dqc
latest

Getting started

  • Installation
  • How to contribute
  • Tutorials

Modules

  • Systems (dqc)
  • QCCalc (dqc)
    • HF: Hartree-Fock
    • KS: Kohn-Sham
  • Other APIs (dqc)

Submodules

  • Hamilton (dqc.hamilton)
  • XC (dqc.xc)
  • Utilities (dqc.utils)

Release notes

  • Release notes
dqc
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  • QCCalc (dqc)
  • Edit on GitHub

QCCalc (dqc)ΒΆ

  • HF: Hartree-Fock
  • KS: Kohn-Sham
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