P. Bogdanovich

Atomic Data for S II—Toward Better Diagnostics of Chemical Evolution in High-redshift Galaxies

Absorption-line spectroscopy is a powerful tool used to estimate element abundances in both the nearby and distant universe. The accuracy of the abundances thus derived is naturally limited by the accuracy of the atomic data assumed for the spectral lines. We have recently started a project to perform new extensive atomic data calculations used for optical/UV spectral lines in the plasma modeling code Cloudy using state of the art quantal calculations. Here, we demonstrate our approach by focussing on S II, an ion used to estimate metallicities for Milky Way interstellar clouds as well as distant damped Lyman-alpha (DLA) and sub-DLA absorber galaxies detected in the spectra of quasars and gamma-ray bursts. We report new extensive calculations of a large number of energy levels of S II, and the line strengths of the resulting radiative transitions. Our calculations are based on the configuration interaction approach within a numerical Hartree-Fock framework, and utilize both non-relativistic and quasirelativistic one-electron radial orbitals. The results of these new atomic calculations are then incorporated into Cloudy and applied to a lab plasma, and a typical DLA, for illustrative purposes. The new results imply relatively modest changes (0.04 dex) to the metallicities estimated from S II in past studies. These results will be readily applicable to other studies of S II in the Milky Way and other galaxies.

Energy Levels and Transition Probabilities for Boron-Like Fe XXII

The Multiconfiguration Dirac-Fock method is used to calculate the energies of the 407 lowest levels in Fe xxii. These results are cross-checked using a suite of codes which employ the configuration interaction method on the basis set of transformed radial orbitals with variable parameters, and takes into account relativistic corrections in the Breit-Pauli approximation. Transition probabilities, oscillator and line strengths are presented for electric dipole (E1), electric quadrupole (E2) and magnetic dipole (M1) transitions among these levels. The total radiative transition probabilities, as well as the five largest values from each level be it of E1, M1, E2, M2, or E3 type, are also provided. Finally, the results are compared with data compiled by NIST.

Theoretical energy level spectra and transition data for 4p64d2, 4p64d4f, and 4p54d3 configurations of W36+

The ab initio quasirelativistic Hartree–Fock method developed specifically for the calculation of spectral parameters of heavy atoms and highly charged ions is used to derive transition data for a multicharged tungsten ion. The configuration interaction method is applied to include electron correlation effects. The relativistic effects are taken into account in the Breit–Pauli approximation for quasirelativistic Hartree–Fock radial orbitals. The energy level spectra, radiative lifetimes and Lande g-factors are calculated for the 4p{sup 6}4d{sup 2}, 4p{sup 6}4d4f, and 4p{sup 5}4d{sup 3} configurations of the ion W{sup 36+}. The transition wavelengths, spontaneous transition probabilities, oscillator strengths, and line strengths for the electric dipole, electric quadrupole, electric octupole, and magnetic dipole transitions among the levels of these configurations are tabulated.

ATOMIC DATA FOR ZN II: IMPROVING SPECTRAL DIAGNOSTICS OF CHEMICAL EVOLUTION IN HIGH-REDSHIFT GALAXIES

Damped Lyman-alpha (DLA) and sub-DLA absorbers in quasar spectra provide the most sensitive tools for measuring element abundances of distant galaxies. Estimation of abundances from absorption lines depends sensitively on the accuracy of the atomic data used. We have started a project to produce new atomic spectroscopic parameters for optical/UV spectral lines using state-of-the-art computer codes employing very broad configuration interaction basis. Here we report our results for Zn II, an ion used widely in studies of the interstellar medium (ISM) as well as DLA/sub-DLAs. We report new calculations of many energy levels of Zn II, and the line strengths of the resulting radiative transitions. Our calculations use the configuration interaction approach within a numerical Hartree-Fock framework. We use both non-relativistic and quasi-relativistic one-electron radial orbitals. We have incorporated the results of these atomic calculations into the plasma simulation code Cloudy, and applied them to a lab plasma and examples of a DLA and a sub-DLA. Our values of the Zn II {\lambda}{\lambda} 2026, 2062 oscillator strengths are higher than previous values by 0.10 dex. Cloudy calculations for representative absorbers with the revised Zn atomic data imply ionization corrections lower than calculated before by 0.05 dex. The new results imply Zn metallicities should be lower by 0.1 dex for DLAs and by 0.13-0.15 dex for sub-DLAs than in past studies. Our results can be applied to other studies of Zn II in the Galactic and extragalactic ISM.

Energy levels and radiative rates for transitions in Cr-like Co IV and Ni V

We report calculations of energy levels and radiative rates (

Energy levels and transition probabilities for nitrogen-like Fe xx ,

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Quasirelativistic calculation of 4s24p5, 4s24p44d and 4s4p6 configuration spectroscopic parameters for the W39+ ion

-values) for transitions in Cr-like Co IV and Ni V. The quasi-relativistic Hartree-Fock (QRHF) code is adopted for calculating the data although GRASP (general-purpose relativistic atomic structure package) and flexible atomic code (FAC) have also been employed for comparison purposes. No radiative rates are available in the literature to compare with our results, but our calculated energies are in close agreement with those compiled by NIST for a majority of the levels. However, there are discrepancies for a few levels of up to 3\%. The

An ab initio study of the spectral properties of W II

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METHODS, ALGORITHMS, AND COMPUTER CODES FOR CALCULATION OF ELECTRON-IMPACT EXCITATION PARAMETERS

-values are listed for all significantly contributing E1, E2 and M1 transitions, and the corresponding lifetimes reported, although unfortunately no previous theoretical or experimental results exist to compare with our data.

Atomic Data Revisions for Transitions Relevant to Observations of Interstellar, Circumgalactic, and Intergalactic Matter

Energies of the 700 lowest levels in Fe  have been obtained using the multiconfiguration Dirac-Fock method. Configuration interaction method on the basis set of transformed radial orbitals with variable parameters taking into account relativistic corrections in the Breit-Pauli approximation was used to crosscheck our presented results. Transition probabilities, oscillator and line strengths are presented for electric dipole (E1), electric quadrupole (E2) and magnetic dipole (M1) transitions among these levels. The total radiative transition probabilities from each level are also provided. Results are compared with data compiled by NIST and with other theoretical work.