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Kai Trepte

3PUBLICATIONS

18CO-AUTHORS

Theoretical quantum chemistry

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Publications (3)

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|Dec 16, 2021

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

Kai Trepte, Sebastian Schwalbe, Simon Liebing

|Sep 03, 2020

PyFLOSIC: Python-based Fermi-Löwdin orbital self-interaction correction.

Sebastian Schwalbe, Lenz Fiedler, Jakob Kraus

|May 10, 2019

Stretched or noded orbital densities and self-interaction correction in density functional theory.

Chandra Shahi, Puskar Bhattarai, Kamal Wagle

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Frequent Collaborators

3 joint publications

Sebastian Schwalbe

3 joint publications

Jens Kortus

3 joint publications

Susi Lehtola

2 joint publications

Hemanadhan Myneni

1 joint publications

Puskar Bhattarai

1 joint publications

Kamal Wagle

1 joint publications

Biswajit Santra

1 joint publications

Torsten Hahn

1 joint publications

Koblar A Jackson

1 joint publications

Juan E Peralta

Frequent Collaborators

3 joint publications

Sebastian Schwalbe

3 joint publications

Jens Kortus

3 joint publications

Susi Lehtola

2 joint publications

Hemanadhan Myneni

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