To better understand plasma wall interactions involving tungsten, accurate atomic structure and electron-impact driven collisional processes for near-neutral ion stages of tungsten are required. Complementing existing work on neutral and singly ionised tungsten, atomic structure and collisional calculations for W2+ electron-impact excitation have been completed. These excitation calculations are an important component of S/XB coefficients for near-neutral charge states, which may be used to spectroscopically infer re-deposition of tungsten at the plasma-solid boundary of fusion relevant devices. With W2+ in particular having emission lines that can be observed at ultraviolet (UV) wavelengths, while higher charge states of tungsten are unlikely to have lines possible to observe outside of the vacuum UV range. The atomic structure was generated using the General-purpose Relativistic Atomic Structure Package (GRASP(0)), implementing the Multi-configuration Dirac Fock approach. This structure was the basis for a subsequent Dirac R-matrix electron-impact excitation calculation to provide Maxwellian averaged rate coefficients. A synthetic spectrum was generated from this data using a collisional-radiative model to predict the strongest W III spectral lines and these lines were compared to emission from the Compact Toroidal Hybrid (CTH) plasma device. Several of the strongest W III lines are observed in CTH and agree well with the modelled line wavelengths and intensities, a table of these lines is provided that could be observed in other devices.

We present results from a pilot study, using a laser-produced plasma, to identify new lines in the 350-1000 nm spectral region for the r-process element gold (Au), of relevance to studies of neutron star mergers. This was achieved via optical-IR spectroscopy of a laser-produced Au plasma, with an Au target of high purity (99.95%) and a low vacuum pressure to remove any air contamination from the experimental spectra. Our data were recorded with a spectrometer of 750 mm focal length and 1200 lines mm-1 grating, yielding a resolution of 0.04 nm. We find 54 lines not previously identified and which are not due to the impurities (principally copper (Cu) and silver (Ag)) in our Au sample. Of these 54 lines, we provisionally match 21 strong transitions to theoretical results from collisional-radiative models that include energy levels derived from atomic structure calculations up to the 6s level. Some of the remaining 33 unidentified lines in our spectra are also strong and may be due to transitions involving energy levels which are higher-lying than those in our plasma models. Nevertheless, our experiments demonstrate that laser-produced plasmas are well suited to the identification of transitions in r-process elements, with the method applicable to spectra ranging from UV to IR wavelengths.

A selection of electron-impact excitation R-matrix calculations completed by the collision group at Queens University Belfast are discussed. The atomic data calculated are the foundation of applications in a variety of fields, a sample of which are presented here. They include an analysis of Fe ii emission in active galactic nuclei, the possible presence of Pt and Au in the spectra of binary neutron star mergers and the viability of W ions as a diagnostic tool in magnetically confined tokamak plasmas. The radiative atomic data were computed using the most recent version of the fully relativistic structure code grasp0 and the collision cross sections were evaluated using the recently developed pdarc R-matrix package.

The detection of a gravitational-wave signal and subsequent electromagnetic transient from a neutron star merger in 2017 is consistent with expectations of neutron star mergers as an r -process element production site. Within the first few days post-merger, the kilonova spectra are consistent with a blackbody illuminating a mix of heavy, r -process elements. With increasing time, the kilonova transitions to the non-LTE regime where the level populations and ionization balance are determined by both collisional and photoprocesses. Detailed cross section data for electron-impact processes involving the relevant species are often not available. In such circumstances, it is reasonable to use approximate methods as baseline data for use in spectral modeling, and it is useful to evaluate the accuracy of such methods against more sophisticated collision calculations when possible. We describe new calculations of the electron-impact excitation cross sections of Pt i – iIi using the DARC R -matrix codes. Using collisional-radiative models, we show that, at plasma conditions expected in kilonovae, the expressions of van Regemorter and Axelrod are insufficient for producing electron-impact excitation data for complex, heavy species such as the low charge states of Pt. Through comparisons with data generated with the relativistic distorted wave approach, as implemented in the Flexible Atomic Code, we show the distorted wave method produces cross section data that, when incorporated into spectral models, predicts strong spectral feature distributions similar in intensity to those from models built on data computed with the R -matrix approach for the considered ions and plasma conditions.

ABSTRACT Neutron binary star mergers have long been proposed as sufficiently neutron rich environments that could support the synthesis of rapid neutron capture elements (r-process elements) such as gold. However, the literature reveals that beyond neutral and singly ionized systems, there is an incompleteness of atomic data for the remaining ion stages of importance for mergers. In this work, we report on relativistic atomic structure calculations for Au i–Au iii using the grasp0 codes. Comparisons to calculations using the Flexible Atomic Code suggest uncertainties on average of 9.2 per cent, 5.7 per cent, and 3.8 per cent for Au i–Au iii level energies. Agreement around ∼50 per cent is achieved between our computed A-values and those in the literature, where available. Using the grasp0 structure of Au i, we calculated electron-impact excitation rate coefficients and use a collisional-radiative model to explore the excitation dynamics and line ratio diagnostics possible in neutron star merger environments. We find that proper accounting of metastable populations is critical for extracting useful information from ultraviolet–visible line ratio diagnostics of Au i. As a test of our data, we applied our electron-impact data to study a gold hollow cathode spectrum in the literature and diagnosed the plasma conditions as Te = 3.1 ± 1.2 eV and $n_\textrm {e} = 2.7^{+1.3}_{-0.9}\times 10^{13}$ cm−3.

ABSTRACT Binary neutron star mergers are thought to be one of the dominant sites of production for rapid neutron capture elements, including platinum and gold. Since the discovery of the binary neutron star merger GW170817, and its associated kilonova AT2017gfo, numerous works have attempted to determine the composition of its outflowing material, but they have been hampered by the lack of complete atomic data. Here, we demonstrate how inclusion of new atomic data in synthetic spectra calculations can provide insights and constraints on the production of the heaviest elements. We employ theoretical atomic data (obtained using $\small {\rm GRASP}^{0}$) for neutral, singly and doubly ionized platinum and gold, to generate photospheric and simple nebular phase model spectra for kilonova-like ejecta properties. We make predictions for the locations of strong transitions, which could feasibly appear in the spectra of kilonovae that are rich in these species. We identify low-lying electric quadrupole and magnetic dipole transitions that may give rise to forbidden lines when the ejecta becomes optically thin. The strongest lines lie beyond 8000 Å, motivating high quality near-infrared spectroscopic follow-up of kilonova candidates. We compare our model spectra to the observed spectra of AT2017gfo, and conclude that no platinum or gold signatures are prominent in the ejecta. From our nebular phase modelling, we place tentative upper limits on the platinum and gold mass of ≲ a few 10−3 M⊙, and ≲ 10−2 M⊙, respectively. This work demonstrates how new atomic data of heavy elements can be included in radiative transfer calculations, and motivates future searches for elemental signatures.