Interpretation and Automatic Generation of Fermi-Orbital Descriptors. - Sebastian Schwalbe; Kai Trepte; Lenz Fiedler; Alex I. Johnson; Jakob Kraus; Torsten Hahn; Juan E. Peralta; Koblar A. Jackson; Jens Kortus (J. Comput. Chem., 2019)

Analytic atomic gradients in the fermi-löwdin orbital self-interaction correction. - Kai Trepte; Sebastian Schwalbe; Torsten Hahn; Jens Kortus; Der-You Kao; Yoh Yamamoto; Tunna Baruah; Rajendra R. Zope; Kushantha P. K. Withanage; Juan E. Peralta; Koblar A. Jackson (J. Comput. Chem., 2019)