Quantum ESPRESSO: Difference between revisions

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srun pw.x < si.scf.in > si.scf.out  
srun pw.x < si.scf.in > si.scf.out  
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The above example requests two whole nodes for a total of 64 single-threaded processes. This is certainly more processors than is needed for the silicon tutorial case. Please be aware that suitable selection of a process count is complicated, but it is your responsibility to choose an efficient number.
The above example requests 32 processes, which is more than needed for the silicon tutorial case. Please be aware that suitable selection of a process count is complicated, but it is your responsibility to choose an efficient number.  See also [[Advanced MPI scheduling]].


= Segfaults with OpenMPI 3.1.2 = <!--T:9-->
= Segfaults with OpenMPI 3.1.2 = <!--T:9-->
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