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arXiv · 2103.15886

Relativistic calculations of the chemical properties of the superheavy element with $Z=119$ and its homologues

I. I. Tupitsyn·A. V. Malyshev·D. A. Glazov·M. Y. Kaygorodov·Y. S. Kozhedub·I. M. Savelyev·V. M. Shabaev
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Abstract

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 non-relativistic 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).

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I. I. Tupitsyn, A. V. Malyshev, D. A. Glazov, M. Y. Kaygorodov, Y. S. Kozhedub, I. M. Savelyev, V. M. Shabaev. 2021-03-29. Relativistic calculations of the chemical properties of the superheavy element with $Z=119$ and its homologues. https://doi.org/10.1134/s0030400x21070213

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