[Wien] k point parallel mode
L-marks at northwestern.edu
Fri Dec 30 11:50:19 CET 2011
To "make" the file, you use an editor (nothing more or less) and put
the file in the directory where you are running the job. I have not
looked, but there is probably something in w2web to do this.
N.B., the code does not use OMP anywhere (at present) so this will not
2011/12/30 susanta mohanta <susanta.phy at gmail.com>:
> Dear Prof. Blaha and Wien2k Users,
> I am running wien2k on a intel i7 PC (6core 12 Processors) with
> Fedora linux.
> The program is using maximum six processors at a time. I think, I have to do
> k point
> parallel configuration to use all the processors for a single program. I
> have tried with
> OMP_NUM_THREADS (1 to 12), it did not work. Any suggestion how to make
> (though example is there but where to make) file
> and which files needs to be edited (or created) for k point parallel mode
> will be helpful. I have
> gone through the user guide and checked in the mailing list, but could not
> find thing that could
> help me.
> Wish you all a very happy new year in advance.
> with sincere regards
> Wien mailing list
> Wien at zeus.theochem.tuwien.ac.at
Professor Laurence Marks
Department of Materials Science and Engineering
"Research is to see what everybody else has seen, and to think what
nobody else has thought"
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