𝔖 Bobbio Scriptorium
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Extension of the separated pair theory

✍ Scribed by E. Kapuy

Book ID
104795805
Publisher
Springer
Year
1966
Tongue
English
Weight
627 KB
Volume
6
Category
Article
ISSN
1432-2234

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πŸ“œ SIMILAR VOLUMES

Calculation of the Ο€-electron correlatio
Calculation of the Ο€-electron correlation energy of butadiene using the extended separated pair theory
✍ E. Kapuy πŸ“‚ Article πŸ“… 1969 πŸ› Elsevier Science 🌐 English βš– 222 KB

The best separated pair wave function is taken as the zeroth order approximation and a second order correction is calculated to the energy. It is found that the contribution from terms not included in former generalizations of the separated pair theory is very important.