Selectivity of Azine Ligands Toward Lanthanide(III)​/Actinide(III) Differentiation: A Relativistic DFT Based Rationalization

Autor: Abdellah Zaiter, Lotfi Belkhiri, Abdou Boucekkine, Boudersa Amine, Michel Ephritikhine, Yamina Bouzidi

Publikováno v: Inorganic Chemistry
Inorganic Chemistry, American Chemical Society, 2014, 53 (9), pp.4687-4697. ⟨10.1021/ic500361b⟩
Inorganic Chemistry, 2014, 53 (9), pp.4687-4697. ⟨10.1021/ic500361b⟩

Polyazines emerge as highly selective ligands toward actinide versus lanthanide separation. Electronic structures of several mono- and polyazine f-complexes of general formula MX3L (M(+3) = Ce, Nd, Eu, U, Am, and Cm; X = RCp(-) or NO3(-); L = N-donor

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::dc5ea0cde7c6352c6273f7107fc9b5a6
https://hal.archives-ouvertes.fr/hal-00992868

A relativistic DFT study of magnetic exchange coupling in ketimide bimetallic uranium(IV) complexes

Autor: Abdellah Zaiter, Abdou Boucekkine, Samir Meskaldji, Lotfi Belkhiri

Publikováno v: Theoretical Chemistry Accounts: Theory, Computation, and Modeling
Theoretical Chemistry Accounts: Theory, Computation, and Modeling, Springer Verlag, 2012, 15, pp.184-191. ⟨10.1007/s00214-012-1151-9⟩
Theoretical Chemistry Accounts: Theory, Computation, and Modeling, 2012, 15, pp.184-191. ⟨10.1007/s00214-012-1151-9⟩

International audience; Magnetic exchange couplings in bis(ketimide) binuclear UIV/UIV complexes [Cp′2UCl]2(μ-ketimide) diuranium(IV) and [(C5H5)2(Cl)An]2(μ-ketimide) (Cp′ = C5Me4Et; ketimide = N=CMe-(C6H4)-MeC=N) have been investigated computa

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::01593b45adf9e5ce63c25ef0c6ced056
https://hal.archives-ouvertes.fr/hal-00859596