git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14995 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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doc/html/_sources/fix_manifoldforce.txt
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doc/html/_sources/fix_manifoldforce.txt
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.. index:: fix manifoldforce
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fix manifoldforce command
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=========================
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Syntax
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""""""
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.. parsed-literal::
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fix ID group-ID manifoldforce manifold manifold-args ...
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* ID, group-ID are documented in :doc:`fix <fix>` command
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* manifold = name of the manifold
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* manifold-args = parameters for the manifold
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Examples
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""""""""
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fix constrain all manifoldforce sphere 5.0
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Description
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"""""""""""
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This fix subtracts each time step from the force the component along the normal of the specified :doc:`manifold <manifolds>`.
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This can be used in combination with :doc:`minimize <minimize>` to remove overlap between particles while
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keeping them (roughly) constrained to the given manifold, e.g. to set up a run with :doc:`fix nve/manifold/rattle <fix_nve_manifold_rattle>`.
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I have found that only *hftn* and *quickmin* with a very small time step perform adequately though.
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----------
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Restart, fix_modify, output, run start/stop, minimize info
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""""""""""""""""""""""""""""""""""""""""""""""""""""""""""
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No information about this fix is written to :doc:`binary restart files <restart>`. None of the :doc:`fix_modify <fix_modify>` options
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are relevant to this fix. No global or per-atom quantities are stored
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by this fix for access by various :ref:`output commands <howto_15>`. No parameter of this fix can
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be used with the *start/stop* keywords of the :doc:`run <run>` command.
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This fix is invoked during :doc:`energy minimization <minimize>`.
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----------
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Restrictions
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""""""""""""
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This fix is part of the USER-MANIFOLD package. It is only enabled if LAMMPS
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was built with that package. See the :ref:`Making LAMMPS <start_3>`
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section for more info.
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Only use this with *min_style hftn* or *min_style quickmin*\ . If not, the constraints
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will not be satisfied very well at all. A warning is generated if the *min_style* is
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incompatible but no error.
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----------
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Related commands
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""""""""""""""""
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:doc:`fix nve/manifold/rattle <fix_nve_manifold_rattle>`, :doc:`fix nvt/manifold/rattle <fix_nvt_manifold_rattle>`
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.. _lws: http://lammps.sandia.gov
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.. _ld: Manual.html
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.. _lc: Section_commands.html#comm
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