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small corrections

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Axel Kohlmeyer
2024-02-22 09:15:18 -05:00
parent 325a7d99d6
commit 3a82e76607
1 changed files with 7 additions and 7 deletions
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doc/src/pair_airebo.rst
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@ -156,7 +156,7 @@ pair_coeff command:
The first 2 arguments must be \* \* so as to span all LAMMPS atom types.
The first three C arguments map LAMMPS atom types 1,2,3 to the C
element in the AIREBO file. The final H argument maps LAMMPS atom
type 4 to the H element in the SW file. If a mapping value is
type 4 to the H element in the AIREBO file. If a mapping value is
specified as NULL, the mapping is not performed. This can be used
when a *airebo* potential is used as part of the *hybrid* pair style.
The NULL values are placeholders for atom types that will be used with
@ -222,12 +222,12 @@ enabled if LAMMPS was built with that package. See the :doc:`Build package <Bui
These pair potentials require the :doc:`newton <newton>` setting to be
"on" for pair interactions.
The CH.airebo and CH.airebo-m potential files provided with LAMMPS
(see the potentials directory) are parameterized for metal :doc:`units <units>`.
You can use the AIREBO, AIREBO-M or REBO potential with any LAMMPS units,
but you would need to create your own AIREBO or AIREBO-M potential file
with coefficients listed in the appropriate units, if your simulation
does not use "metal" units.
The CH.airebo and CH.airebo-m potential files provided with LAMMPS (see
the potentials directory) are parameterized for metal :doc:`units
<units>`. You can use the pair styles with *any* LAMMPS units, but you
would need to create your own AIREBO or AIREBO-M potential file with
coefficients listed in the appropriate units, if your simulation does
not use "metal" units.
The pair styles provided here **only** support potential files parameterized
for the elements carbon and hydrogen (designated with "C" and "H" in the