[Wien] Running k-point parallel:Changs in .machines file

Ghosh SUDDHASATTWA ssghosh at igcar.gov.in
Thu Apr 22 15:48:52 CEST 2010


Dear Wien2k users, 

I am working on a node "nx80" with 8 processors with 1080 k-points

So I made the following changes in the .machines file 

 

Granularity=1 

1:nx80:1

Residue:nx80:1

 

When I submitted the job in the command line with 

Run_lapw -cc 0.0001 -ec 0.00005 -p

 

It gave an error 

Lapw crashed 

Can anybody tell me what exactly we have to change in the .machines file. 

 

Any suggestions would be of great help 

 

S Ghosh 

 

 

 

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