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Ongoing Developments in Semiempirical MO Theory

Finally, some attention has been paid to the quality of the complete electrostatic potential about the molecule at the NDDO level. This topic is discussed in Chapter 9, as are additional details associated with the performance of semiempirical models in comparison to other levels of electronic structure theory for a variety of more specialized properties. [Pg.141]


See other pages where Ongoing Developments in Semiempirical MO Theory is mentioned: [Pg.152]    [Pg.153]    [Pg.155]    [Pg.157]    [Pg.141]    [Pg.141]    [Pg.143]    [Pg.145]    [Pg.152]    [Pg.153]    [Pg.155]    [Pg.157]    [Pg.141]    [Pg.141]    [Pg.143]    [Pg.145]   


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Development theory

MO theory

Semiempirical

Semiempirical MO theory

Semiempirical theory

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