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arxiv: 1104.2188 · v1 · pith:3YB5ETCKnew · submitted 2011-04-12 · ❄️ cond-mat.str-el

Ab initio calculations with the dynamical vertex approximation

classification ❄️ cond-mat.str-el
keywords beyondcorrelationsdynamicalinitiovertexapproachapproximationbare
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We propose an approach for the ab initio calculation of materials with strong electronic correlations which is based on all local (fully irreducible) vertex corrections beyond the bare Coulomb interaction. It includes the so-called GW and dynamical mean field theory and important non-local correlations beyond, with a computational effort estimated to be still manageable.

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