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Derivative SCF equations

To overcome some of the problems inlierent in the UFIF method, it is possible to derive SCF equations based on minimizing the energy of a wavefiinction fomied by spin projecting a single Slater detemiinant starting... [Pg.2168]


See other pages where Derivative SCF equations is mentioned: [Pg.354]    [Pg.98]   
See also in sourсe #XX -- [ Pg.98 ]




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