PseudoPotentialIO.jl
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File formats

Here are some links to documentation and other parsers for various pseudopotential file formats:

  • UPF
    • QuantumESPRESSO website
    • CECAM website
    • upf-schema on GitHub
    • upf_to_json on GitHub
    • QuantumESPRESSO read_upf_new.f90 on GitHub
    • ABINIT m_upf2abinit.F90 on GitHub
    • Abacus read_pp_upf201.cpp on GitHub
    • GPAW upf.py on GitLab
  • PSP8
    • ABINIT documentation
    • ABINIT m_psp8.F90 on GitHub
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