Ignore:
Timestamp:
Mar 14, 2015 5:35:03 PM (8 years ago)
Author:
toby
Message:

change sphinx docs links; rebuild & fixing minor formatting

File:
1 edited

Legend:

Unmodified
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  • sphinxdocs/build/html/_modules/G2export_shelx.html

    r1513 r1709  
    5252<span class="c"># -*- coding: utf-8 -*-</span>
    5353<span class="c">########### SVN repository information ###################</span>
    54 <span class="c"># $Date: 2014-03-24 17:22:41 -0500 (Mon, 24 Mar 2014) $</span>
    55 <span class="c"># $Author: toby $</span>
    56 <span class="c"># $Revision: 1261 $</span>
    57 <span class="c"># $URL: https://subversion.xor.aps.anl.gov/pyGSAS/trunk/exports/G2export_shelx.py $</span>
    58 <span class="c"># $Id: G2export_shelx.py 1261 2014-03-24 22:22:41Z toby $</span>
     54<span class="c"># $Date: 2014-12-26 21:08:45 -0600 (Fri, 26 Dec 2014) $</span>
     55<span class="c"># $Author: vondreele $</span>
     56<span class="c"># $Revision: 1618 $</span>
     57<span class="c"># $URL: https://subversion.xray.aps.anl.gov/pyGSAS/trunk/exports/G2export_shelx.py $</span>
     58<span class="c"># $Id: G2export_shelx.py 1618 2014-12-27 03:08:45Z vondreele $</span>
    5959<span class="c">########### SVN repository information ###################</span>
    6060<span class="sd">&#39;&#39;&#39;</span>
     
    6868<span class="kn">import</span> <span class="nn">os.path</span>
    6969<span class="kn">import</span> <span class="nn">GSASIIpath</span>
    70 <span class="n">GSASIIpath</span><span class="o">.</span><span class="n">SetVersionNumber</span><span class="p">(</span><span class="s">&quot;$Revision: 1261 $&quot;</span><span class="p">)</span>
     70<span class="n">GSASIIpath</span><span class="o">.</span><span class="n">SetVersionNumber</span><span class="p">(</span><span class="s">&quot;$Revision: 1618 $&quot;</span><span class="p">)</span>
    7171<span class="kn">import</span> <span class="nn">GSASIIIO</span> <span class="kn">as</span> <span class="nn">G2IO</span>
    7272<span class="kn">import</span> <span class="nn">GSASIIstrIO</span> <span class="kn">as</span> <span class="nn">G2stIO</span>
     
    117117            <span class="bp">self</span><span class="o">.</span><span class="n">Write</span><span class="p">(</span><span class="s">&quot;LATT &quot;</span><span class="o">+</span><span class="nb">str</span><span class="p">(</span><span class="n">lattnum</span><span class="p">))</span>
    118118            <span class="c"># generate symmetry operations not including centering and center of symmetry</span>
    119             <span class="k">for</span> <span class="n">M</span><span class="p">,</span><span class="n">T</span> <span class="ow">in</span> <span class="n">phasedict</span><span class="p">[</span><span class="s">&#39;General&#39;</span><span class="p">][</span><span class="s">&#39;SGData&#39;</span><span class="p">][</span><span class="s">&#39;SGOps&#39;</span><span class="p">]:</span>
    120                 <span class="n">sym</span> <span class="o">=</span> <span class="n">G2spc</span><span class="o">.</span><span class="n">MT2text</span><span class="p">(</span><span class="n">M</span><span class="p">,</span><span class="n">T</span><span class="p">)</span><span class="o">.</span><span class="n">lower</span><span class="p">()</span><span class="o">.</span><span class="n">replace</span><span class="p">(</span><span class="s">&quot; ,&quot;</span><span class="p">,</span><span class="s">&quot;, &quot;</span><span class="p">)</span>
     119            <span class="k">for</span> <span class="n">Opr</span> <span class="ow">in</span> <span class="n">phasedict</span><span class="p">[</span><span class="s">&#39;General&#39;</span><span class="p">][</span><span class="s">&#39;SGData&#39;</span><span class="p">][</span><span class="s">&#39;SGOps&#39;</span><span class="p">]:</span>
     120                <span class="n">sym</span> <span class="o">=</span> <span class="n">G2spc</span><span class="o">.</span><span class="n">MT2text</span><span class="p">(</span><span class="n">Opr</span><span class="p">)</span><span class="o">.</span><span class="n">lower</span><span class="p">()</span><span class="o">.</span><span class="n">replace</span><span class="p">(</span><span class="s">&quot; ,&quot;</span><span class="p">,</span><span class="s">&quot;, &quot;</span><span class="p">)</span>
    121121                <span class="bp">self</span><span class="o">.</span><span class="n">Write</span><span class="p">(</span><span class="s">&#39;SYMM &#39;</span><span class="o">+</span><span class="n">G2IO</span><span class="o">.</span><span class="n">trim</span><span class="p">(</span><span class="n">sym</span><span class="p">))</span>
    122122            <span class="c"># scan through atom types, count the number of times that each element occurs</span>
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