Abstract
A density-functional theory (DFT) of lattice fermion models is presented, which uses the single-particle density matrix as basic variable. A simple, explicit approximation to the interaction-energy functional of the Hubbard model is derived from exact dimer results, scaling properties of and known limits. Systematic tests on the one-dimensional chain show a remarkable agreement with the Bethe-ansatz exact solution for all interaction regimes and band fillings. New results are obtained for the ground-state energy and charge-excitation gap in two dimensions. A successful description of strong electron correlations within DFT is achieved.
- Received 1 May 2002
DOI:https://doi.org/10.1103/PhysRevB.66.155118
©2002 American Physical Society