Symmetry-adapted-multiconfiguration SCF wavefunctions via symmetry-restricted annihilation of single excitations. I.
- 1 March 1977
- journal article
- research article
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 66 (5), 2045-2048
- https://doi.org/10.1063/1.434163
Abstract
The symmetry-restricted annihilation of single excitations formalism is extended to the case of multiconfiguration wavefunctions. The implications for a completely general computational procedure are discussed.Keywords
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