An SCF-Xαstudy of the ionization energies of the octahedral complexes XF₆^n-(X=S, P, Si, Al)

Abstract

SCF-Xa calculations are reported for A1Fn a-, SiFe *-, PFs-and SF 6. The results for SF6 are comparable with those obtained from a recent manybody perturbation theory calculation. Ionization energies for the complexes calculated by the transition state technique agree well with experiment.

Electron superhalogens as positronium superhalogens

“…A promising direction for this investigation is the exploration of electron SH. Since the initial discovery of fluorine-substituted octahedral complexes, 41 several SH families have emerged. A notable family, proposed by Gutsev and Boldyrev, follows the general formula MX k +1 .…”