git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3856 f3b2605a-c512-4ea7-a41b-209d697bcdaa

This commit is contained in:
sjplimp
2010-03-02 21:59:33 +00:00
parent 7ee1c0c9e7
commit f8fa87eb7a
68 changed files with 96 additions and 168 deletions

View File

@ -192,15 +192,14 @@ output</A>.
<P>This fix computes a scalar energy and a 6-length vector of forces (one
force magnitude per wall), which can be accessed by various <A HREF = "Section_howto.html#4_15">output
commands</A>. The scalar and vector values
calculated by this fix are "extensive", meaning they scale with the
number of atoms in the simulation. Note that the scalar energy is the
sum of interactions with all defined walls. If you want the energy on
a per-wall basis, you need to use multiple fix wall commands. The 6
vector quantities are the force on the <I>xlo</I> wall, the <I>xhi</I> wall,
<I>ylo</I>, <I>yhi</I>, <I>zlo</I>, <I>zhi</I>. These values will only be non-zero if the
corresponding wall is defined. Note that an outward force on a wall
will be a negative value for <I>lo</I> walls and a positive value for <I>hi</I>
walls.
calculated by this fix are "extensive". Note that the scalar energy
is the sum of interactions with all defined walls. If you want the
energy on a per-wall basis, you need to use multiple fix wall
commands. The 6 vector quantities are the force on the <I>xlo</I> wall,
the <I>xhi</I> wall, <I>ylo</I>, <I>yhi</I>, <I>zlo</I>, <I>zhi</I>. These values will only be
non-zero if the corresponding wall is defined. Note that an outward
force on a wall will be a negative value for <I>lo</I> walls and a positive
value for <I>hi</I> walls.
</P>
<P>No parameter of this fix can be used with the <I>start/stop</I> keywords of
the <A HREF = "run.html">run</A> command.