Sophie

Sophie

distrib > Mandriva > 2010.0 > i586 > media > contrib-release > by-pkgid > 247b28499c443e092731ffba814075f2 > files > 751

mpqc-html-2.3.1-9mdv2010.0.i586.rpm

<!DOCTYPE HTML PUBLIC "-//W3C//DTD HTML 4.01 Transitional//EN">
<html><head><meta http-equiv="Content-Type" content="text/html;charset=UTF-8">
<title>MPQC: sc::SOTransformShell Class Reference</title>
<link href="tabs.css" rel="stylesheet" type="text/css">
<link href="doxygen.css" rel="stylesheet" type="text/css">
</head><body>
<!-- Generated by Doxygen 1.5.9 -->
<div class="navigation" id="top">
  <div class="tabs">
    <ul>
      <li><a href="index.html"><span>Main&nbsp;Page</span></a></li>
      <li><a href="pages.html"><span>Related&nbsp;Pages</span></a></li>
      <li class="current"><a href="annotated.html"><span>Classes</span></a></li>
      <li><a href="files.html"><span>Files</span></a></li>
    </ul>
  </div>
  <div class="tabs">
    <ul>
      <li><a href="annotated.html"><span>Class&nbsp;List</span></a></li>
      <li><a href="hierarchy.html"><span>Class&nbsp;Hierarchy</span></a></li>
      <li><a href="functions.html"><span>Class&nbsp;Members</span></a></li>
    </ul>
  </div>
  <div class="navpath"><b>sc</b>::<a class="el" href="classsc_1_1SOTransformShell.html">SOTransformShell</a>
  </div>
</div>
<div class="contents">
<h1>sc::SOTransformShell Class Reference</h1><!-- doxytag: class="sc::SOTransformShell" --><a class="el" href="classsc_1_1SOTransformShell.html" title="SOTransformShell maintains a list of AO functions contribute to an SO function in...">SOTransformShell</a> maintains a list of AO functions contribute to an SO function in a particular SO shell.  
<a href="#_details">More...</a>
<p>
<code>#include &lt;<a class="el" href="sobasis_8h_source.html">sobasis.h</a>&gt;</code>
<p>

<p>
<a href="classsc_1_1SOTransformShell-members.html">List of all members.</a><table border="0" cellpadding="0" cellspacing="0">
<tr><td></td></tr>
<tr><td colspan="2"><br><h2>Public Member Functions</h2></td></tr>
<tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="8be947b5cf5fe4e8dd59c4d47ad63afb"></a><!-- doxytag: member="sc::SOTransformShell::add_func" ref="8be947b5cf5fe4e8dd59c4d47ad63afb" args="(int irrep, double coef, int aofunc, int sofunc)" -->
void&nbsp;</td><td class="memItemRight" valign="bottom"><a class="el" href="classsc_1_1SOTransformShell.html#8be947b5cf5fe4e8dd59c4d47ad63afb">add_func</a> (int irrep, double coef, int aofunc, int sofunc)</td></tr>

<tr><td class="mdescLeft">&nbsp;</td><td class="mdescRight">Add another function to the transform. <br></td></tr>
<tr><td colspan="2"><br><h2>Public Attributes</h2></td></tr>
<tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="6e2af143ff1ae23464f44f6d007c482d"></a><!-- doxytag: member="sc::SOTransformShell::aoshell" ref="6e2af143ff1ae23464f44f6d007c482d" args="" -->
int&nbsp;</td><td class="memItemRight" valign="bottom"><a class="el" href="classsc_1_1SOTransformShell.html#6e2af143ff1ae23464f44f6d007c482d">aoshell</a></td></tr>

<tr><td class="mdescLeft">&nbsp;</td><td class="mdescRight">The number of the AO shell from which these functions come. <br></td></tr>
<tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="cf8978796f85bf6447970f7b9fd01fe0"></a><!-- doxytag: member="sc::SOTransformShell::nfunc" ref="cf8978796f85bf6447970f7b9fd01fe0" args="" -->
int&nbsp;</td><td class="memItemRight" valign="bottom"><a class="el" href="classsc_1_1SOTransformShell.html#cf8978796f85bf6447970f7b9fd01fe0">nfunc</a></td></tr>

<tr><td class="mdescLeft">&nbsp;</td><td class="mdescRight">The number of AO/SO function pairs contributing. <br></td></tr>
<tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="2c65b541e802a7c8f6f20ed44425bd7e"></a><!-- doxytag: member="sc::SOTransformShell::func" ref="2c65b541e802a7c8f6f20ed44425bd7e" args="" -->
<a class="el" href="classsc_1_1SOTransformFunction.html">SOTransformFunction</a> *&nbsp;</td><td class="memItemRight" valign="bottom"><a class="el" href="classsc_1_1SOTransformShell.html#2c65b541e802a7c8f6f20ed44425bd7e">func</a></td></tr>

<tr><td class="mdescLeft">&nbsp;</td><td class="mdescRight">The array of <a class="el" href="classsc_1_1SOTransformFunction.html" title="SOTransformShell describes how an AO function contributes to an SO function in a...">SOTransformFunction</a> objects describing the transform. <br></td></tr>
</table>
<hr><a name="_details"></a><h2>Detailed Description</h2>
<a class="el" href="classsc_1_1SOTransformShell.html" title="SOTransformShell maintains a list of AO functions contribute to an SO function in...">SOTransformShell</a> maintains a list of AO functions contribute to an SO function in a particular SO shell. 
<p>
The information is stored in objects of type <a class="el" href="classsc_1_1SOTransformFunction.html" title="SOTransformShell describes how an AO function contributes to an SO function in a...">SOTransformFunction</a>. <hr>The documentation for this class was generated from the following file:<ul>
<li><a class="el" href="sobasis_8h_source.html">sobasis.h</a></ul>
</div>
<hr>
<address>
<small>

Generated at Wed Oct 14 14:12:13 2009 for <a
href="http://www.mpqc.org">MPQC</a>
2.3.1 using the documentation package <a
href="http://www.doxygen.org">Doxygen</a>
1.5.9.

</small>
</address>
</body>
</html>