The continuity dilemma and hartree-fock
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N. Moiseyev; J. Katriel
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Article
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1974
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Elsevier Science
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English
โ 403 KB
The stability criteria of the Hartree-Fock wavefunctions YC implemented in the context of the Raothaan-Ha&e-e-Fock procedure. Use is made of modified SCF equations, in which the total enera, rather than orbital energies, appezxs. The procedure is applied to the 2 'S state of helium.