Method of the orthonormality-constrained variation |
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Authors: | Tetsuo Morikawa |
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Institution: | School of Pharmaceutical Science, Toho University, Miyama, Hunabashi, Japan |
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Abstract: | The orthonormality-constrained variation method is developed, the application of which gives an exact SCF equation. The variational procedure used in deriving the equation clarifies the source and meaning of two kinds of arbitrary parameters which appear by the use of the method of lagrangean multipliers. |
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