[Wien] lapw2 error

qianlijie84 qianlijie84 at 163.com
Tue May 19 08:22:50 CEST 2009


Dear Prof. Blaha:   I do something about the magntic films using WIEN2k_08. They are Co,Cu Co and Nio layers. The RMT setted automatically are 2.45,2.46.2.45.2.50.2.50 respectively.It is strange that both the RMT of Ni AND O are 2.50. Otherwise the same error always occour during the first SCF cycle.
  1)The following is the error information during running:
   STOP  LAPW1 END
 STOP
 STOP FERMIG
 STOP
in.tmp - No such file or directory
Cannot access .in.tmp: No such file or directory
Cannot access .in.tmp1: No such file or directory
>   stop error
 2)The following is the error information in case.dayfile:
  >   lapw2 -c  -p        (11:40:52) running LAPW2 in parallel mode
Abort (core dumped)
**  LAPW2 crashed!
0.7u 0.3s 0:04 26% 0+0k 74+7io 6pf+0w
error: command   /disk1/issp/ljqian/WIEN2k_08/lapw2cpara -c lapw2.def   failed

>   stop error
3) the following is the content of the error file
Error in LAPW2
**  testerror: Error in Parallel LAPW2
 I don't know what's the problem and how to deal with. Any suggestions will be appreciated.

 Best wishes!
  yours sincerely
ljqian
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