[lammps-users] Information to be added to the manual (?)

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1

Dear LAMMPS authors,

I tried to run a NEB calculations, and I finally succeeded once I
included an "atom_modify map" command in the input file (BTW, thanks for
the example). It is mentioned in the doc that atoms sorting must be
disabled using "atoms_modify sort", but not that mapping has to be
activated.

I did not find any messages related to this issue in the archive, so I
thought it might be worth to tell you.

Thanks for the support and for the LAMMPS code,

Laurent

2

Added a line to the neb doc page about this.

Thanks,
Steve