A review on the derivation of the spin-restricted Hartree-Fock (RHF) self-consistent field (SCF) equations for open-shell systems. Description of different methods to handle the off-diagonal multipliers coupling closed and open shells (Q1611942)
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scientific article; zbMATH DE number 1790650
| Language | Label | Description | Also known as |
|---|---|---|---|
| English | A review on the derivation of the spin-restricted Hartree-Fock (RHF) self-consistent field (SCF) equations for open-shell systems. Description of different methods to handle the off-diagonal multipliers coupling closed and open shells |
scientific article; zbMATH DE number 1790650 |
Statements
A review on the derivation of the spin-restricted Hartree-Fock (RHF) self-consistent field (SCF) equations for open-shell systems. Description of different methods to handle the off-diagonal multipliers coupling closed and open shells (English)
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28 August 2002
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high-spin
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singlet systems
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Born-Oppenheimer separation and approximation
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0.80210674
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0.8018595
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0.7826275
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0.7812339
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0.7803269
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0.77937627
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