[Wien] mBJ conflicts with SO?
bruce.tian
brucetian8080 at gmail.com
Tue Feb 14 05:05:06 CET 2012
Dear Prof. Blaha:
First I did mBJ calculation there are no errors. Then I did SO calculation
and I got the error:
hup: Command not found.
LAPW0 END
0 LAPW0-Error. Check file lapw0.error and case.output0*.
LAPW0 - Error. Check file lapw0.error.
> stop error
The lapw0.error is as following:
Error in LAPW0
'LAPW0' - case.grr file not present, which is requred for mBJ
When I open case.grr I found there is only a line of stars. At the
position after mBJ calculation and before SO calculation there is a
number. For GGA+SO calculation there are also
no errors reported. What is the problem.
Thanks!
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