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Antisymmetrized products of group

The problem of estimating crystal field parameters can be solved by considering the CFT/LFT as a special case of the effective Hamiltonian theory for one group of electrons of the whole A -electronic system in the presence of other groups of electrons. The standard CFT ignores all electrons outside the d-shell and takes into account only the symmetry of the external field and the electron-electron interaction inside the d-shell. The sequential deduction of the effective Hamiltonian for the d-shell, carried out in the work [133] is based on representation of the wave function of TMC as an antisymmetrized product of group functions of d-electrons and other (valence) electrons of a complex. This allows to express the CFT s (LFT s or AOM s) parameters through characteristics of electronic structure of the environment of the metal ion. Further we shall characterize the effective Hamiltonian of crystal field (EHCF) method and its numerical results. [Pg.479]

Other attempts were made to separate groups of electrons and to put correlation into each group. The total wave function was taken as the antisymmetrized product of group functions... [Pg.320]


See other pages where Antisymmetrized products of group is mentioned: [Pg.151]    [Pg.486]   


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