unfold#

ElectronicBandStructure.unfold(transformation_matrix=None, structure=None)[source]#

The method helps unfold the bands. This is done by using the unfolder to find the new kpoint weights. The current weights are then updated

Parameters:

  • transformation_matrix (np.ndarray, optional) – The transformation matrix to transform the basis. Expected size is (3,3), by default None

  • structure (pyprocar.core.Structure, optional) – The structure of a material, by default None

Returns:

None – None