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ChemEnv: a fast and robust coordination environment identification tool

David Waroquiers1, Janine George1, Matthew Horton2

  • 1Institute of Condensed Matter and Nanosciences, Université catholique de Louvain, Chemin des Étoiles 8, 1348 Louvain-la-Neuve, Belgium.

Acta Crystallographica Section B, Structural Science, Crystal Engineering and Materials
|August 25, 2020
PubMed

Keywords:
Voronoïcontinuous symmetry measurecoordination environmentcoordination number

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