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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@1123 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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sjplimp 2007-11-02 21:05:48 +00:00
parent 3ec5b83564
commit 11bc33feb8
2 changed files with 6 additions and 6 deletions
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6
doc/compute_pe.html
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@ -17,7 +17,7 @@
</PRE>
<UL><LI>ID, group-ID are documented in <A HREF = "compute.html">compute</A> command
<LI>pe = style name of this compute command
<LI>zero of more keywords may be appended
<LI>zero or more keywords may be appended
<LI>keyword = <I>pair</I> or <I>bond</I> or <I>angle</I> or <I>dihedral</I> or <I>improper</I> or <I>kspace</I>
</UL>
<P><B>Examples:</B>
@ -29,8 +29,8 @@ compute molPE all bond angle dihedral improper
</P>
<P>Define a computation that calculates the potential energy of the
entire system of atoms. The specified group must be "all". See the
<A HREF = "compute_epair_atom.html">compute epair/atom</A> <A HREF = "compute_ebond_atom.html">compute
ebond/atom</A> or commands if you want per-atom
<A HREF = "compute_epair_atom.html">compute epair/atom</A> and <A HREF = "compute_ebond_atom.html">compute
ebond/atom</A> commands if you want per-atom
energies. These per-atom values could be summed for a group of atoms
via the <A HREF = "compute_sum.html">compute sum</A> command.
</P>

6
doc/compute_pe.txt
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@ -14,7 +14,7 @@ compute ID group-ID pe keyword ... :pre
ID, group-ID are documented in "compute"_compute.html command
pe = style name of this compute command
zero of more keywords may be appended
zero or more keywords may be appended
keyword = {pair} or {bond} or {angle} or {dihedral} or {improper} or {kspace} :ul
[Examples:]
@ -26,8 +26,8 @@ compute molPE all bond angle dihedral improper :pre
Define a computation that calculates the potential energy of the
entire system of atoms. The specified group must be "all". See the
"compute epair/atom"_compute_epair_atom.html "compute
ebond/atom"_compute_ebond_atom.html or commands if you want per-atom
"compute epair/atom"_compute_epair_atom.html and "compute
ebond/atom"_compute_ebond_atom.html commands if you want per-atom
energies. These per-atom values could be summed for a group of atoms
via the "compute sum"_compute_sum.html command.