The one-third paradigm of PBE0 density functional, PBE0-1/3, has shown to be a successful method for various properties. In this paper, the applicability of PBE0-1/3 is put into broader perspective for transition metals chemistry. As a comparative study, the performance of PBE0 and PBE0-1/3 has been assessed for geometries and vibrational frequencies of some transition metal hydrides and transi...

* Address for correspondence: PL-84200 Wejherowo, ul. Gen. W. Sikorskiego 11, Poland. the increments in the dipole moments, A/J, determined for different fluorescent molecules, based on the LippertMataga solvent polarity parameter are much overrated in comparison to the values /ue obtained by electrooptical methods [7-10], In the present paper we determine the dipole moments ,ug and yue of P R ...