<!DOCTYPE HTML PUBLIC "-//W3C//DTD HTML 4.0 Transitional//EN"> <html><head><meta name="robots" content="noindex"> <meta http-equiv="Content-Type" content="text/html;charset=iso-8859-1"> <title>sc::SelfConsistentExtrapolation class Reference</title> <link href="doxygen.css" rel="stylesheet" type="text/css"> </head><body bgcolor="#ffffff"> <!-- Generated by Doxygen 1.2.5 on Mon Oct 14 14:17:46 2002 --> <center> <a class="qindex" href="index.html">Main Page</a> <a class="qindex" href="hierarchy.html">Class Hierarchy</a> <a class="qindex" href="annotated.html">Compound List</a> <a class="qindex" href="files.html">File List</a> <a class="qindex" href="functions.html">Compound Members</a> <a class="qindex" href="pages.html">Related Pages</a> </center> <hr><h1>sc::SelfConsistentExtrapolation Class Reference</h1>The <a class="el" href="class_sc__SelfConsistentExtrapolation.html">SelfConsistentExtrapolation</a> abstract class is used to iteratively solve equations requiring a self consistent solution, such as,. <a href="#_details">More...</a> <p> <code>#include <<a class="el" href="scextrap_h-source.html">scextrap.h</a>></code> <p> Inheritance diagram for sc::SelfConsistentExtrapolation<p><center><img src="class_sc__SelfConsistentExtrapolation_inherit_graph.gif" border="0" usemap="#sc::SelfConsistentExtrapolation_inherit_map" alt="Inheritance graph"></center> <map name="sc::SelfConsistentExtrapolation_inherit_map"> <area href="class_sc__DIIS.html" shape="rect" coords="77,347,133,365"> <area href="class_sc__SavableState.html" shape="rect" coords="54,213,155,232"> <area href="class_sc__DescribedClass.html" shape="rect" coords="47,147,162,165"> <area href="class_sc__RefCount.html" shape="rect" coords="63,80,146,99"> <area href="class_sc__Identity.html" shape="rect" coords="69,13,141,32"> </map> <center><font size="2">[<a href="graph_legend.html">legend</a>]</font></center>Collaboration diagram for sc::SelfConsistentExtrapolation:<p><center><img src="class_sc__SelfConsistentExtrapolation_coll_graph.gif" border="0" usemap="#sc::SelfConsistentExtrapolation_coll_map" alt="Collaboration graph"></center> <map name="sc::SelfConsistentExtrapolation_coll_map"> <area href="class_sc__SavableState.html" shape="rect" coords="54,214,155,233"> <area href="class_sc__DescribedClass.html" shape="rect" coords="47,147,162,166"> <area href="class_sc__RefCount.html" shape="rect" coords="63,81,146,99"> <area href="class_sc__Identity.html" shape="rect" coords="69,14,141,33"> </map> <center><font size="2">[<a href="graph_legend.html">legend</a>]</font></center><a href="class_sc__SelfConsistentExtrapolation-members.html">List of all members.</a><table border=0 cellpadding=0 cellspacing=0> <tr><td colspan=2><br><h2>Public Methods</h2></td></tr> <tr><td nowrap align=right valign=top><a name="a0" doxytag="sc::SelfConsistentExtrapolation::SelfConsistentExtrapolation"></a> </td><td valign=bottom><b>SelfConsistentExtrapolation</b> ()</td></tr> <tr><td nowrap align=right valign=top><a name="a1" doxytag="sc::SelfConsistentExtrapolation::SelfConsistentExtrapolation"></a> </td><td valign=bottom><b>SelfConsistentExtrapolation</b> (<a class="el" href="class_sc__StateIn.html">StateIn</a> &)</td></tr> <tr><td nowrap align=right valign=top><a name="a2" doxytag="sc::SelfConsistentExtrapolation::SelfConsistentExtrapolation"></a> </td><td valign=bottom><a class="el" href="class_sc__SelfConsistentExtrapolation.html#a2">SelfConsistentExtrapolation</a> (const <a class="el" href="class_sc__Ref.html">Ref</a>< <a class="el" href="class_sc__KeyVal.html">KeyVal</a> > &)</td></tr> <tr><td> </td><td><font size=-1><em>The only keyword read is tolerance#, which is usually not needed since the objects using <a class="el" href="class_sc__SelfConsistentExtrapolation.html">SelfConsistentExtrapolation</a> should set the tolerances as needed.</em></font><br><br></td></tr> <tr><td nowrap align=right valign=top><a name="a3" doxytag="sc::SelfConsistentExtrapolation::~SelfConsistentExtrapolation"></a> </td><td valign=bottom><b>~SelfConsistentExtrapolation</b> ()</td></tr> <tr><td nowrap align=right valign=top>void </td><td valign=bottom><a class="el" href="class_sc__SelfConsistentExtrapolation.html#a4">save_data_state</a> (<a class="el" href="class_sc__StateOut.html">StateOut</a> &)</td></tr> <tr><td> </td><td><font size=-1><em>Save the base classes (with save_data_state) and the members in the same order that the <a class="el" href="class_sc__StateIn.html">StateIn</a> CTOR initializes them.</em> <a href="#a4">More...</a><em></em></font><br><br></td></tr> <tr><td nowrap align=right valign=top><a name="a5" doxytag="sc::SelfConsistentExtrapolation::set_tolerance"></a> void </td><td valign=bottom><b>set_tolerance</b> (double t)</td></tr> <tr><td nowrap align=right valign=top><a name="a6" doxytag="sc::SelfConsistentExtrapolation::tolerance"></a> double </td><td valign=bottom><b>tolerance</b> ()</td></tr> <tr><td nowrap align=right valign=top><a name="a7" doxytag="sc::SelfConsistentExtrapolation::error"></a> double </td><td valign=bottom><b>error</b> ()</td></tr> <tr><td nowrap align=right valign=top><a name="a8" doxytag="sc::SelfConsistentExtrapolation::converged"></a> int </td><td valign=bottom><b>converged</b> ()</td></tr> <tr><td nowrap align=right valign=top><a name="a9" doxytag="sc::SelfConsistentExtrapolation::extrapolate"></a> virtual int </td><td valign=bottom><b>extrapolate</b> (const <a class="el" href="class_sc__Ref.html">Ref</a>< <a class="el" href="class_sc__SCExtrapData.html">SCExtrapData</a> > &data, const <a class="el" href="class_sc__Ref.html">Ref</a>< <a class="el" href="class_sc__SCExtrapError.html">SCExtrapError</a> > &error)=0</td></tr> <tr><td nowrap align=right valign=top><a name="a10" doxytag="sc::SelfConsistentExtrapolation::start_extrapolation"></a> virtual void </td><td valign=bottom><b>start_extrapolation</b> ()</td></tr> <tr><td nowrap align=right valign=top><a name="a11" doxytag="sc::SelfConsistentExtrapolation::reinitialize"></a> virtual void </td><td valign=bottom><b>reinitialize</b> ()=0</td></tr> <tr><td colspan=2><br><h2>Protected Methods</h2></td></tr> <tr><td nowrap align=right valign=top><a name="b0" doxytag="sc::SelfConsistentExtrapolation::set_error"></a> void </td><td valign=bottom><b>set_error</b> (double e)</td></tr> </table> <hr><a name="_details"></a><h2>Detailed Description</h2> The <a class="el" href="class_sc__SelfConsistentExtrapolation.html">SelfConsistentExtrapolation</a> abstract class is used to iteratively solve equations requiring a self consistent solution, such as,. <p> <p><center> <img align="top" src="form-67.gif"> </center><p> <p> <hr><h2>Member Function Documentation</h2> <a name="a4" doxytag="sc::SelfConsistentExtrapolation::save_data_state"></a><p> <table width="100%" cellpadding="2" cellspacing="0" border="0"> <tr> <td class="md"> <table cellpadding="0" cellspacing="0" border="0"> <tr> <td nowrap valign="top"><b> void sc::SelfConsistentExtrapolation::save_data_state ( </b></td> <td valign="bottom"><b> <a class="el" href="class_sc__StateOut.html">StateOut</a> & <em>s</em> )<code> [virtual]</code> </b></td> </tr> </table> </td> </tr> </table> <table cellspacing=5 cellpadding=0 border=0> <tr> <td> </td> <td> <p> Save the base classes (with save_data_state) and the members in the same order that the <a class="el" href="class_sc__StateIn.html">StateIn</a> CTOR initializes them. <p> This must be implemented by the derived class if the class has data. <p> Reimplemented from <a class="el" href="class_sc__SavableState.html#a5">sc::SavableState</a>. <p> Reimplemented in <a class="el" href="class_sc__DIIS.html#a4">sc::DIIS</a>. </td> </tr> </table> <hr>The documentation for this class was generated from the following file:<ul> <li><a class="el" href="scextrap_h-source.html">scextrap.h</a></ul> <hr> <address> <small> Generated at Mon Oct 14 14:17:47 2002 for <a href="http://aros.ca.sandia.gov/~cljanss/mpqc">MPQC</a> 2.1.2 using the documentation package <a href="http://www.stack.nl/~dimitri/doxygen/index.html">Doxygen</a> 1.2.5. </small> </address> </body> </html>