At the 1988 IAU General Assembly in Baltimore, among many who offered reminiscences of earlier meetings was Charlotte Moore Sitterly. She first attended the 1932 GA meeting, in Cambridge, Mass., though she already “helped to assemble material for delegates” since the 1920s, for astronomers at Princeton, Mount Wilson and Lick Observatory. She was an ardent member of the new Commission 14 (then called “Fundamental Spectroscopic Data”), eventually becoming its president. In her 1988 reminiscence, she recalled that the Commission meeting was sparsely attended and very informal, but astronomers’ “never-ending demand for tables and data analysis” soon changed all that (Sitterly 1988). Here we provide a brief overview of how Charlotte Moore Sitterly came to be at the very center of that change, which Donald Menzel early on described as having “turned chaos into order” and just a “little short of miraculous” (Menzel 1928) We will recount highlights of her early life, aspirations, training, and contributions during her years at Princeton, Berkeley, Mount Wilson, and the National Bureau of Standards.

Most (yet not all) results of atomic physics research of Charlotte Moore Sitterly (CMS), which was closely connected to astrophysics, are now incorporated in online databases, one of which is the Atomic Spectra Database of the National Institute of Standards and Technology. The use of this database extends far beyond astrophysics, but this review focuses on astrophysical applications. The impact of CMS’s work on modern atomic physics and other sciences is discussed, and problems that urgently need solutions are outlined.

The paper corresponds to the session organised by the IAU inter-commission B2-B5 working group “Laboratory Astrophysics Data Compilation, Validation and Standardization: from the Laboratory to FAIR usage in the Astronomical Community” at the IAU 2022 General Assembly. The session included talks about the usage and implementation of FAIR concepts in VAMDC and in the IVOA, then domain specific talks oriented towards planetology, dust and ices. The program (doi.org/10.5281/zenodo.7050654) and the various talks can be found in the ZENODO “cb5-labastro” community (zenodo.org/communities/cb5-labastro).

This paper gives an overview of the IAU B5 commission session on “Laboratory Astrophysics Activities” at the 2022 IAU General Assembly (GA). It provides a brief overview of the talks that were given in that session. The IAU 2022 GA B5 commission meeting was organised to present Laboratory Astrophysics activities in various parts of the world in an attempt to provide a first step towards a “Global Network of Laboratory Astrophysics Network of Activities and Data”. The program (10.5281/zenodo.7051332) and the presentations can be found in the ZENODO “cb5-labastro” community (https://zenodo.org/communities/cb5-labastro).

Experimental studies are key to investigating the physical and chemical processes that drive cloud and haze formation from gas and solid phase molecular precursors in (exo)planetary environments, and validating the theoretical calculations used in models of (exo)planetary atmospheres. They allow characterizing the physical, optical, and chemical properties of laboratory-generated analogs, hence providing critical input parameters to models for observational data analysis. In this paper, we present examples of (1) experiments performed with different facilities to produce analogs of Titan and exoplanet atmospheric aerosols from gas phase molecular precursors, and (2) the characterization of these analogs to provide information on their composition, morphology, and optical constants to the scientific community. We also introduce the recently launched NASA Center for Optical Constants (NCOC), which will provide this critical data to the scientific community for (exo)planetary-relevant ices and organic refractory materials produced in the laboratory from the irradiation of gas and ice precursors.

Molecular data obtained from laboratory studies are crucial for deriving chemical abundances in astrophysical environments. The Leiden Ice Database for Astrochemistry (LIDA; https://icedb.strw.leidenuniv.nl/) has supported these studies for years in the context of astrophysical ices. For the era of the James Webb Space Telescope - JWST, LIDA hosts more than 1100 infrared spectra of pure and mixed ices that mimic different astrophysical conditions and UV-vis optical constants of water ice. Additionally, LIDA has an online tool - SPECFY, that allows the creation of protostar synthetic spectra. In this paper, we create a synthetic spectrum including OCS ice to check the detection feasibility of this molecule with a 3σ significance using JWST. The calculations are made with the exposure time calculator (ETC). LIDA is a prime deliverable of Ice Age, an Early Release Science JWST program. The collected data and online tools are also accessible for other programs collecting ice data.

The building of online atomic and molecular databases for astrophysics and for other research fields started with the beginning of the internet. These databases have encompassed different forms: databases of individual research groups exposing their own data, databases providing collected data from the refereed literature, databases providing evaluated compilations, databases providing repositories for individuals to deposit their data, and so on. They were, and are, the replacement for literature compilations with the goal of providing more complete and in particular easily accessible data services to the users communities. Such initiatives involve not only scientific work on the data, but also the characterization of data, which comes with the “standardization” of metadata and of the relations between metadata, as recently developed in different communities. This contribution aims at providing a representative overview of the atomic and molecular databases ecosystem, which is available to the astrophysical community and addresses different issues linked to the use and management of data and databases. The information provided in this paper is related to the keynote lecture “Atomic and Molecular Databases: Open Science for better science and a sustainable world” whose slides can be found at DOI : doi.org/10.5281/zenodo.6979352 on the Zenodo repository connected to the “cb5-labastro” Zenodo Community (https://zenodo.org/communities/cb5-labastro).

This paper corresponds to an invited oral contribution to the session 5A organised by the IAU inter-commission B2-B5 working group (WG) “Laboratory Astrophysics Data Compilation, Validation and Standardization: from the Laboratory to FAIR usage in the Astronomical Community” at the IAU 2022 General Assembly (GA) Rengel (2022). This WG provides a platform where to discuss the Findability, Accessibility,Interoperability, Reuse (FAIR) usage of laboratory Atomic and Molecular (A&M) data in astronomy and astrophysics.

A&M data play a key role in the understanding of the physics and chemistry of processes in several research topics, including planetary science and interdisciplinary research in particular the atmospheres of planets and planetary explorations, etc. Databases, compilation of spectroscopic parameters, and facility tools are used by computer codes to interpret spectroscopic observations and simulate them. In this talk I presented existing A&M databases of interest to the planetary community focusing on access, organisation, infrastructures, limitations and issues, etc.

Through Spectroscopy, we aim to develop the field of pulsating stars, especially the atmospheric dynamics of high amplitude pulsators such as RR Lyr and R Scuti, in order to establish new models of the mechanical and thermal behavior of their atmospheres (shock waves, relaxation time, energy loss…). We used high-resolution spectra over a total of 81 nights from made with the spectrograph Eshell during years 2013 and 2015 runs from Oukaïmeden observatory in the High Atlas mountains (Morocco) completed with made with the spectrograph ELODIE (Haute Provence observatory, France) during years 1994–1997. A detailed analysis of line profile variations over the whole pulsation cycle is performed. Shock wave velocity and lines intensity were used as indicators of atmospheric dynamics activities. We have obtained and compared our results with those obtained by the large telescopes, we have obtained thanks to our site very satisfactory results, Indeed : For RR lyr: For the first time the second apparition of Helium (D3) was detected using our Telescope (0.35m) at Oukaïmeden Observatory.

For the first time, during the phase of expansion of the star, the emission of the line D3 is visible on various phases Blazhko, including during the minimum of the cycle Blazhko.

Also, we presented the results of a long- term, high-resolution spectroscopic study of the variable star R Sct. We analyzed the features of the optical spectra of this object and found RSct shows irregular behavior in its slight variations for much of the time that it was observed. Its average period is close to 142 d, but some- times the irregularities are so strong that it is not possible to define a periodic variation.

Using the SDSS spectroscopy, we have carried out fine optical spectral classification for activity types for 710 AGN candidates. These objects come from a larger sample of some 2,500 candidate AGN using pre-selection by various samples; bright objects of the Catalog of Quasars and Active Galactic Nuclei, AGN candidates among X-ray sources, optically variable radio sources, IRAS extragalactic objects, etc. A number of papers have been published with the results of this spectral classification. More than 800 QSOs have been identified and classified, including 710 QSOs, Seyferts and Composites. The fine classification shows that many QSOs show the same features as Seyferts, i.e., subtypes between S1 and S2 (S1.2, S1.5, S1.8 and S1.9). We have introduced subtypes for the QSOs: QSO1.2, QSO1.5, QSO1.8, QSO1.9, though the last subtype does not appear in SDSS wavelength range due to mostly highly redshifted Hα (the main line for identification of the 1.9 subtype). Thus, independent of the luminosity (which serves as a separator between QSOs and Seyferts), AGN show the same features. We also have classified many objects as Composites, spectra having composite characteristics between Sy and LINERs, Sy and HII or LINERs and HII; in some cases all three characteristics appear together resulting as Sy/LINER/HII subtype. The QSOs subtypes together with Seyfert ones allow to follow AGN properties along larger redshift range expanding our knowledge on the evolution of AGN to more distant Universe represented by QSOs.

Laboratory experiments are found to be extremely important in the field of planetary and exoplanetary science. In this proceeding, I cover three aspects of my envisioned next-generation laboratory research and the previous and current works of our group on achieving these visions. I will include three topics: 1) using material science techniques to study planetary materials, 2) collaborative laboratory research on planetary and exoplanetary haze analogs, and 3) building a robust laboratory database to better understand various atmospheric and surface processes on Titan and exoplanets. I will also elaborate on how such laboratory work could power next-generation space missions such as the Dragonfly mission to Titan and the James Webb Space Telescope.

For the last 20 years, Galactic Surveys have been revolutionizing our vision of the universe and broadening our understanding of the vastness of space that surrounds us. Galactic Surveys such as APOGEE, Gaia-ESO, GALAH, WEAVE and the currently-under-development 4MOST are teaching us a great deal about the chemical composition of stellar atmospheres, the formation and evolution of galaxies and how elements are synthesised in the universe. However, many questions remain unanswered and the current focus of ongoing and future surveys. Answering each of these questions requires the collection of data, normally as spectra, as most of the information we receive from the universe is electromagnetic radiation. Following the very expensive acquisition of astronomical spectra, another crucial task lies ahead: the analysis of these spectra to extract the priceless information they carry. High-quality atomic data of many neutral and ionised species is essential to conduct this analysis.

In the interstellar medium, inelastic collisions are so rare that they cannot maintain a local thermodynamical equilibrium (LTE). Atomic and molecular populations therefore do not follow a simple Boltzmann distribution and non-LTE spectra are the rule rather than the exception. In such conditions, accurate state-to-state collisional data are crucial for a quantitative interpretation of spectra. In recent years, considerable progress has been made in quantum calculations of inelastic cross sections for a variety of targets, types of transitions and projectiles. For a few benchmark species, detailed comparisons between theory and experiment were also carried out at the state-to-state level and in the quantum regime. In this article, we highlight such comparisons for three important molecules: CO, H2O and CH+. We also describe current computational efforts to extend these advances to ever larger targets, new transition types, and new environments (e.g. stellar envelopes or cometary atmospheres).