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20172026
most citedStretched or noded orbital densities and self-interaction correction in density functional theory

69 citations · 82 across the 7 of their papers we have counts for

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physics.comp-ph2021★ 13 cited

Chemical bonding theories as guides for self-interaction corrected solutions: multiple local minima and symmetry breaking

Kai Trepte, Sebastian Schwalbe, Simon Liebing +5

Fermi--Löwdin orbitals (FLO) are a special set of localized orbitals, which have become commonly used in combination with the Perdew--Zunger self-interaction correction (SIC) in th…