The memory RAM in use of the machines does not decrease when we kill the processes of Wien2k on the CPU Ans suggestions please ? Le 17 juin 2014 22:10, "Gavin Abo" <[email protected]> a écrit :
> > what about the environment in which we must mention the list of > machines that will run parallel computing? > > > If you are using a single PC, you should be able to use "edit .machines" > in the menu of w2web. See section "5.5.4 The .machines file" in the Wien2k > 13.1 usersguide [http://www.wien2k.at/reg_user/textbooks/usersguide.pdf], > which describes the content of the .machines file. > > I also find the University of Texas slides at the following link useful: > > https://www.xsede.org/documents/10157/305826/ecss_hliu_051012.pdf > > If you are using a cluster, you should talk to your system administer(s), > because they should know everything about your cluster system and should be > able to help you create the best configuration for your system (something > we know nothing about it). There is a webpage in FAQ on the Wien2k website > that can help with that: > > http://www.wien2k.at/reg_user/faq/pbs.html > > I also want to know the parameters for multi threading > > > I think there was some previous discussion on threading. Search the mail > archive at: > > http://www.mail-archive.com/[email protected]/ > > For example, try searching with the keyword: OMP_NUM_THREADS > > > > _______________________________________________ > Wien mailing list > [email protected] > http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien > SEARCH the MAILING-LIST at: > http://www.mail-archive.com/[email protected]/index.html > >
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