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cluster:73 [2021/03/11 19:48]
hmeij07 [Intel]
cluster:73 [2021/04/12 19:17]
hmeij07 [LAMMPS CPU/GPU]
Line 18: Line 18:
 on either cottontail2 or node n33 located at /share/apps/CENTOS6 \\ on either cottontail2 or node n33 located at /share/apps/CENTOS6 \\
 Some compilations require 7.x and are in /share/apps/CENTOS7 \\ Some compilations require 7.x and are in /share/apps/CENTOS7 \\
 +
 +====== OpenHPC ======
 +
 +So I remember where I put the repos ''/share/apps/src/greentail52/openhpc''
 +
 +  * whitetail tar ball for centos7/warewulf (no slurm)
 +  * http://repos.openhpc.community/OpenHPC/2.0RC1/CentOS_8/x86_64/
 +  * http://repos.openhpc.community/ohpc-1.3/1.3.9/base/CentOS_7/x86_64/
 +  * https://github.com/warewulf/warewulf3 (master git zip file)
  
 ====== OneAPI ====== ====== OneAPI ======
Line 1327: Line 1336:
  
 ====== LAMMPS CPU/GPU ====== ====== LAMMPS CPU/GPU ======
 +
 +** USER_QUIP **
 +
 +This is a version of lammps (29Oct20, last stable) that contains all packages with user-quip.
 +
 +It does not compile with MPI, nor ifort in CentOS7, so there is only a "serial" version.
 +
 +  * Requires CentOS 7 so queues: mwgpu, amber128, exx96
 +
 +Read, if you wish  
 +
 +  * /share/apps/CENTOS7/lammps/QUIP-public.install 
 +  * /share/apps/CENTOS7/lammps/29Oct2020.install 
 +
 +Environments
 +
 +<code>
 +
 +# serial - cpu only (although quippy compiled, it refused to install)
 +
 +export PATH=/share/apps/CENTOS7/python/3.8.3/bin:$PATH
 +export LD_LIBRARY_PATH=/share/apps/CENTOS7/python/3.8.3/lib:$LD_LIBRARY_PATH
 +
 +# serial - cpu+gpu
 +
 +(to come, hopefully)
 +
 +</code>
  
 ** CPU only ** -Centos6 ** CPU only ** -Centos6
cluster/73.txt ยท Last modified: 2024/05/15 12:58 by hmeij07