git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10954 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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sjplimp
2013-11-04 20:51:55 +00:00
parent 343928a9f1
commit 315cc6011e
16 changed files with 81 additions and 6 deletions

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@ -84,7 +84,7 @@ wildcard asterisk can be used in place of or in conjunction with the
an asterisk with no numeric values means all types from 1 to N. A
leading asterisk means all types from 1 to n (inclusive). A trailing
asterisk means all types from n to N (inclusive). A middle asterisk
means all types from m to n (inclusive).
means all types from m to n (inclusive).
</P>
<P>You also specify two functions, as <A HREF = "variable.html">equal-style
variables</A>. The first is specified as <I>v_name1</I>, where
@ -113,6 +113,8 @@ command.
<P>More details about the exact functional forms for the computation of
du/dl can be found in the paper by <A HREF = "#Eike">Eike</A>.
</P>
<HR>
<P><B>Output info:</B>
</P>
<P>This compute calculates a global scalar, namely dUs/dlambda. This
@ -127,8 +129,8 @@ options.
</P>
<P><B>Restrictions:</B>
</P>
<P>This compute is part of the MISC package. It is only enabled if LAMMPS
was built with that package. See the <A HREF = "Section_start.html#start_3">Making
<P>This compute is part of the MISC package. It is only enabled if
LAMMPS was built with that package. See the <A HREF = "Section_start.html#start_3">Making
LAMMPS</A> section for more info.
</P>
<P><B>Related commands:</B>
@ -137,6 +139,8 @@ LAMMPS</A> section for more info.
</P>
<P><B>Default:</B> none
</P>
<HR>
<A NAME = "Eike"></A>
<P><B>(Eike)</B> Eike and Maginn, Journal of Chemical Physics, 124, 164503 (2006).