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- W2098085286 abstract "Gradient-dependent approximations to the functional of the kinetic energy of non-interacting electrons (Ts[ρ]), which reflect various properties of the exact functional, are considered. For specially constructed pairs of electron densities, for which the analytic expression for the differences of Ts[ρ] is known, it is shown that the accuracy of the quantities derivable from a given approximation to Ts[ρ]: energy differences and their functional derivatives, does not reflect that of Ts[ρ] itself. The comparisons between the exact values of the kinetic energy in such cases are proposed as an independent condition/criterion for appraisal of approximations to Ts[ρ]." @default.
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- W2098085286 date "2008-01-23" @default.
- W2098085286 modified "2023-10-18" @default.
- W2098085286 title "The energy-differences based exact criterion for testing approximations to the functional for the kinetic energy of non-interacting electrons" @default.
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- W2098085286 doi "https://doi.org/10.1088/1751-8113/41/5/055302" @default.
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