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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14349 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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sjplimp
2015-12-10 17:23:56 +00:00
parent 8550cacf18
commit 28bf73fbf7
688 changed files with 6410 additions and 6513 deletions
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26
doc/fix_nphug.html
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@ -8,7 +8,7 @@
<meta name="viewport" content="width=device-width, initial-scale=1.0">
<title>fix nphug command &mdash; LAMMPS 15 May 2015 version documentation</title>
<title>fix nphug command &mdash; LAMMPS 10 Dec 2015 version documentation</title>
@ -32,7 +32,7 @@
<link rel="top" title="LAMMPS 15 May 2015 version documentation" href="index.html"/>
<link rel="top" title="LAMMPS 10 Dec 2015 version documentation" href="index.html"/>
<script src="_static/js/modernizr.min.js"></script>
@ -216,16 +216,14 @@ fluctuate about zero.</p>
the simulation. These can be overridden using the fix_modify keywords <em>e0</em>,
<em>v0</em>, and <em>p0</em> described below.</p>
<hr class="docutils" />
<div class="admonition warning">
<p class="first admonition-title">Warning</p>
<p class="last">Unlike the <a class="reference internal" href="fix_temp_berendsen.html"><em>fix temp/berendsen</em></a> command which performs
thermostatting but NO time integration, this fix performs
thermostatting/barostatting AND time integration. Thus you should not
use any other time integration fix, such as <a class="reference internal" href="fix_nve.html"><em>fix nve</em></a> on
atoms to which this fix is applied. Likewise, this fix should not be
used on atoms that have their temperature controlled by another fix
- e.g. by <a class="reference internal" href="fix_nh.html"><em>fix langevin</em></a> or <a class="reference internal" href="fix_temp_rescale.html"><em>fix temp/rescale</em></a>
commands.</p>
<div class="admonition note">
<p class="first admonition-title">Note</p>
<p class="last">Unlike the <a class="reference internal" href="fix_temp_berendsen.html"><em>fix temp/berendsen</em></a> command
which performs thermostatting but NO time integration, this fix
performs thermostatting/barostatting AND time integration. Thus you
should not use any other time integration fix, such as <a class="reference internal" href="fix_nve.html"><em>fix nve</em></a> on atoms to which this fix is applied. Likewise,
this fix should not be used on atoms that have their temperature
controlled by another fix - e.g. by <a class="reference internal" href="fix_nh.html"><em>fix langevin</em></a> or <a class="reference internal" href="fix_temp_rescale.html"><em>fix temp/rescale</em></a> commands.</p>
</div>
<hr class="docutils" />
<p>This fix computes a temperature and pressure at each timestep. To do
@ -338,7 +336,7 @@ plus the additional ones mentioned above.</p>
<div role="contentinfo">
<p>
&copy; Copyright .
&copy; Copyright 2013 Sandia Corporation.
</p>
</div>
Built with <a href="http://sphinx-doc.org/">Sphinx</a> using a <a href="https://github.com/snide/sphinx_rtd_theme">theme</a> provided by <a href="https://readthedocs.org">Read the Docs</a>.
@ -359,7 +357,7 @@ plus the additional ones mentioned above.</p>
<script type="text/javascript">
var DOCUMENTATION_OPTIONS = {
URL_ROOT:'./',
VERSION:'15 May 2015 version',
VERSION:'10 Dec 2015 version',
COLLAPSE_INDEX:false,
FILE_SUFFIX:'.html',
HAS_SOURCE: true