pymatgen.analysis.xas.spectrum module

class XANES(x, y, structure, absorption_specie, edge)

Bases: pymatgen.core.spectrum.Spectrum

Basic XANES object.

Parameters

• x – A sequence of x-ray energies in eV

• y – A sequence of mu(E)

• structure (Structure) – Structure associated with the XANES.

• absorption_specie (Specie) – Specie associated with the XANES.

• edge (str) –

XLABEL = 'Energy'

YLABEL = 'Intensity'