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Hartree-Fock Intermediate Neglect Differential Overlap Single

On the basis of the optimized ground-slate geometries, we simulate the absorption speetra by combining the scmicmpirical Hartree-Fock Intermediate Neglect of Differential Overlap (INDO) Hamiltonian to a Single Configuration Interaction... [Pg.372]

See other pages where Hartree-Fock Intermediate Neglect Differential Overlap Single is mentioned: [Pg.74]    [Pg.312]    [Pg.321]    [Pg.715]    [Pg.92]    [Pg.168]    [Pg.958]    [Pg.158]    [Pg.41]    [Pg.649]    [Pg.715]    [Pg.5]   


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Neglect

Overlap differential

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