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researcher

S. Lehtola

54 papers hereh-index 306.2k citations87 works total

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

author position
  • sole author16
  • first author12
  • middle author12
  • last author11

Across the 51 of 54 papers where every author was matched, so the position is known.

fields
  • physics.chem-ph24
  • physics.comp-ph22
  • cond-mat.mtrl-sci3
  • cond-mat.str-el3
  • physics.atom-ph2

identity via Semantic Scholar / OpenAlex

activity
20152026
most citedRecent developments in the PySCF program package

1.2k citations · 2.7k across the 53 of their papers we have counts for

collaborators
Showing 2021 · physics.comp-phShow all

1 paper · 2 filters

physics.comp-ph2021★ 13 cited

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

Kai Trepte, Sebastian Schwalbe, Simon Liebing +5

Fermi--Löwdin orbitals (FLO) are a special set of localized orbitals, which have become commonly used in combination with the Perdew--Zunger self-interaction correction (SIC) in th…

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Not affiliated with arXiv. Researcher data from Semantic Scholar (ODC-BY) and OpenAlex.