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Contents:

  • Installation
  • Basis functions
  • Integral evaluation
  • Basis sets and molecules
  • Electronic structure calculations
  • Molecular Orbital Diagrams
  • Orbital visualization
  • Orbital localization: Foster-Boys
  • Matrix visualization
  • Geometry optimization
  • Population Analysis
  • Symmetry-adapted basis sets
  • Integral evaluation acceleration routines
  • Integrator object
  • Gallery
  • Community guidelines
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