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#PBS -N Pt136_H2_1_TS
#PBS -l nodes=node02:ppn=16+node03:ppn=16+node04:ppn=16+node05:ppn=16
#PBS -j oe
#PBS -l walltime=9999:00:00
job=Pt136_H2_1_TS
cd /home/dft/vaspuser/ZP/H2-Pt/Pt136_H2_1_TS
mpirun -np 64 -machinefile $PBS_NODEFILE /bin/vasp
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