DOI

Relativistic calculations of the electronic structure of the superheavy element of the eighth period - eka-francium (Z = 119) and its homologues, which form the group of alkali metals, are performed in the framework of the configuration-interaction method and many-body perturbation theory using the basis of the Dirac–Fock–Sturm orbitals (DFS). The obtained values of the ionization potentials, electron affinities, and root-mean-square radii are compared with the corresponding values calculated within the nonrelativistic approximation. A comparison with the available experimental data and the results of previous theoretical calculations is given as well. The analysis of the obtained results indicates a significant influence of the relativistic effects for the francium and eka-francium atoms, which leads to a violation of the monotonic behaviour of the listed above chemical properties as a function of the alkaline-element atomic number. In addition, the quantum electrodynamics corrections to the ionization potentials are evaluated by employing the model Lamb-shift operator (QEDMOD).
Язык оригиналаанглийский
ЖурналOPTICS AND SPECTROSCOPY
DOI
СостояниеЭлектронная публикация перед печатью - 26 дек 2021

    Предметные области Scopus

  • Атомная и молекулярная физика и оптика

    Области исследований

  • superheavy elements, alkali metals, relativistic effects, correlation effects, quantum electrodynamics corrections, configuration-interaction method, ionization potentials, electron affinities

ID: 90823770