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1.0
  • Part 1: CE construction
    • Structure enumeration
    • Random structure generation
    • Condition number selection of structures
    • Active learning
    • Orthogonal structure generation
    • Cutoff selection
    • Regression methods
    • Hyper-parameter scans
  • Part 2: Low-symmetry systems
  • Part 3: MC sampling
ce-tutorials
materialsmodeling.org

Part 1: CE constructionΒΆ

Structure generation and selection

  • Structure enumeration
  • Random structure generation
  • Condition number selection of structures
  • Active learning
  • Orthogonal structure generation

Linear regression

  • Cutoff selection
  • Regression methods
  • Hyper-parameter scans
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