Abstract : A Periodic System was proposed for the elements 1-172 by Pyykkö (Phys. Chem. Chem. Phys. 2011, 13, 161) on the basis of atomic and ionic calculations. In it, the elements 121-138 were nominally assigned to a 5g row. We now perform molecular, relativistic four-component DFT calculations and find that the hexafluorides of the elements 125-129 indeed enjoy occupied 5g states.
https://hal-cea.archives-ouvertes.fr/cea-01515489
Contributeur : Serge Palacin
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Soumis le : jeudi 27 avril 2017 - 15:25:53
Dernière modification le : jeudi 15 mars 2018 - 15:03:50
Document(s) archivé(s) le : vendredi 28 juillet 2017 - 13:17:01
