running:main
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running:main [2018/09/23 18:52] – ↷ Page moved and renamed from usage to running:main daniel | running:main [2018/09/23 18:52] (current) – ↷ Links adapted because of a move operation daniel | ||
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- | The name of the //potfit// binary depends on the selected potential model and interaction. The parameter file contains all further [[parameters]] describing the optimization. | + | The name of the //potfit// binary depends on the selected potential model and interaction. The parameter file contains all further [[:parameters]] describing the optimization. |
=== Parallel execution | === Parallel execution | ||
- | //potfit// supports [[MPI|MPI parallelization]]. If MPI is enabled, the number of MPI processes must be stated at the program start. This is usually done with a (system dependent) startup script like the following one: | + | //potfit// supports [[running:mpi|MPI parallelization]]. If MPI is enabled, the number of MPI processes must be stated at the program start. This is usually done with a (system dependent) startup script like the following one: |
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running/main.1537721540.txt.gz · Last modified: 2018/09/23 18:52 by daniel