LAMMPS run in Stampede 2

Hi everyone,

If there is someone running lammps in Stampede 2? I have a simple question.

As Stampede 2 default mpi is intel mpi(version impi/17.0.3), how can I write my sbatch file in the executive line?

I know it should be written as:

ibrun --mpi=openmpi /home1/04590/tg838897/lammps30Jul16/src/lmp_adhe<./in.file>log.lammps

as previous stampede install MVAPICH2.

Then how I revise it now?

Best,

Lynn

Hi everyone,

If there is someone running lammps in Stampede 2? I have a simple question.

As Stampede 2 default mpi is intel mpi(version impi/17.0.3), how can I
write my sbatch file in the executive line?

I know it should be written as:

ibrun --mpi=openmpi /home1/04590/tg838897/lammps30Jul16/src/lmp_adhe<./
in.file>log.lammps

as previous stampede install MVAPICH2.

Then how I revise it now?

‚Äčthis is something that you should ask the TACC help desk. it is their job
to help you run on their machine.

axel.‚Äč

Hi Axel,

Many thanks.

best,
Lynn