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Getting Started

  • Installation
  • Quick Start with MiniHF

Theory & Tutorials

  • Molecular Integrals in MiniHF
  • Hartree-Fock Method

API Reference

  • minihf
    • minihf package
      • Subpackages
        • minihf.basis package
        • minihf.hamiltonian package
        • minihf.molecule package
        • minihf.scf package
      • Module contents
minihf
  • minihf
  • minihf package
  • minihf.hamiltonian package
  • View page source

minihf.hamiltonian package

Subpackages

  • minihf.hamiltonian.integral package
    • Submodules
      • minihf.hamiltonian.integral.boys module
        • boys()
        • boys_recursion()
      • minihf.hamiltonian.integral.electron_repulsion module
        • ElectronRepulsion
      • minihf.hamiltonian.integral.kinetic module
        • Kinetic
      • minihf.hamiltonian.integral.nuclear_attraction module
        • NuclearAttraction
      • minihf.hamiltonian.integral.overlap module
        • Overlap
    • Module contents

Submodules

  • minihf.hamiltonian.auxiliary module
    • eint()
  • minihf.hamiltonian.hamiltonian module
    • Hamiltonian
      • Hamiltonian.__init__()
      • Hamiltonian.assign_operators()
      • Hamiltonian.ClassMethods()
      • Hamiltonian.build()
      • Hamiltonian.build()
      • Hamiltonian.build_overlap()
      • Hamiltonian.build_kinetic()
      • Hamiltonian.build_nuclear_attraction()
      • Hamiltonian.build_electron_repulsion()

Module contents

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