A short-range correlation energy density functional with multi-determinantal reference

نویسنده

  • A. Savin
چکیده

We introduce a short-range correlation density functional defined with respect to a multi-determinantal reference which is meant to be used in a multi-determinantal extension of the Kohn–Sham scheme of density functional theory based on a long-range/short-range decomposition of the Coulomb electron–electron interaction. We construct the local density approximation for this functional and discuss its performance on the He atom.

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تاریخ انتشار 2005