Module representation_analysis

Source
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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.