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On the dependence of the energy given by a CI limited to double substitutions with respect to the number of electrons

✍ Scribed by W. Kutzelnigg; A. Meunier; B. Lévy; G. Berthier

Publisher
John Wiley and Sons
Year
1977
Tongue
English
Weight
117 KB
Volume
12
Category
Article
ISSN
0020-7608

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A tensorial formalism adapted to the case of octahedral molecules or molecular ions with halfinteger angular momenta is proposed as an extension of the usual formalism for the group chain \(O(3) \supset O_{h}\). We use the chain \(S U(2) \otimes C_{l} \supset O_{h}^{\mathrm{s}}\), where \(O_{h}^{\ma