Pérez Villa, Andrea;David, Jorge;Fuentealba, Patricio;Restrepo, Albeiro
(2011-04-29)
Non-relativistic DFT (PW91, PBE, PB86) geometry optimizations followed by relativistic ZORA single point energy calculations on the neutral hexafluoride complexes of the series of actinides U, Np, Pu, Am, Cm, B....