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R195/clusters/user/CPMD/preprocessing.job
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preprocessing.job
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#!/bin/bash -l
#SBATCH --nodes 1
#SBATCH --ntasks 2
#SBATCH --cpus-per-task 1
#SBATCH --time 00:55:00
#SBATCH --job-name CPMD_PRE
#SBATCH --exclusive
# follow cluster-specific content and run command
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