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arxiv: cond-mat/0207429 · v1 · submitted 2002-07-17 · ❄️ cond-mat.str-el

Density-Matrix functional theory of strongly-correlated lattice fermions

classification ❄️ cond-mat.str-el
keywords functionalgammadensityexactlatticeresultstheoryachieved
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A density functional theory (DFT) of lattice fermion models is presented, which uses the single-particle density matrix gamma_{ij} as basic variable. A simple, explicit approximation to the interaction-energy functional W[gamma] of the Hubbard model is derived from exact dimer results, scaling properties of W[gamma] and known limits. Systematic tests on the one-dimensional chain show a remarkable agreement with theBethe-Ansatz exact solution for all interaction regimes and band fillings. New results are obtained for the ground-state energyand charge-excitation gap in two dimensions. A successful description of strong electron correlations within DFT is achieved.

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