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This commit is contained in:
Axel Kohlmeyer
2024-05-13 13:43:50 -04:00
parent 84f06aa7a8
commit d4d4c48574
1 changed files with 2 additions and 2 deletions
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doc/src/replicate.rst
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@ -59,7 +59,7 @@ atoms.
The bond discussion which follows only refers to models with The bond discussion which follows only refers to models with
permanent covalent bonds typically defined in LAMMPS via a data permanent covalent bonds typically defined in LAMMPS via a data
file. It is not relevant to sytems modeled with many-body file. It is not relevant to systems modeled with many-body
potentials which can define bonds on-the-fly, based on the current potentials which can define bonds on-the-fly, based on the current
positions of nearby atoms, e.g. models using the :doc:`AIREBO positions of nearby atoms, e.g. models using the :doc:`AIREBO
<pair_airebo>` or :doc:`ReaxFF <pair_reaxff>` potentials. <pair_airebo>` or :doc:`ReaxFF <pair_reaxff>` potentials.
@ -141,7 +141,7 @@ To work around this restriction two options are possible. (1) Fixes
which use the stored data in the restart file can be defined before which use the stored data in the restart file can be defined before
replication and then deleted via the :doc:`unfix <unfix>` command and replication and then deleted via the :doc:`unfix <unfix>` command and
re-defined after it. Or (2) the restart file can be converted to a re-defined after it. Or (2) the restart file can be converted to a
data file (which deletes the stored fix infomation) and fixes defined data file (which deletes the stored fix information) and fixes defined
after the replicate command. In both these scenarios, the per-atom after the replicate command. In both these scenarios, the per-atom
fix information in the restart file is lost. fix information in the restart file is lost.