[Wien] System hang during parallel calculation
    Ashish Sharma 
    ashishsharma1092016 at gmail.com
       
    Mon Oct 10 08:04:30 CEST 2016
    
    
  
Hi,
Respected Wien2k Users,
I have a system hang (freeze) problem during the parallel calculations.
   I am running WIEN2k_14.2 on a Intel Xeon workstation with dual cpu , 32
   cores  with ubuntu 15 and intel parallel studio Xe 2016 with fftw3
   install.  These steps are taken during the calculations
   1-     firstly i have set  export OMP_NUM_THREADS = 32
   2-     Secondly i have used
       export OMP_NUM_THREADS = 16
and also i try
           export OMP_NUM_THREADS = 1
In all cases my system become hang (freeze) after 10-11 minutes. My
calculations was for 64 atoms of different structures.
During the installation  of WIEN2k_14.2 all program compile was without any
error.
Thanks,
Best Regards,
Ashish Sharma
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20161009/743265fd/attachment.html>
    
    
More information about the Wien
mailing list