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researcher

K. Trepte

11 papers hereh-index 14681 citations38 works total

Matching runs newest-first, so older work may not be attached to this profile yet.

author position
  • first author2
  • middle author9

Across the 11 of 11 papers where every author was matched, so the position is known.

fields
  • physics.comp-ph6
  • physics.chem-ph4
  • cond-mat.mes-hall1

identity via Semantic Scholar / OpenAlex

activity
20142024
most citedStretched or noded orbital densities and self-interaction correction in density functional theory

69 citations · 157 across the 11 of their papers we have counts for

collaborators
Showing 2019 · physics.comp-phShow all

1 paper · 2 filters

physics.comp-ph2019★ 23 cited

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

Sebastian Schwalbe, Lenz Fiedler, Jakob Kraus +3

We present PyFLOSIC, an open-source, general-purpose Python implementation of the Fermi-Löwdin orbital self-interaction correction (FLO-SIC), which is based on the Python simulatio…

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