[Wien] (no subject)

Mansouri Tahar chmansouri94 at gmail.com
Mon Apr 22 10:56:07 CEST 2019


Dear all,

I am running optimization of the Fe-Si structure under a cubic symmetry.

After performing volume cell optimization I tried to calculated the
electronic properties especially the band structure. Unfortunately I have
got the following error message:

ERROR: incorrect classes

0.4u 0.0s 0:00.47 100.0% 0+0k 0+408io 0pf+0w

Please note that I have not included the magnetic properties of Fe in my
calculation.

Thank you for your help
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