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Programming: Using the Core LibrariesΒΆ

  • LibOptions: globals, locals, has_changed and all that
    • Declaring Options
    • What is has_changed ?
    • Reading Options in Module
    • Handling Options in Driver
  • Adding Methods to Driver
    • proc.py
    • Managed Methods
  • BasisSet
    • Advantages to New Scheme (aka Why)
    • How for Programmers
      • Orbital Basis
      • Auxiliary Basis
      • Adding Basis Option to Code
    • Deprecated Steps: Don’t do these anymore!

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LibOptions: globals, locals, has_changed and all that

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