Jens Kortus

Publication Activity (10 Years)

Years Active: 2013-2023
Publications (10 Years): 5

Top Topics

Graphical User Interface

Theoretical Investigation

Top Venues

J. Comput. Chem.

Comput. Phys. Commun.

Publications

Simon Brehm, Cameliu Himcinschi, Jakob Kraus, Jens Kortus
PyRamanGUI: Open-source graphical user interface for analyzing Raman spectra. SoftwareX 23 (2023)
Jakob Kraus, Jens Kortus
A theoretical investigation into gallic acid pyrolysis. J. Comput. Chem. 43 (15) (2022)
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
Analytic atomic gradients in the fermi-löwdin orbital self-interaction correction. J. Comput. Chem. 40 (6) (2019)
Sebastian Schwalbe, Kai Trepte, Lenz Fiedler, Alex I. Johnson, Jakob Kraus, Torsten Hahn, Juan E. Peralta, Koblar A. Jackson, Jens Kortus
Interpretation and Automatic Generation of Fermi-Orbital Descriptors. J. Comput. Chem. 40 (32) (2019)
Sebastian Schwalbe, Torsten Hahn, Simon Liebing, Kai Trepte, Jens Kortus
Fermi-Löwdin orbital self-interaction corrected density functional theory: Ionization potentials and enthalpies of formation. J. Comput. Chem. 39 (29) (2018)
Silvia Bahmann, Jens Kortus
EVO - Evolutionary algorithm for crystal structure prediction. Comput. Phys. Commun. 184 (6) (2013)