The inclusion of electron correlation in calculations on large molecules.
Autor: | Peacock, TE |
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Zdroj: | Australian Journal of Chemistry; 1972, Vol. 25 Issue: 2 p223-229, 7p |
Abstrakt: | This paper reviews some of the methods by which electron correlation can be included in calculations on large conjugated molecules. The methods discussed are applied to benzene and the linear polyenes. |
Databáze: | Supplemental Index |
Externí odkaz: |