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- W2087892009 abstract "Relativistic molecular calculations within the Dirac-Slater scheme have been used in a study of the electronic structure of 6d-metal superheavy hexafluorides. The theoretical results are compared with calculations and measurements of the homolog 4d- and 5d-metal hexafluorides. Large spin-orbit splitting dominates the electronic structure and even has the same order of magnitude as the crystal-field splitting for the valence electrons for the superheavy molecules. Ionization energies have been calculated using a transition state procedure." @default.
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- W2087892009 date "1979-04-01" @default.
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- W2087892009 title "Relativistic molecular calculations of superheavy molecules" @default.
- W2087892009 doi "https://doi.org/10.1051/jphyscol:1979467" @default.
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