Band¶

class py4vasp.raw.Band(dispersion: ~py4vasp._raw.data.Dispersion, fermi_energy: float, occupations: ~py4vasp._raw.data_wrapper.VaspData, projectors: ~py4vasp._raw.data.Projector, projections: ~py4vasp._raw.data_wrapper.VaspData = <factory>)¶

Bases: object

A band structure generated by VASP.

Contains the eigenvalues at specifics k points in the Brillouin zone. Carefully consider before using the absolute eigenvalues for analysis. Typically only relative eigenvalues e.g. with respect to the Fermi energy are meaningful. Includes projections of the bands on orbitals and atoms when available.