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Morokuma decomposition/partitioning

We may now introduce a phenomenological partition of W(M/S). The analogy of W(M/S) with the few body intermolecular AE, extensively studied in QM models, could suggest the use of one of the numerous AE decompositions available in literature. In the past we used, with good results, the following partition (Kitaura and Morokuma, 1976) ... [Pg.6]

An alternative decomposition, due to K. Morokuma, partitions the interaction energy into five terms. ... [Pg.496]

See other pages where Morokuma decomposition/partitioning is mentioned: [Pg.578]    [Pg.139]    [Pg.69]    [Pg.482]    [Pg.503]    [Pg.216]    [Pg.87]   
See also in sourсe #XX -- [ Pg.843 ]



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