[Wien] SOC Error

[Laurence Marks]

You first need to check the error logs using "cat *.error", and check your
*.daytime, :log and other output files. Without additional information
nobody can help.

_____
Professor Laurence Marks
"Research is to see what everybody else has seen, and to think what nobody
else has thought", Albert Szent-Gyorgi
www.numis.northwestern.edu

On Wed, Oct 2, 2019, 08:27 Paresh Rout <paresh.rout at kaust.edu.sa> wrote:

>
> Dear all,
> I am doing SOC calculation in wien2k_17. I am getting some error in
> between SCF calculation (around 9th or 10th cycle) as below.
>
> >   lapw2 -up -p   -c -so       (13:21:14) running LAPW2 in parallel mode
> **  LAPW2 crashed!
> 0.100u 0.064s 0:03.96 4.0%      0+0k 422+352io 8pf+0w
> error: command
> /sw/xc40cle6/wien2k/17.1/cle6.05_intel18.0.1.163/wien2k-17.1/lapw2cpara -up
> -c -so uplapw2.def   failed
>
> >   stop error
>
>  Could you please help me out with this?
>
> Best regards,
> Paresh
>
>
>
> Paresh Chandra Rout
> Postdoctoral Researcher
> King Abdullah University of Science and Technology (KAUST)
> Thuwal 23955-6900
> Kingdom of Saudi Arabia
> Mobile: +966 565671754
> Email address: paresh.rout at kaust.edu.sa
> 3231-WS13
>
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