the calibration and detailed reduction process. Photometric calibration uncertainties are estimated by means of the scaling factors between the synthetic and observed spectra.

The composition of ice grains provides an important tool for the study of the molecular environment of star forming regions. Using ISAAC at the VLT to obtain spectra around 4.65 microns we have detected for the first time `XCN' and CO ice in an extragalactic environment: the nuclear region of the nearby dusty starburst/AGN galaxy NGC4945. The profile of the solid CO band reveals the importance of thermal processing of the ice while the prominence of the XCN band attests to the importance of energetic processing of the ice by FUV radiation and/or energetic particles. In analogy to the processing of ices by embedded protostars in our Galaxy, we attribute the processing of the ices in the center of NGC4945 to ongoing massive star formation. Our M-band spectrum also shows strong HI Pfund-beta and H2 0-0 S(9) line emission and gas phase CO absorption lines. The HI, H2, PAH, gas phase CO and the ices seem to be embedded in a rotating molecular disk which is undergoing vigorous star formation. Recently, strong OCN- absorption has been detected in the spectrum of the Galactic center star GC:IRS19. The most likely environment for the OCN- absorption is the strongly UV-exposed GC molecular ring. The presence of processed ice in the center of NGC4945 and our Galactic center leads us to believe that processed ice may be a common characteristic of dense molecular material in star forming galactic nuclei., 9 pages, 8 figures. Accepted for publication in A&A. Also available at this http://www.astro.rug.nl/~spoon/publications.html

w Ori (HD 37490, HR 1934) is a Be star known to have presented variations. In order to investigate the nature and origin of its short-term and mid-term variability, a study is performed of several spectral lines (Ha, Hδ, HeI 4471, 4713, 4921, 5876, 6678, CII 4267, 6578, 6583, MgII 4481, SiIII 4553 and Sill 6347), based on 249 high signal-to-noise high-resolution spectra taken with 8 telescopes over 22 consecutive nights during the MuSiCoS (Multi Site Continuous Spectroscopy) campaign in November-December 1998. The stellar parameters are revisited and the projected rotational velocity (v sin i = 179 kms - 1 ) is redetermined using several methods. With the MuSiCoS 98 dataset, a time series analysis of line-profile variations (LPVs) is performed using the Restricted Local Cleanest (RLC) algorithm and a least squares method. The behaviour of the velocity of the centroid of the lines, the equivalent widths and the apparent vsini for several lines, as well as Violet and Red components of photospheric lines affected by emission (red He I lines, Sill 6347, CII 6578, 6583) are analyzed. The non-radial pulsation (NRP) model is examined using phase diagrams and the Fourier-Doppler Imaging (FDI) method. The LPVs are consistent with a NRP mode with l = 2 or 3, ‖m‖ = 2 with frequency 1.03 cd - 1 . It is shown that an emission line outburst occurred in the middle of the campaign. Two scenarios are proposed to explain the behaviour of a dense cloud, temporarily orbiting around the star with a frequency 0.46 cd - 1 , in relation to the outburst.

We report a deep survey of diffuse interstellar bands (DIBs) between 3906 Angstrom and 6812 Angstrom under consistent observing conditions toward three very reddened and five unreddened stars. BD+63 degrees 1964's line-of-sight was shown to present exceptional DIB enhancement in number as well as in strength. The early spectral type of the star and the use of spectra of an unreddened comparison star of the same spectral type allowed to limit stellar line residuals. Using careful reduction and analysis methods we discovered 60 new DIBs which are confirmed in the reddened targets HD 183143 and BD+40 degrees 4220. We detected 25 possible DIBs which still await further confirmation, but we did not detect or confirm 28 previously reported DIBs. The present survey with 226 confirmed DIBs, measured in three targets allows a detailed and homogeneous statistical analysis on the distribution of DIB widths and intensities.