158 citations · 614 across the 19 of their papers we have counts for
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physics.chem-ph2014★ 75 cited
A self-interaction-free local hybrid functional: Accurate binding energies vis-à-vis accurate ionization potentials from Kohn-Sham eigenvalues
Tobias Schmidt, Eli Kraisler, Adi Makmal +2
We present and test a new approximation for the exchange-correlation (xc) energy of Kohn-Sham density functional theory. It combines exact exchange with a compatible non-local corr…
physics.atom-ph2014★ 11 cited
Higher Ionization Energies of Atoms in Density Functional Theory
Uri Argaman, Guy Makov, Eli Kraisler
Density functional theory (DFT) is an exact alternative formulation of quantum mechanics, in which it is possible to calculate the total energy, the spin and the charge density of…