Module qsym2::bindings::python::representation_analysis

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Python bindings for QSym² symmetry analysis via representation and corepresentation theories.

See crate::drivers::representation_analysis for more information.

Modules§

  • density
    Python bindings for QSym² symmetry analysis of electron densities.
  • multideterminant
    Python bindings for QSym² symmetry analysis of Slater determinants.
  • slater_determinant
    Python bindings for QSym² symmetry analysis of Slater determinants.
  • vibrational_coordinate
    Python bindings for QSym² symmetry analysis of vibrational coordinates.

Enums§

  • PyArray1RC
    Python-exposed enumerated type to handle the union type of numpy float 1d-arrays and numpy complex 1d-arrays in Python.
  • PyArray2RC
    Python-exposed enumerated type to handle the union type of numpy float 2d-arrays and numpy complex 2d-arrays in Python.
  • PyArray4RC
    Python-exposed enumerated type to handle the union type of numpy float 4d-arrays and numpy complex 4d-arrays in Python.