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Density-functional theory on a lattice: Comparison with exact numerical results for a model with strongly correlated electrons

by: K. Schönhammer, O. Gunnarsson, R. M. Noack
Physical Review B, Vol. 52, No. 4. (15 Jul 1995), pp. 2504-2510, doi:10.1103/physrevb.52.2504  Key: citeulike:3453424

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Abstract

Most of the basic ideas of the density-functional theory (DFT) are shown to be unrelated to the fact that the particle density is used as the basic variable. After presenting the general formalism and a simple example unrelated to densities, we discuss various approaches to density-functional theory on a lattice. One has proven useful for the understanding of various fundamental issues of the DFT. The exact Kohn-Sham band gap and the band gap in the local-density approximation (LDA) are compared to the exact results for a one-dimensional model. As the interacting homogeneous system can be solved exactly no further approximation is needed to formulate the LDA.


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