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CPMD: Difference between revisions
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You can use it now as usual in your submission script. | You can use it now as usual in your submission script. | ||
=Example of job script = <!--T:19--> | =Example of a job script = <!--T:19--> | ||
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It is also possible to put the pseudo-potentials in another directory | It is also possible to put the pseudo-potentials in another directory with | ||
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<code>srun cpmd.x <input files> <path to pseudo potentials location> > <output file></code> (as in | <code>srun cpmd.x <input files> <path to pseudo potentials location> > <output file></code> (as in script 2) | ||
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