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The Valence Bond Configuration Interaction Method

In a first step, all the fundamental VB structures are involved, and a VBSCF wave function is calculated and taken as a zeroth-order wave function. [Pg.252]

Since the virtual orbitals conserve the nature of the fundamental VB structures, the entire VBCI wave function can be rewritten in a compact form, [Pg.253]


See other pages where The Valence Bond Configuration Interaction Method is mentioned: [Pg.252]   


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Bond interactions

Bonded interactions

Bonding interactions

Configuration Interaction

Configuration Interaction method

Configurational interaction

Configurational interaction method

Interaction Methods

The Bond-valence Method

Valence Bond methods

Valence bond configurations

Valence bond-configurational interaction

Valence configuration interaction

Valence configurations

Valence interaction

Valency configuration

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