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Usage of LAMMPS on JUQUEEN

Lammps is available on JUQUEEN and can be used by loading the corresponding module: module load lammps/30Aug12. The example given below is stored on JUQUEEN in /bgsys/local/lammps/30Aug12/examples/Quickstep . Just launch the job by llsubmit crack_lammps.job .


crack_lammps.job:

Lammps is available on JUROPA/HPC-FF and can be used by loading the corresponding module: module load lammps .
The example given below is stored on JUROPA/HPC-FF in
/usr/local/lammps/9-Nov-2011/examples/Quickstep .
Just launch the job by msub crack_lammps.job .

crack_lammps.job:

#!/bin/bash

# @job_name = lammps
# @comment = "lammps test"
# @output = crack.out
# @error = crack.err
# @environment = COPY_ALL
# @job_type = bluegene
# @notification = never
# @bg_size = 32
# @bg_connectivity = Torus
# @wall_clock_limit = 00:10:00

module load lammps/30Aug12

runjob : /bgsys/local/lammps/5May12/bin/lmp_juqueen -in in.crack