[ase-users] CaF2 Bandstructure Plot

Christoph Bernkopf christoph.bernkopf at cern.ch
Tue Jul 24 12:24:43 CEST 2018


Hi All,

I’m currently using a CaF2 model to calculate the band structure (python code attached). My output is attached also (caf2_bandstructure.png). It looks wrong to me as the output usually has 4-5 entries on the X axis (attached example: bandstructure_si.png). Also the labels are missing in my graphic. Does anybody know what I’m doing wrong here?

Cheers and thanks for the help,
Chris



[cid:01acc745-52a4-430a-b2da-c292dd34434c at cern.ch]
[cid:c9cece00-bd46-49fb-9acb-cb2af9c107db at cern.ch]
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