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Pseudospectral implementations of long-range corrected density functional theory.

Yixiang X. CaoMathew D. HallsTati Reddy VadicherlaRichard A. Friesner
Published in: J. Comput. Chem. (2021)
Keyphrases
  • long range
  • short range
  • conditional random fields
  • long range correlations
  • long range interactions
  • neural network
  • computational models