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Generalized Molecular Orbital Theory II

โœ Scribed by Couty, Marc; Hall, Michael B.


Book ID
127314763
Publisher
American Chemical Society
Year
1997
Tongue
English
Weight
241 KB
Volume
101
Category
Article
ISSN
1089-5639

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The useful perturbation expressions for wave functions and energies ## ลฝ . that are needed in perturbational molecular orbital PMO theory are rederived and generalized in two aspects: First, degenerate systems now can be treated in a systematic manner, as in the case of nondegenerate systems. Seco