[Wien] Problem with k-point parallel

Peter Blaha pblaha at theochem.tuwien.ac.at
Sat Aug 5 09:02:58 CEST 2006


Difficult to say without more info. Maybe you tcsh version is buggy!

> Dear Wien Users,
> 
> I'm using k-point parallelization. Lapw0 and lapw1 may be OK, since the
> lapw0.error and lapw1_X.error are all empty. However, after lapw1, the
> execution halts, lapw2 doesn't start, and the execution is finally
> terminated by pbs. The attachment is the dayfile and the pbs output. Does
> anyone have an idea about this problem?
> 
> Thanks a lot.
> 
> Xu Zuo
> Professor of Electrical Engineering
> College of Information Technical Science
> Nankai University
> 94 Weijin Rd., Tianjin 300071, P. R. China
> Tel: +86-22-2349-4893
> FAX: +86-22-2350-8234
> Email: xzuo at nankai.edu.cn
> 
> 


                                      P.Blaha
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Phone: +43-1-58801-15671             FAX: +43-1-58801-15698
Email: blaha at theochem.tuwien.ac.at    WWW: http://info.tuwien.ac.at/theochem/
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