exercises:2020_uzh_acpc2:installation
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exercises:2020_uzh_acpc2:installation [2020/04/07 08:11] – [Module loading] jglan | exercises:2020_uzh_acpc2:installation [2020/04/07 09:22] – jglan | ||
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- | Now, make a new directory, for instance called '' | + | Now, make a new directory, for instance called '' |
+ | |||
+ | To download the file and extract the zip: | ||
+ | < | ||
+ | wget https:// | ||
+ | |||
+ | mv exercises: | ||
+ | |||
+ | unzip argon.zip | ||
+ | |||
+ | </ | ||
< | < | ||
cp2k.popt -i argon.inp -o out_ex0.out | cp2k.popt -i argon.inp -o out_ex0.out | ||
</ | </ | ||
- | To run cp2k with MPI | + | To run cp2k with MPI, for instance with 2 CPU, one can use |
< | < | ||
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.txt · Last modified: 2020/08/21 10:15 by 127.0.0.1