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From: | Stefan Kesselheim |
Subject: | Re: [ESPResSo-users] running on cluster |
Date: | Wed, 27 Nov 2013 10:59:28 +0100 |
User-agent: | Mozilla/5.0 (X11; Linux x86_64; rv:24.0) Gecko/20100101 Thunderbird/24.1.0 |
Dear guozhicheng222,
On 11/27/2013 06:55 AM, guozhicheng222 wrote: On our cluster(s), we need to load these things (at least fftw) by using module load numlib/fftw/3.3.2-openmpi-1.4.3-gnu-4.5 It is important that you choose the right combination of compiler, fftw and mpi. On some cluster you can log into the subordinate nodes by qsub -I, and then you can look araound where the libraries are. But you should know that this is standard Unix/Cluster stuff, but the Espresso mailing list likes to answer questions about Espresso. Regards Stefan |
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