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Structures and properties of lanthanide and actinide complexes by a new density functional approach: Lanthanum, gadolinium, lutetium, and thorium halides as case studies.

Carlo AdamoVincenzo Barone
Published in: J. Comput. Chem. (2000)
Keyphrases
  • case study
  • functional properties
  • lessons learned
  • real world
  • structural properties
  • computer vision
  • data structure
  • open source
  • literature review
  • low density