[Wien] Error in WIENNCM running in parallel mode

Gavin Abo gsabo at crimson.ua.edu
Fri Sep 8 06:17:34 CEST 2017


You might try checking the lapw2.error file. Does it show a problem with 
the case.energy_1 file like in the post at:

https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg07963.html

If you have that same error, it might be that lapw1 failed in generating 
the case.energy_1.  There are other files you may need to look for error 
messages in as mentioned before in the mailing list archive [ 
https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg15549.html 
].

On 9/7/2017 5:32 PM, Jianpeng Liu wrote:
> Dear Wien2k/Wienncm users and developers,
>
> I am learning to use wienncm to run some noncollinear-magnetism 
> calculations. I have compiled the code without any error report, and 
> the code runs well in serial mode. But if I run the same calculation 
> in parallel mode,  the calculation is always aborted at the lapw2 
> step, and  I got the following error:
>
> FERMI - Error
> cp: cannot stat `.in.tmp': No such file or directory
> rm: cannot remove `.in.tmp': No such file or directory
> rm: cannot remove `.in.tmp1': No such file or directory
>
> The following is the .machine file:
>
> granularity:1
> 1:node91
> 1:node91
> 1:node91
> 1:node91
> 1:node91
> 1:node91
> 1:node91
> 1:node91
> 1:node91
> 1:node91
> 1:node91
> 1:node91
>
> I would appreciate your help.
>
> Best,
> Jianpeng
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