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Local-density approximation / Hybrid functional / Jellium / Kohn–Sham equations / Density functional theory / Physics / Chemistry


DFT in depth the exchange-correlation term Robin HIRSCHL ¨ Materialphysik Institut fur and Center for Computational Material Science
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Document Date: 2003-03-18 08:13:34

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Wien / Oxford / /

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Overall LDA / /

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Austria / /

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kinetic energy difference / correlation energy / uniform electron gas / minimum energy / nonlocal and hybrid functionals applications / energy / /

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Center for Computational Material Science Universit¨at Wien / Materialphysik Institut / /

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Vxc / /

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