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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12703 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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sjplimp 2014-11-17 18:40:51 +00:00
parent 45f40ad299
commit 2dae59316d
2 changed files with 16 additions and 6 deletions
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11
doc/compute_property_atom.html
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@ -61,7 +61,7 @@
tqx,tqy,tqz = torque on finite-size particles
end12x, end12y, end12z = end points of line segment
corner123x, corner123y, corner123z = corner points of triangle
nbonds = number of bonds
nbonds = number of bonds assigned to an atom
</PRE>
<PRE> PERI package per-atom properties:
vfrac = ???
@ -131,8 +131,13 @@ line segment particles and define the end points of each line segment.
<I>corner2z</I>, <I>corner3x</I>, <I>corner3y</I>, <I>corner3z</I>, are defined for
triangular particles and define the corner points of each triangle.
</P>
<P><I>nbonds</I> is available for all molecular atom styles and refers to
the number of explicit bonds attached to an atom.
<P><I>Nbonds</I> is available for all molecular atom styles and refers to the
number of explicit bonds assigned to an atom. Note that if the
<A HREF = "newton.html">newton bond</A> command is set to <I>on</I>, which is the
default, then every bond in the system is assigned to only one of the
two atoms in the bond. Thus a bond between atoms I,J may be tallied
for either atom I or atom J. If <A HREF = "newton.html">newton bond off</A> is set,
it will be tallied with both atom I and atom J.
</P>
<P>The <I>i_name</I> and <I>d_name</I> attributes refer to custom integer and
floating-point properties that have been added to each atom via the

11
doc/compute_property_atom.txt
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@ -54,7 +54,7 @@ input = one or more atom attributes :l
tqx,tqy,tqz = torque on finite-size particles
end12x, end12y, end12z = end points of line segment
corner123x, corner123y, corner123z = corner points of triangle
nbonds = number of bonds :pre
nbonds = number of bonds assigned to an atom :pre
PERI package per-atom properties:
vfrac = ???
@ -123,8 +123,13 @@ line segment particles and define the end points of each line segment.
{corner2z}, {corner3x}, {corner3y}, {corner3z}, are defined for
triangular particles and define the corner points of each triangle.
{nbonds} is available for all molecular atom styles and refers to
the number of explicit bonds attached to an atom.
{Nbonds} is available for all molecular atom styles and refers to the
number of explicit bonds assigned to an atom. Note that if the
"newton bond"_newton.html command is set to {on}, which is the
default, then every bond in the system is assigned to only one of the
two atoms in the bond. Thus a bond between atoms I,J may be tallied
for either atom I or atom J. If "newton bond off"_newton.html is set,
it will be tallied with both atom I and atom J.
The {i_name} and {d_name} attributes refer to custom integer and
floating-point properties that have been added to each atom via the