This work focusses on MWC 922, the central object in the Red Square Nebula. We obtained low and medium resolution spectra of both, the central object and the surrounding nebula, using the DIS and TSpec spectrograph. The spectra show the whole spectral range between ~3 500 Å up to ~25 000 Å. The central object shows a plethora of emission lines, including many Fe II and forbidden Fe [II] lines. Here, we present the inventory of the emission lines of the central object, MWC 922. Future work will comprise the identification of the nebula emission lines by using newly obtained X-Shooter spectra. That way we want to gain further insight into the physical and chemical conditions in this environment. A comparison of the Red Square to the Red Rectangle Nebula is anticipated and will guide our search for DIBs in emission.

TeV gamma ray emissions have been detected at the directions of supernova remnants (SNRs) W51C and Tycho SNR. We analyze the Hi absorption spectra towards W51C, Tycho SNR and their nearby compact sources. We conclude that W51C is at a distance of about 4.3 kpc and Tycho SNR has a distance of 2.5 ~ 3.0 kpc. Our study detects high-velocity Hi clouds which coincide with star formation region W51B, but finds that the clouds are behind W51B which argues against previous claims that W51C has shocked the high velocity Hi clouds. We argue that Tycho SNR is naked Ia SNR (lack of evidence of interacting with adjacent neutral and molecular cloud). This gives two examples that the very high gamma ray emission from SNRs does not likely originate from SNR-cloud interaction.

We briefly summarize the method of kinematic distances of Galactic radio objects and discuss the ambiguity in this method. Both Hi absorption and Hi self-absorption are effective tools to solve the kinematic distance ambiguity. We build the 21 cm Hi absorption spectrum of the complex G35.6-0.5, and suggest SNR G35.6-0.4, one component of the complex, is located at the near side distance of about 3.6 kpc.

Carriers of the diffuse interstellar bands (DIBs) cannot be definitively identified without laboratory spectra. Several techniques, including matrix isolation, cavity ringdown spectroscopy, resonance enhanced multiphoton ionization, and ion trapping, have been used to measure the electronic spectra of carbon chains and their derivatives. The gas-phase laboratory spectra could then be compared to the astronomical data of known DIBs. The choice of molecules studied in the gas phase depends on the presence of strong electronic transitions at optical wavelengths, the lifetimes of excited electronic states, and chemical feasibility in diffuse astrophysical environments. Collisional-radiative rate models have also be used in conjunction with laboratory spectra to predict absorption profiles under interstellar conditions.

Spectroscopic investigations of PAHs have been conducted for many years, commencing with solid and solution studies and more recently including gas phase characterisation of a broad range of different species. Through the development of new, efficient methods of production and more sensitive spectroscopic techniques, fresh data are becoming available for not only neutral species, but also for radicals, ions and clusters.

Studies of gas phase ion-neutral reactions provide insight into many areas of astrochemistry, including the elusive characterization of the Diffuse Interstellar Bands (DIBs). This presentation gives an overview of our experimental studies of several classes of positive and negative ions, using the flowing afterglow-selected ion flow tube and a newly modified ion trap. Earlier studies of carbon chain anions and polycyclic aromatic hydrocarbon (PAH) cations, both of which have been suggested as carriers of the DIBs, are described. More recent work including isomeric PAHs, nitrogen-containing PAHs, negative ions of PAHs, and negative ions of 5-membered heterocyclic rings are discussed. Finally, the study of quantitative thermochemistry by coupling our results with data from Photoelectron Spectroscopy is described.

The electronic spectroscopy of various polycyclic aromatic hydrocarbon (PAH) molecules has been studied in the laboratory at low temperatures using both molecular beam and matrix isolation spectroscopy techniques. While molecular beam spectra can be readily compared to astronomical observations, the band positions measured in Ne and Ar matrices are extrapolated to obtain rather good estimates for the same transitions in the gas phase. Absolute absorption cross sections are determined for gas-phase and matrix spectra by comparing them with calibrated solution spectra. All laboratory results are analyzed and discussed in view of the role that PAHs can play as carriers of the diffuse interstellar bands (DIBs). Our studies suggest that regular neutral PAHs are not responsible for any of the known strong DIBs.

Polycyclic aromatic hydrocarbon (PAH) molecules have been long considered promising candidates for the carriers of the diffuse interstellar bands (DIBs). The PAH-DIB hypothesis, however, raises two major issues. First, the number of interstellar PAH species is potentially orders of magnitude larger than the number of DIBs. Second, the absorption spectrum of a PAH is in general dominated by bands found at UV wavelengths while, conversely, DIBs are absent from the UV wavelength domain and arise at visible and near IR wavelengths. These issues do not necessarily weaken the PAH-DIB hypothesis and can actually allow us to refine it. In that context, we analyze the UV/vis absorption spectra of PAH molecules isolated in Ne matrices and propose that polyynyl-substituted PAHs, or similar species, are valid candidates for the carriers of the DIBs. Finally, a possible lifecycle for DIB-carrying PAHs is presented.

A new and sensitive set-up to swiftly test proposed carriers of the diffuse interstellar bands (DIBs), over a relatively broad spectral range, is described. The instrument utilizes broad-band cavity enhanced absorption spectroscopy (BBCEAS) and incorporates an optomechanical shutter to modulate light from a continuous incoherent light source. A pulsed supersonically expanding planar plasma expansion is used to mimic conditions in translucent interstellar clouds. Measurements of plasma durations as low as 400 μs are possible. The sensitivity is estimated to be better than 10 ppm/pass, measured with an effective exposure time of only ca. 1 s. The performance and potential of the instrument is demonstrated on spectra of C5H, C6H and C9H3 recorded through expanding hydrocarbon plasma.

Cationic polycyclic aromatic hydrocarbons (PAHs) are attractive candidates for the Diffuse Interstellar Bands, but to date not a single PAH species has been identified on the basis of a spectral agreement. This indicates either that the molecular diversity is very large or that the candidates that have been considered are not the correct ones. In particular, small/medium-sized PAH cations are submitted to photodissociation under UV photons from stars. Therefore it is of interest to characterize the spectroscopic properties of key breakdown products. Furthermore, these studies should be performed under conditions that mimic those found in interstellar space, which leads to additional experimental difficulties. We describe the approach we are developing with the PIRENEA set-up and present results on the 1-Methylpyrene cation and photo-derived species. Experimental measurements are guided by calculations based on density functional theory.

A discharge-emission spectrometer and a cavity ringdown spectrometer have been developed to aid in the solution to the diffuse interstellar band (DIB) problem. A hollow cathode was used to generate molecular ions in a discharge because it has been suggested that molecular ions are probable DIB candidates. The discharge was produced by a pulsed voltage of 1300–1500 V. A wide wavelength range of optical emission from the discharge was examined by a HORIBA Jobin Yvon iHR320 monochromator. The dispersed discharge emission was detected by a photomultiplier and was recorded via a lock-in amplifier. The 2B3u–X2B2g electronic transition of the butatriene cation H2CCCCH2+ was observed in the discharge emission of 2-butyne H3CCCCH3. The frequency of the electronic transition was measured to be 20381 cm−1, and a comparison study was made with known DIB spectra.

The resolution of the discharge-emission spectrometer is insufficient to make precise comparisons between laboratory frequencies and astronomically observed DIB spectra. We therefore developed the cavity ringdown spectrometer using the same hollow cathode. The high sensitivity of this spectrometer was confirmed by the observation of the forbidden band of O2.

The spectra of fullerenes C60 and C70, higher fullerenes C76, C78 and C84 and hydrogenated fullerenes (fulleranes) were studied in laboratory in the UV and in the visible spectral range and could be used for searching and recognizing these molecules in space. Furthermore, the radical cation spectra of all the mentioned fullerene series and also of a series of large and very large polycyclic aromatic hydrocarbons (PAHs) were generated in the laboratory and studied in the near infrared spectral range.

The tricarbon C3 molecule has been detected in a number of translucent interstellar clouds via its $A^1\Pi_{u}-X^1\Sigma_{g}^{+}$ (000-000) electronic ‘comet’ band around 4051 Å. So far, it is the largest molecule unambiguously identified in the diffuse interstellar medium. In this work, rotationally resolved laboratory spectra are presented for the corresponding transition of the 13C3 isotopologue. The spectra are recorded in direct absorption using cavity ring-down spectroscopy in combination with a supersonic plasma jet. A rotational analysis yields accurate spectroscopic parameters. In contrast to 12C3, no significant perturbations are found for (e− or f-parity) levels up to J' = 18 in the A1Π upper electronic state.

To study the interstellar chemical composition and interpret molecular observations, astrochemists have built chemical models over the years. Those models compute the composition of the gas and the icy mantles of interstellar grains taking in account a large number of processes, such as chemical reactions in the gas-phase, interactions with grain surfaces (sticking and evaporation) and chemical reactions at the surface of the grains. Those models rely on a number of parameters (physical parameters of the medium and intrinsic chemical parameters such as rate coefficients), which are estimated with an associated uncertainty. From a chemical point of view, those uncertainties are mainly due to an incomplete knowledge of the efficiency of the processes in the interstellar conditions. Many studies in the recent and past years have been undertaken to improve this knowledge, either using experimental or theoretical results in physico-chemistry.

We present the general physical conditions thought to be present in diffuse interstellar clouds. The radiation field is driving the atomic to molecular transition and the resulting physical conditions. We focus on the recent observational signatures of significant values of the cosmic ionization rate (10−16 - 10−15 s−1) which should also impact the clues to Diffuse interstellar Bands.

Ground-based and space-borne observations of diffuse molecular clouds suggest a number of areas where further improvements to modeling efforts is warranted. I will highlight those that have the widest applicability. The range in CO fractionation caused by selective isotope photodissociation, in particular the large 12C16O/13C16O ratios observed toward stars in Ophiuchus, is not reproduced well by current models. Our ongoing laboratory measurements of oscillator strengths and predissociation rates for Rydberg transitions in CO isotopologues may help clarify the situtation. The CH+ abundance continues to draw attention. Small scale structure seen toward ζ Per may provide additional constraints on the possible synthesis routes. The connection between results from optical transitions and those from radio and sub-millimeter wave transitions requires further effort. A study of OH+ and OH toward background stars reveals that these species favor different environments. This brings to focus the need to model each cloud along the line of sight separately, and to allow the physical conditions to vary within an individual cloud, in order to gain further insight into the chemistry. Now that an extensive set of data on molecular excitation is available, the models should seek to reproduce these data to place further constraints on the modeling results.

The ExoMol project aims at providing comprehensive line lists of molecular transitions which are likely to be important in the atmospheres of extra-solar planets and cool stars, including brown dwarfs. The physics of the molecules involved varies and can be categories according to the number atoms in the species. Thus the molecules can be grouped as diatomics, both closed and open and shell, triatomics, tetratomics, methane and larger species. Progress in providing complete sets of line list for the molecules in each of these categorizes is considered. The latest line lists and related data for each of the species can be found on the project website www.exomol.com.

Establishing the stability of cosmic fullerenes and fullerenic aggregates is extremely relevant for a variety of reasons. For instance, the emission features of C60 and C70 fall in the same spectral region as the Un-identified InfraRed (UIR) bands, which they could contribute to. To be able to contribute to the UIR emission, however, fullerenes must be able to survive long enough against the destruction mechanisms operating in the interstellar medium. In this study we focus on the effects of collisional processing, i.e., the bombardment by energetic ions and electrons. A recent experimental/theoretical study has shown that ion collisions with C60 clusters result in the dissociation of the cluster with the simultaneous formation of covalent fullerene dimers, which could play a role as DIBs carriers. We present here our first results about the collisional processing of C60 molecules and clusters by H, He and C ions in interstellar shocks. We have adapted the models that have previously been developed to successfully treat the collisional processing of PAHs in space. The nature of the interaction and the similarities between PAHs and fullerenes make this approach appropriate. In addition, our study shows that the formation of covalent dimers following ion collisions with C60 clusters is compatible with the astrophysical conditions under consideration.

The dipole-bound excited state of the methylene nitrile anion (CH2CN−) has been suggested as a candidate carrier for a diffuse interstellar band (DIB) at 803.8 nm. Its corresponding radical has been detected in the interstellar medium (ISM), making the existence for the anion possible. This work applies state-of-the-art ab initio methods such as coupled cluster theory to reproduce accurately the electronic excitations for CH2CN− and the similar methylene enolate anion, CH2CHO−. This same approach has been employed to indicate that 19 other anions may possess electronically excited states, five of which are valence in nature. Concurrently, in order to assist in the detection of these anions in the ISM, work has also been directed towards predicting vibrational frequencies and spectroscopic constants for these anions through the use of quartic force fields (QFFs). Theoretical rovibrational work on anions has thus far included studies of CH2CN−, C3H−, and is currently ongoing for similar systems.

About a thousand optical absorption features on the interstellar extinction curve popularly known as the Diffuse Interstellar Bands (DIBs) have been observed. The numbers are increasing every year, thanks to the improvement in telescope and spectroscopic technology. Ultra-high resolution spectroscopic observations and emission features corresponding to some of the DIBs suggest that, some if not all, of these features are due to large molecules. The strength of DIBs depend on the amount of reddening which is directly proportional to the amount of material present between the background star and the observer. Since, the strengths of the DIBs are not strongly correlated with each other, there must be several carriers. Time Dependent Density Functional Theory (TDDFT) calculations are useful in narrowing down molecular systems that may be further investigated in the laboratory.

The observations of the unidentified infrared (UIR) bands point towards the widespread presence of Polycyclic Aromatic Hydrocarbon (PAH) molecules. Though, not a single PAH has been discovered in interstellar space, these are the largest molecules suspected to be present. PAHs are stable towards energetic environment prevailing under interstellar conditions rendering these molecules to be good candidates as DIB carriers. We report TDDFT calculations to predict electronic transitions of neutral, protonated-deuteronated and PAHs with five member rings with various sites of protonation and deuteronation. Compared to their neutral forms, these charged isoelectronic forms of PAHs are predicted to have active transitions in the visible region, which means they are suitable candidates as carriers for some of the DIBs and laboratory studies are warranted for these systems.