DFT API Reference ================= This page documents callable interfaces in :mod:`dp5.dft` and links to the RST-style docstrings added to the implementation. Dispatcher Functions -------------------- .. automodule:: dp5.dft.run_dft :members: :undoc-members: Base Class ---------- .. automodule:: dp5.dft.base_dft_method :members: :undoc-members: Concrete Backends ----------------- Gaussian ^^^^^^^^ .. automodule:: dp5.dft.gaussian :members: :undoc-members: NWChem ^^^^^^ .. automodule:: dp5.dft.nwchem :members: :undoc-members: ORCA ^^^^ .. automodule:: dp5.dft.orca :members: :undoc-members: