Ionization energy and valence electron orbital binding energy of the superheavy element Og(Z=118) and its homologs

Abstract

The ionization energy of the superheavy element Og (Z=118) and its homolog elements Ar, Kr, Xe, Rn, and their ions were systematically calculated using the GRASP2K program based on the multi-configuration Dirac-Hartree-Fock (MCDHF) method, taking into account relativistic effects, electron correlation effects between valence shell electrons (VV), quantum electrodynamics (QED) effects, and Breit interaction. To reduce the uncertainty of the ionization energy derived from electron correlation effects which are not fully considered, the ionization potential of the superheavy element Og<sup>0-2+</sup> and its homolog element Rn<sup>0-2+</sup> are extrapolated by the extrapolation method. The ionization energy of extrapolated Rn<sup>0-5+</sup> and Og<sup>5+</sup> coincides well with experimental and other theoretical values. These results can be used to predict the unknown physical and chemical properties of the atoms and compounds of the superheavy element Og. In addition, the calculation of the electron orbital binding energy of the atomic valence shell of the superheavy element Og and its homolog elements Ar, Kr, Xe, and Rn under relativistic and non-relativistic conditions shows that due to the relativistic effect, there is a strong orbital contraction phenomenon in the 7s and 7p<sub>1/2</sub> orbitals and a strong splitting phenomenon occurs in the 7p<sub>1/2</sub>and 7p<sub>3/2</sub> orbitals of Og, which may cause the physical and chemical properties of the superheavy element Og to be different from other homologs.