Commit 5feedbd8 authored by Axel Kohlmeyer's avatar Axel Kohlmeyer
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regenerate html pages with new txt2rst tool

parent 44ce6fac
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@@ -346,8 +346,8 @@ package and are explained in the individual accelerator doc pages,
listed above:</p>
<table border="1" class="docutils">
<colgroup>
<col width="65%" />
<col width="35%" />
<col width="64%" />
<col width="36%" />
</colgroup>
<tbody valign="top">
<tr class="row-odd"><td>build the accelerator library</td>
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@@ -247,15 +247,15 @@ inside the parenthesis is treated as an &#8220;immediate&#8221; variable and
evaluated as an <a class="reference internal" href="variable.html"><span class="doc">equal-style variable</span></a>.  This is a way
to use numeric formulas in an input script without having to assign
them to variable names.  For example, these 3 input script lines:</p>
<div class="highlight-default"><div class="highlight"><pre><span></span>variable X equal (xlo+xhi)/2+sqrt(v_area)
<pre class="literal-block">
variable X equal (xlo+xhi)/2+sqrt(v_area)
region 1 block $X 2 INF INF EDGE EDGE
variable X delete
</pre></div>
</div>
</pre>
<p>can be replaced by</p>
<div class="highlight-default"><div class="highlight"><pre><span></span>region 1 block $((xlo+xhi)/2+sqrt(v_area)) 2 INF INF EDGE EDGE
</pre></div>
</div>
<pre class="literal-block">
region 1 block $((xlo+xhi)/2+sqrt(v_area)) 2 INF INF EDGE EDGE
</pre>
<p>so that you do not have to define (or discard) a temporary variable X.</p>
<p>Note that neither the curly-bracket or immediate form of variables can
contain nested $ characters for other variables to substitute for.
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@@ -486,7 +486,7 @@ be computed.</dd>
<dt><em>Bad TIP4P bond type for PPPMDisp/TIP4P</em></dt>
<dd>Specified bond type is not valid.</dd>
<dt><em>Bad fix ID in fix append/atoms command</em></dt>
<dd>The value of the fix_id for keyword spatial must start with &#8216;<a href="#id6"><span class="problematic" id="id7">f_</span></a>&#8216;.</dd>
<dd>The value of the fix_id for keyword spatial must start with &#8216;f_&#8217;.</dd>
<dt><em>Bad grid of processors</em></dt>
<dd>The 3d grid of processors defined by the processors command does not
match the number of processors LAMMPS is being run on.</dd>
@@ -6358,13 +6358,13 @@ have an infinite periodic crystal with bonds then it is impossible to
have fully consistent image flags, since some bonds will cross
periodic boundaries and connect two atoms with the same image
flag.</dd>
<dt><em>KIM Model does not provide `energy&#8217;; Potential energy will be zero</em></dt>
<dt><em>KIM Model does not provide &#8216;energy&#8217;; Potential energy will be zero</em></dt>
<dd>Self-explanatory.</dd>
<dt><em>KIM Model does not provide `forces&#8217;; Forces will be zero</em></dt>
<dt><em>KIM Model does not provide &#8216;forces&#8217;; Forces will be zero</em></dt>
<dd>Self-explanatory.</dd>
<dt><em>KIM Model does not provide `particleEnergy&#8217;; energy per atom will be zero</em></dt>
<dt><em>KIM Model does not provide &#8216;particleEnergy&#8217;; energy per atom will be zero</em></dt>
<dd>Self-explanatory.</dd>
<dt><em>KIM Model does not provide `particleVirial&#8217;; virial per atom will be zero</em></dt>
<dt><em>KIM Model does not provide &#8216;particleVirial&#8217;; virial per atom will be zero</em></dt>
<dd>Self-explanatory.</dd>
<dt><em>Kspace_modify slab param &lt; 2.0 may cause unphysical behavior</em></dt>
<dd>The kspace_modify slab parameter should be larger to insure periodic
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@@ -303,11 +303,11 @@ longer times, e.g. to measure a particular quantity.</p>
</tbody>
</table>
<p>Here is how you can run and visualize one of the sample problems:</p>
<div class="highlight-default"><div class="highlight"><pre><span></span><span class="n">cd</span> <span class="n">indent</span>
<span class="n">cp</span> <span class="o">../../</span><span class="n">src</span><span class="o">/</span><span class="n">lmp_linux</span> <span class="o">.</span>           <span class="c1"># copy LAMMPS executable to this dir</span>
<span class="n">lmp_linux</span> <span class="o">-</span><span class="ow">in</span> <span class="ow">in</span><span class="o">.</span><span class="n">indent</span>            <span class="c1"># run the problem</span>
</pre></div>
</div>
<pre class="literal-block">
cd indent
cp ../../src/lmp_linux .           # copy LAMMPS executable to this dir
lmp_linux -in in.indent            # run the problem
</pre>
<p>Running the simulation produces the files <em>dump.indent</em> and
<em>log.lammps</em>.  You can visualize the dump file of snapshots with a
variety of 3rd-party tools highlighted on the
@@ -321,17 +321,17 @@ ImageMagick or QuickTime or various Windows-based tools. See the
<a class="reference internal" href="dump_image.html"><span class="doc">dump image</span></a> doc page for more details.  E.g. this
Imagemagick command would create a GIF file suitable for viewing in a
browser.</p>
<div class="highlight-default"><div class="highlight"><pre><span></span><span class="o">%</span> <span class="n">convert</span> <span class="o">-</span><span class="n">loop</span> <span class="mi">1</span> <span class="o">*.</span><span class="n">jpg</span> <span class="n">foo</span><span class="o">.</span><span class="n">gif</span>
</pre></div>
</div>
<pre class="literal-block">
% convert -loop 1 *.jpg foo.gif
</pre>
</div>
<hr class="docutils" />
<div class="section" id="uppercase-directories">
<h2>7.2. Uppercase directories</h2>
<table border="1" class="docutils">
<colgroup>
<col width="10%" />
<col width="90%" />
<col width="11%" />
<col width="89%" />
</colgroup>
<tbody valign="top">
<tr class="row-odd"><td>ASPHERE</td>
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