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<P><FONT SIZE=2>Dear all,<BR>
<BR>
I have already emailed you about uspp generation,and the initial input I had was describing the electron occupation like it should.<BR>
<BR>
However, I get this error message :<BR>
<BR>
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%<BR>
from ld1_setup : error # 1<BR>
mismatched all-electron/pseudo occupations<BR>
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%<BR>
<BR>
This suggests me that the occupations I wrote in the input are incorrect. Like I said, they are supposed to be correct the way I described them.<BR>
<BR>
Could you tell me how I can create a pseudo with the occupations I want? Shall I change lines in ld1_setup.f90?<BR>
<BR>
I attached once again the input.<BR>
<BR>
Thank you,<BR>
<BR>
Parwana,<BR>
Ph.D student,<BR>
CEA-Saclay,<BR>
DSM/IRAMIS/SPCSI<BR>
<BR>
PS : the rel_dist tag is not supposed to be the problem...I get the same error with and without the tag.<BR>
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