From 58a03f12eb2bbbc842499214bd038a2339403ec9 Mon Sep 17 00:00:00 2001 From: David Nicholson Date: Thu, 30 Jan 2020 15:25:55 -0500 Subject: [PATCH] draft doc page for bond_style special --- doc/src/bond_special.rst | 59 ++++++++++++++++++++++++++++++++++++++++ 1 file changed, 59 insertions(+) create mode 100644 doc/src/bond_special.rst diff --git a/doc/src/bond_special.rst b/doc/src/bond_special.rst new file mode 100644 index 0000000000..1b9409be3d --- /dev/null +++ b/doc/src/bond_special.rst @@ -0,0 +1,59 @@ +.. index:: bond_style special + +bond_style special command +================================= + +Syntax +"""""" + + +.. code-block:: LAMMPS + + bond_style special + +Examples +"""""""" + + +.. code-block:: LAMMPS + + bond_style special + bond_coeff 0.5 0.5 + +Description +""""""""""" + +The *special* bond style can be used to impose weighted Lennard Jones and/or +Coloumbic interactions on any two particles in the system. It can be used for +cases that cannot be handled in :doc:`special_bonds `, such as +1-5 interactions or hyrbrid simulations that require the use of different +weighting factors for different molecules. + +The following coefficients must be defined for each bond type via the +:doc:`bond_coeff ` command as in the example above, or in +the data file or restart files read by the :doc:`read_data ` +or :doc:`read_restart ` commands: + +* `w_lj` weight (0.0 to 1.0) on pairwise Lennard-Jones interactions + +* `w_coul` weight (0.0 to 1.0) on pairwise Coulombic interactions + +This command will typically be used in conjunction with + +---------- + + + +Restrictions +"""""""""""" + +This bond style can only be used if LAMMPS was built with the +USER-MISC package. See the :doc:`Build package ` doc +page for more info. + +Related commands +"""""""""""""""" + +:doc:`bond_coeff `, :doc:`special_bonds `, + +**Default:** none