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- W2270494104 abstract "Two electrons at the threshold of ionization represent a severe test case for electronic structure theory. A pseudospectral method yields a very accurate density of the two-electron ion with nuclear charge close to the critical value. Highly accurate energy components and potentials of Kohn-Sham density functional theory are given, as well as a useful parametrization of the critical density. The challenges for density functional approximations and the strength of correlation are also discussed." @default.
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- W2270494104 date "2014-08-09" @default.
- W2270494104 modified "2023-09-27" @default.
- W2270494104 title "Quantum critical benchmark for density functional theory" @default.
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