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Optimization of density fitting auxiliary Slater-type basis functions for time-dependent density functional theory.

Marco MedvesGiovanna FronzoniMauro Stener
Published in: J. Comput. Chem. (2022)
Keyphrases
  • basis functions
  • linear combination
  • b spline
  • radial basis function
  • state space
  • feature vectors
  • least squares
  • zernike moments
  • linear approximation
  • multiresolution
  • decision theory
  • wavelet bases
  • signal reconstruction