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- W2074367057 abstract "A study is made of the completeness of the basis sets used by Clementi and Nesbet for the calculation of atomic Hartree-Fock and correlation energies. A good criterion for completeness is found to be related to the overlap between these sets and the hydrogenic functions that contribute most in many-body perturbation theory. Thus the experience gained in perturbation-theory calculations is shown to be helpful in choosing the best basis sets for the matrix method. Moreover, perturbation calculations can be simplified in those cases where the function space can be adequately approximated by a set of easily integrable functions." @default.
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- W2074367057 date "1971-04-01" @default.
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- W2074367057 title "Criterion of Completeness for the Set of Functions Used in Matrix Hartree-Fock and Correlation-Energy Calculations" @default.
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- W2074367057 doi "https://doi.org/10.1103/physreva.3.1291" @default.
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