Author

S. A. Artiukova

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Preprint Sep 2026

Pseudo-hybrid density functional ACBN0 for Hubbard $U$ correction in a numeric atom-centered orbital basis

We present a formulation and implementation of the Agapito-Curtarolo-Buongiorno Nardelli (ACBN0) pseudo-hybrid density functional in a numeric atom-centered orbital basis. The method is realized in the all-electron, full-potential electronic-structure package FHI-aims. The implementation uses a L\"owdin-orthogonalized...

S. A. Artiukova, Ilia M. Odud, S. Levchenko · 0 citations