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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10100 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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sjplimp
2013-06-27 19:43:07 +00:00
parent 8b031ab609
commit 33e5f0e99a
4 changed files with 30 additions and 8 deletions
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11
doc/Section_howto.html
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@ -1359,6 +1359,17 @@ output. In each case, the compute, fix, or variable must generate
global values for input to the <A HREF = "dump.html">thermo_style custom</A>
command.
</P>
<P>Note that thermodynamic output values can be "extensive" or
"intensive". The former scale with the number of atoms in the system
(e.g. total energy), the latter do not (e.g. temperature). The
setting for <A HREF = "thermo_modify.html">thermo_modify norm</A> determines whether
extensive quantities are normalized or not. Computes and fixes
produce either extensive or intensive values; see their individual doc
pages for details. <A HREF = "variable.html">Equal-style variables</A> produce only
intensive values; you can include a division by "natoms" in the
formula if desired, to make an extensive calculation produce an
intensive result.
</P>
<H5><A NAME = "dump"></A>Dump file output
</H5>
<P>Dump file output is specified by the <A HREF = "dump.html">dump</A> and

11
doc/Section_howto.txt
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@ -1348,6 +1348,17 @@ output. In each case, the compute, fix, or variable must generate
global values for input to the "thermo_style custom"_dump.html
command.
Note that thermodynamic output values can be "extensive" or
"intensive". The former scale with the number of atoms in the system
(e.g. total energy), the latter do not (e.g. temperature). The
setting for "thermo_modify norm"_thermo_modify.html determines whether
extensive quantities are normalized or not. Computes and fixes
produce either extensive or intensive values; see their individual doc
pages for details. "Equal-style variables"_variable.html produce only
intensive values; you can include a division by "natoms" in the
formula if desired, to make an extensive calculation produce an
intensive result.
Dump file output :h5,link(dump)
Dump file output is specified by the "dump"_dump.html and

8
doc/thermo_style.html
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@ -308,10 +308,10 @@ equal-style variables can be referenced. See the
or they can invoke other computes, fixes, or variables when evaluated,
so this is a very general means of creating thermodynamic output.
</P>
<P>See <A HREF = "Section_modify.html">Section_modify</A> for information on how to add
new compute and fix styles to LAMMPS to calculate quantities that can
then be referenced with these keywords to generate thermodynamic
output.
<P>Note that equal-style variables are assumed to be "intensive" global
quantities, which are thus printed as-is, without normalization by
thermo_style custom. You can include a division by "natoms" in the
variable formula if this is not the case.
</P>
<HR>

8
doc/thermo_style.txt
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@ -302,10 +302,10 @@ equal-style variables can be referenced. See the
or they can invoke other computes, fixes, or variables when evaluated,
so this is a very general means of creating thermodynamic output.
See "Section_modify"_Section_modify.html for information on how to add
new compute and fix styles to LAMMPS to calculate quantities that can
then be referenced with these keywords to generate thermodynamic
output.
Note that equal-style variables are assumed to be "intensive" global
quantities, which are thus printed as-is, without normalization by
thermo_style custom. You can include a division by "natoms" in the
variable formula if this is not the case.
:line