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cond-mat.str-el2017
Fermionic statistics in the strongly correlated limit of Density Functional Theory
Juri Grossi, Derk P. Kooi, Klaas J. H. Giesbertz +4
Exact pieces of information on the adiabatic connection integrand , which allows to evaluate the exchange-correlation energy of Kohn-Sham density functional theory, can be…
cond-mat.str-el2008★ 252 cited
The discontinuous nature of the exchange-correlation functional -- critical for strongly correlated systems
Paula Mori-Sanchez, Aron J. Cohen, Weitao Yang
Standard approximations for the exchange-correlation functional have been found to give big errors for the linearity condition of fractional charges, leading to delocalization erro…