Pi Electronic Structure of the Benzene Molecule
- 15 September 1963
- journal article
- research article
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 39 (6), 1557-1560
- https://doi.org/10.1063/1.1734479
Abstract
A configuration‐interaction calculation in a molecular orbital basis has been performed for the benzene molecule. The Goeppert‐Mayer and Sklar core approximation has been assumed. All three‐ and four‐center integrals have been accurately computed.Keywords
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