embands
Full name: ase2sprkkr.asr.emasses.embands
- ase2sprkkr.asr.emasses.embands(gpw, soc, bandtype, delta=0.1)[source]
Effective masses for bands within delta of extrema.
- Parameters:
gpw (str) – name of gpw filename
soc (bool) – include spin-orbit coupling
bandtype ('vb' or 'cb') – type of band
efermi (float, optional) – fermi level (takes it from gpw if None)
delta (float, optional) – bands within this value (in eV) is included in the em fit default is 0.1 eV