[Wien] Spin polarised optical calculation with spin orbit

[Chukwuemeka Okoye]

Dear Wien users,

I am calculating optical properties including spin polarization and spin-orbit using about 10,000k-points in the IBZ using Wien2k_04. I have followed the procedure in the UG. I successfully executed 
 
x optic -c -up -so
 
However the file *.outmatup did not give expected values. 
This has made it impossible for me to go to the next stage.

I have attached a few lines of the *.outmatup file.


Please , I am looking forward to your kind assistance

C M I Okoye



        
     3  Re <x><x>    Re <z><z>    Re <x><y>
   KP:     1 NEMIN NEMAX :     1   40 dE:-5.00 2.20 K:         1
      1   1???????????????????????????????????????
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      1  10???????????????????????????????????????
      1  11???????????????????????????????????????
      1  12???????????????????????????????????????
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      1  14???????????????????????????????????????
      1  15???????????????????????????????????????
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      1  17???????????????????????????????????????
      1  18???????????????????????????????????????
      1  19???????????????????????????????????????
      1  20????????????
 






Chukwuemeka M. I. Okoye,

Department of Physics and Astronomy,

University of Nigeria,Nsukka,

Enugu State,NIGERIA

234-042-771611
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