Multiconfiguration self-consistent wavef
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B. Levy
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Article
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1973
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Elsevier Science
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English
โ 382 KB
Tine results of scvcral hlC SCF calculations on CH 4, CzH4 and CzHe with minimum bases of Slater type AO's are reported. The computin,o method is a quadrstically convergent process. Better final energies are obtained if localized MO's xc used. \* These results were presented by the author at the me