pymatgen.analysis.xas.spectrum module

class XANES(x, y, structure, absorption_specie, edge)[source]

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'