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- W2044155393 abstract "Abstract Electronic states of the O2+ ion are evaluated by diagonalization of the exact effective valence shall Hamiltonian Hv which has been previously calculated for O2. The present calculations are then essentially complete valence shall configuration interaction calculations using the same orbitals as for the O2 calculation, but including correlation contributions from all single and double excitations out of the valence shell. The computed results demonstrate the transferability of the Hv of O2 to the O2+ system." @default.
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- W2044155393 date "1985-01-01" @default.
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- W2044155393 title "Test of transferability in the exact effective valence shell Hamiltonian of quasi-degenerate many-body perturbation theory: O2+ calculation from O2 effective Hamiltonian" @default.
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- W2044155393 doi "https://doi.org/10.1016/0009-2614(85)80253-0" @default.
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