Multi-band D-TRILEX approach to materials with strong electronic correlations

We present the multi-band dual triply irreducible local expansion (D-TRILEX) approach to interacting electronic systems and discuss its numerical implementation. This method is designed for a self-consistent description of multi-orbital systems that can also have several atoms in the unit cell. The...

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Veröffentlicht in:arXiv.org 2022-07
Hauptverfasser: Vandelli, Matteo, Kaufmann, Josef, El-Nabulsi, Mohammed, Harkov, Viktor, Lichtenstein, Alexander I, Stepanov, Evgeny A
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Sprache:eng
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Zusammenfassung:We present the multi-band dual triply irreducible local expansion (D-TRILEX) approach to interacting electronic systems and discuss its numerical implementation. This method is designed for a self-consistent description of multi-orbital systems that can also have several atoms in the unit cell. The current implementation of the D-TRILEX approach is able to account for the frequency- and channel-dependent long-ranged electronic interactions. We show that our method is accurate when applied to small multi-band systems such as the Hubbard-Kanamori dimer. Calculations for the extended Hubbard, the two-orbital Hubbard-Kanamori, and the bilayer Hubbard models are also discussed.
ISSN:2331-8422
DOI:10.48550/arxiv.2204.06426