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exercises:2020_uzh_acpc2:installation

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exercises:2020_uzh_acpc2:installation [2020/04/07 08:17] – [Module loading] jglanexercises:2020_uzh_acpc2:installation [2020/08/21 10:15] (current) – external edit 127.0.0.1
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 Now, make a new directory, for instance called ''exercise0''. Download and extract the file {{ :exercises:2019_uzh_acpc2:argon.zip |argon.inp}} into this directory and run cp2k by typing Now, make a new directory, for instance called ''exercise0''. Download and extract the file {{ :exercises:2019_uzh_acpc2:argon.zip |argon.inp}} into this directory and run cp2k by typing
 +
 +To download the file and extract the zip:
 +<code>
 +wget https://www.cp2k.org/_media/exercises:2019_uzh_acpc2:argon.zip
 +
 +mv exercises:2019_uzh_acpc2:argon.zip argon.zip
 +
 +unzip argon.zip
 +
 +</code>
 +
 <code> <code>
 cp2k.popt -i argon.inp -o out_ex0.out cp2k.popt -i argon.inp -o out_ex0.out
 </code> </code>
  
-To run cp2k with MPI+To run cp2k with MPI, for instance with 2 CPU, one can use
 <code> <code>
 mpirun -n 2 cp2k.popt -i argon.inp -o out_ex0.out mpirun -n 2 cp2k.popt -i argon.inp -o out_ex0.out
exercises/2020_uzh_acpc2/installation.1586247422.txt.gz · Last modified: 2020/08/21 10:15 (external edit)