I’m running a LAMMPS script using SLURM. I’m getting the following error,
Deleted 179 atoms, new total = 123473
WARNING: Using ‘neigh_modify every 1 delay 0 check yes’ setting during minimization (…/min.cpp:168)
I’m running a LAMMPS script using SLURM. I’m getting the following error,
you forgot the most important piece of information: which LAMMPS version is this with. what platform etc.?
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But the same file is working for other lammps jobs. Does this error indicate any error in my script? Any help is greatly appreciated.
what do you mean by “same file”. please be more specific and provide more detailed information. please also note, that there have been several updates and bugfixes to the USER-INTEL package recently, so i would strongly recommend to update LAMMPS to the latest patch version (24 October 2018).
axel.
Thanks,