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D4FT: A Deep Learning Approach to Kohn-Sham Density Functional Theory.

Tianbo LiMin LinZheyuan HuKunhao ZhengGiovanni VignaleKenji KawaguchiA. H. Castro NetoKostya S. NovoselovShuicheng Yan
Published in: CoRR (2023)
Keyphrases
  • deep learning
  • unsupervised learning
  • machine learning
  • unsupervised feature learning
  • mental models
  • deep architectures
  • data mining
  • pattern recognition
  • supervised learning
  • generative model