Fermionic Statistics in the Strongly Correlated Limit of Density Functional Theory

  title={Fermionic Statistics in the Strongly Correlated Limit of Density Functional Theory},
  author={Juri Grossi and Derk P. Kooi and Klaas J. H. Giesbertz and Michael Seidl and Aron J. Cohen and Paula Mori-S{\'a}nchez and Paola Gori-Giorgi},
  journal={Journal of Chemical Theory and Computation},
  pages={6089 - 6100}
Exact pieces of information on the adiabatic connection integrand, Wλ[ρ], which allows evaluation of the exchange-correlation energy of Kohn–Sham density functional theory, can be extracted from the leading terms in the strong coupling limit (λ → ∞, where λ is the strength of the electron–electron interaction). In this work, we first compare the theoretical prediction for the two leading terms in the strong coupling limit with data obtained via numerical implementation of the exact Levy… 

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