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A program to generate a basis set adaptive radial quadrature grid for density functional theory.

Khatuna KakhianiKakha TsereteliPaata Tsereteli
Published in: Comput. Phys. Commun. (2009)
Keyphrases
  • neural network
  • data mining
  • machine learning
  • probability distribution
  • small number
  • user defined
  • set theory