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some more documentation updates

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This commit is contained in:
Axel Kohlmeyer
2023-03-29 17:46:17 -04:00
parent c68e71a24f
commit a382f4ce3c
3 changed files with 22 additions and 7 deletions
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14
doc/src/Commands_removed.rst
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@ -38,6 +38,20 @@ been folded into the :doc:`reset_atoms <reset_atoms>` command. If
present, LAMMPS will replace the commands accordingly and print a
warning.
LATTE package
-------------
.. deprecated:: TBD
The LATTE package with the fix latte command was removed from LAMMPS.
This functionality has been superseded by :doc:`fix mdi/qm <fix_mdi_qm>`
and :doc:`fix mdi/qmmm <fix_mdi_qmmm>` from the :ref:`MDI package
<PKG-MDI>`. These fixes are compatible with several quantum software
packages, including LATTE. See the ``examples/QUANTUM`` dir and the
:doc:`MDI coupling HOWTO <Howto_mdi>` page. MDI supports running LAMMPS
with LATTE as a plugin library (similar to the way fix latte worked), as
well as on a different set of MPI processors.
MEAM package
------------

14
doc/src/Howto_couple.rst
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@ -15,13 +15,13 @@ the context of your application.
1. Define a new :doc:`fix <fix>` or :doc:`compute <compute>` command
that calls the other code. In this scenario, LAMMPS is the driver
code. During timestepping, the fix or compute is invoked, and can
make library calls to the other code, which has been linked to
LAMMPS as a library. This is the way the :ref:`VORONOI
<PKG-VORONOI>` package, which computes Voronoi tesselations using
the `Voro++ library <http://math.lbl.gov/voro++>`_, is interfaced
to LAMMPS. See the :doc:`compute voronoi <compute_voronoi>`
command for more details. Also see the :doc:`Modify <Modify>`
pages for information on how to add a new fix or compute to LAMMPS.
make library calls to the other code, which has been linked to LAMMPS
as a library. This is the way the :ref:`VORONOI <PKG-VORONOI>`
package, which computes Voronoi tesselations using the `Voro++
library <http://math.lbl.gov/voro++>`_, is interfaced to LAMMPS. See
the :doc:`compute voronoi <compute_voronoi_atom>` command for more
details. Also see the :doc:`Modify <Modify>` pages for information
on how to add a new fix or compute to LAMMPS.
.. spacer

1
doc/utils/sphinx-config/false_positives.txt
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@ -3543,6 +3543,7 @@ ters
tersoff
Tersoff
tesselation
tesselations
Tetot
tex
tfac