Search Results - Malkina, O.L.

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  1. 1
    Spin–orbit corrections to NMR shielding constants from density functional theory. How important are the two-electron terms?

    Spin–orbit corrections to NMR shielding constants from density functional theory. How important are the two-electron terms? by Malkina, O.L., Schimmelpfennig, B., Kaupp, M., Hess, B.A., Chandra, P., Wahlgren, U., Malkin, V.G.

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  2. 2
    Calculations of NMR shielding constants by uncoupled density functional theory

    Calculations of NMR shielding constants by uncoupled density functional theory by Malkin, V.G., Malkina, O.L., Salahub, D.R.

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  3. 3
    Calculations of NMR shielding constants beyond uncoupled density functional theory. IGLO approach

    Calculations of NMR shielding constants beyond uncoupled density functional theory. IGLO approach by Malkin, V.G., Malkina, O.L., Salahub, D.R.

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  4. 4
    A new approximation for Slater's averaged Hartree-Fock exchange potential

    A new approximation for Slater's averaged Hartree-Fock exchange potential by Malkina, O.L., Gritsenko, O.V., Zhidomirov, G.M.

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