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Contents:

  • Installing Chemist
  • Chemist Background
  • Developer Documentation
    • Design Documentation
      • Architecture of Chemist
      • Design of the Point Component
        • Designing the Point Component
      • Design of the Chemical System Component
      • Design of the AO Basis Set Component
      • Design of the Basis Set Component
      • Design of the Topology Component
      • Design of the Fragmenting Component
      • Design of the Quantum Mechanics (QM) Component
      • DSL Component
    • Developing the Chemical System Component
    • Creating a New View
    • Understanding the Traits Component
    • Notes on Adding an Operator
    • Exposing Operators to Python
    • NWChemEx author documentation
  • Chemist Tutorials
  • C++ API
Chemist
  • Developer Documentation
  • Design Documentation
  • Design of the Point Component
  • View page source

Design of the Point Component

  • Designing the Point Component
    • What is the Point Component?
    • Why do we need a separate type?
    • Point Considerations
    • Point Design
    • Summary
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