[Wien] Error in SO

Hong Jiang jiangh99 at googlemail.com
Wed Apr 9 08:25:55 CEST 2014


Did you run "initso_lapw" following the instruction given by the 
users-guide before you started your calculations?



? 2014/4/9 14:14, ??? ??:
> Dear WIEN2k,
>     I did the SO in my calculation, but there is an error :
>   Calculating CoS2 in /home/llh1/WIEN2k/CoS2
> on localhost.localdomain with PID 24045
> using WIEN2k_11.1 (Release 14/6/2011) in /home/llh1/wien
>
>
>      start 	(Wed Apr  9 10:39:34 CST 2014) with lapw0 (40/99 to go)
>
>      cycle 1 	(Wed Apr  9 10:39:34 CST 2014) 	(40/99 to go)
>
> >   lapw0 	(10:39:34) 5.611u 0.101s 0:06.71 85.0%	0+0k 0+0io 0pf+0w
> >   lapw1  -up   	(10:39:41) 4040.031u 48.070s 1:30:32.12 75.2%	0+0k 0+0io 0pf+0w
> >   lapw1  -dn   	(12:10:13) 3980.955u 48.090s 1:34:28.69 71.0%	0+0k 0+0io 0pf+0w
> >   lapwso -up  	(13:44:42) 0.132u 0.016s 0:00.36 38.8%	0+0k 0+0io 15pf+0w
> error: command   /home/llh1/wien/lapwso lapwso.def   failed
>
> >   stop error
>
> But the error files is empty.I do not know what is wrong. Please give 
> me some hits. Thank you.
>
>
> _______________________________________________
> Wien mailing list
> Wien at zeus.theochem.tuwien.ac.at
> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
> SEARCH the MAILING-LIST at:  http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html

-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20140409/4dbf8008/attachment.htm>


More information about the Wien mailing list