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Valence Bond theory (Read 1438 times)
Gerrit-Jan Linker
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Valence Bond theory
22.07.11 at 21:03:40
Valence Bond theory
VB: Valence bond theory
Starting from :Atoms
Bonding :  Spin-pairing
Orbitals :  Non-Orthogonal
(historically) fixed
Simplest : 1 structure, more determinants
In general : Multi-structure
Extend : Add Ionic.. structures
Starting from : Molecules
Bonding :  Sharing Orbitals
Orbitals :  Orthogonal
In general : 1 configuration, 1 determinant
Extend : Add configurations (CI)

Valence bond lecture notes Joop H. van Lenthe, HAN 2007
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« Last Edit: 22.07.11 at 21:04:30 by Gerrit-Jan Linker »  

Gerrit-Jan Linker
Linker IT Software
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