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Electronic structure calculations with dynamical mean-field theory

Journal

REVIEWS OF MODERN PHYSICS
Volume 78, Issue 3, Pages 865-951

Publisher

AMER PHYSICAL SOC
DOI: 10.1103/RevModPhys.78.865

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A review of the basic ideas and techniques of the spectral density-functional theory is presented. This method is currently used for electronic structure calculations of strongly correlated materials where the one-electron description breaks down. The method is illustrated with several examples where interactions play a dominant role: systems near metal-insulator transitions, systems near volume collapse transitions, and systems with local moments.

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