<!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::PsiExEnv 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 Page</span></a></li> <li><a href="pages.html"><span>Related 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 List</span></a></li> <li><a href="hierarchy.html"><span>Class Hierarchy</span></a></li> <li><a href="functions.html"><span>Class Members</span></a></li> </ul> </div> <div class="navpath"><b>sc</b>::<a class="el" href="classsc_1_1PsiExEnv.html">PsiExEnv</a> </div> </div> <div class="contents"> <h1>sc::PsiExEnv Class Reference</h1><!-- doxytag: class="sc::PsiExEnv" --><!-- doxytag: inherits="sc::DescribedClass" --><a class="el" href="classsc_1_1PsiExEnv.html" title="PsiExEnv specifies a Psi calculation.">PsiExEnv</a> specifies a Psi calculation. <a href="#_details">More...</a> <p> <code>#include <<a class="el" href="psiexenv_8h_source.html">psiexenv.h</a>></code> <p> <div class="dynheader"> Inheritance diagram for sc::PsiExEnv:</div> <div class="dynsection"> <p><center><img src="classsc_1_1PsiExEnv.png" usemap="#sc::PsiExEnv_map" border="0" alt=""></center> <map name="sc::PsiExEnv_map"> <area href="classsc_1_1DescribedClass.html" alt="sc::DescribedClass" shape="rect" coords="0,112,120,136"> <area href="classsc_1_1RefCount.html" alt="sc::RefCount" shape="rect" coords="0,56,120,80"> <area href="classsc_1_1Identity.html" alt="sc::Identity" shape="rect" coords="0,0,120,24"> </map> </div> <p> <a href="classsc_1_1PsiExEnv-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="505bd7fb6a0f6322e27e5985cbc958a0"></a><!-- doxytag: member="sc::PsiExEnv::PsiExEnv" ref="505bd7fb6a0f6322e27e5985cbc958a0" args="(const Ref< KeyVal > &)" --> </td><td class="memItemRight" valign="bottom"><b>PsiExEnv</b> (const <a class="el" href="classsc_1_1Ref.html">Ref</a>< <a class="el" href="classsc_1_1KeyVal.html">KeyVal</a> > &)</td></tr> <tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="4b24b91b5b73510d59e640e0415586b7"></a><!-- doxytag: member="sc::PsiExEnv::PsiExEnv" ref="4b24b91b5b73510d59e640e0415586b7" args="(char *cwd, char *fileprefix, int nscratch, char **scratch)" --> </td><td class="memItemRight" valign="bottom"><b>PsiExEnv</b> (char *cwd, char *fileprefix, int nscratch, char **scratch)</td></tr> <tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="9c91fe9bc639e5b1b9969f903b446522"></a><!-- doxytag: member="sc::PsiExEnv::get_psi_input" ref="9c91fe9bc639e5b1b9969f903b446522" args="() const " --> <a class="el" href="classsc_1_1Ref.html">Ref</a>< <a class="el" href="classsc_1_1PsiInput.html">PsiInput</a> > </td><td class="memItemRight" valign="bottom"><a class="el" href="classsc_1_1PsiExEnv.html#9c91fe9bc639e5b1b9969f903b446522">get_psi_input</a> () const </td></tr> <tr><td class="mdescLeft"> </td><td class="mdescRight">Returns the <a class="el" href="classsc_1_1PsiInput.html" title="PsiInput is a Psi input file.">PsiInput</a> object which <a class="el" href="classsc_1_1PsiExEnv.html" title="PsiExEnv specifies a Psi calculation.">PsiExEnv</a> uses. <br></td></tr> <tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="4e0f2e2e695e0e8e19e0b973e1159352"></a><!-- doxytag: member="sc::PsiExEnv::get_psi_file11" ref="4e0f2e2e695e0e8e19e0b973e1159352" args="() const " --> <a class="el" href="classsc_1_1Ref.html">Ref</a>< <a class="el" href="classsc_1_1PsiFile11.html">PsiFile11</a> > </td><td class="memItemRight" valign="bottom"><a class="el" href="classsc_1_1PsiExEnv.html#4e0f2e2e695e0e8e19e0b973e1159352">get_psi_file11</a> () const </td></tr> <tr><td class="mdescLeft"> </td><td class="mdescRight">Returns the <a class="el" href="classsc_1_1PsiFile11.html" title="PsiFile11 is a Psi gradient file.">PsiFile11</a> object which <a class="el" href="classsc_1_1PsiExEnv.html" title="PsiExEnv specifies a Psi calculation.">PsiExEnv</a> uses. <br></td></tr> <tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="e63d0bb64c9f3da5476bf7271a4de9a4"></a><!-- doxytag: member="sc::PsiExEnv::run_psi" ref="e63d0bb64c9f3da5476bf7271a4de9a4" args="()" --> int </td><td class="memItemRight" valign="bottom"><a class="el" href="classsc_1_1PsiExEnv.html#e63d0bb64c9f3da5476bf7271a4de9a4">run_psi</a> ()</td></tr> <tr><td class="mdescLeft"> </td><td class="mdescRight">Executes Psi input+driver. <br></td></tr> <tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="da6ae4e70a28037cc26f398e5dab4ea5"></a><!-- doxytag: member="sc::PsiExEnv::run_psi_module" ref="da6ae4e70a28037cc26f398e5dab4ea5" args="(char *)" --> int </td><td class="memItemRight" valign="bottom"><a class="el" href="classsc_1_1PsiExEnv.html#da6ae4e70a28037cc26f398e5dab4ea5">run_psi_module</a> (char *)</td></tr> <tr><td class="mdescLeft"> </td><td class="mdescRight">Executes a Psi module. <br></td></tr> <tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="157349885291dfcc37ee29f8cb514c83"></a><!-- doxytag: member="sc::PsiExEnv::get_cwd" ref="157349885291dfcc37ee29f8cb514c83" args="() const " --> string </td><td class="memItemRight" valign="bottom"><a class="el" href="classsc_1_1PsiExEnv.html#157349885291dfcc37ee29f8cb514c83">get_cwd</a> () const </td></tr> <tr><td class="mdescLeft"> </td><td class="mdescRight">Returns current working directory. <br></td></tr> <tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="de8df0fbca1c021d53bf42374154bad7"></a><!-- doxytag: member="sc::PsiExEnv::get_fileprefix" ref="de8df0fbca1c021d53bf42374154bad7" args="() const " --> string </td><td class="memItemRight" valign="bottom"><a class="el" href="classsc_1_1PsiExEnv.html#de8df0fbca1c021d53bf42374154bad7">get_fileprefix</a> () const </td></tr> <tr><td class="mdescLeft"> </td><td class="mdescRight">Returns the Psi file prefix. <br></td></tr> <tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="316c3f9c3d3b00efd968ea8a3366a37e"></a><!-- doxytag: member="sc::PsiExEnv::get_nscratch" ref="316c3f9c3d3b00efd968ea8a3366a37e" args="() const " --> int </td><td class="memItemRight" valign="bottom"><a class="el" href="classsc_1_1PsiExEnv.html#316c3f9c3d3b00efd968ea8a3366a37e">get_nscratch</a> () const </td></tr> <tr><td class="mdescLeft"> </td><td class="mdescRight">Returns the number of scratch locations. <br></td></tr> <tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="f2b35b09d5a951b840dd3ea2d3987b8e"></a><!-- doxytag: member="sc::PsiExEnv::get_scratch" ref="f2b35b09d5a951b840dd3ea2d3987b8e" args="(int i) const " --> string </td><td class="memItemRight" valign="bottom"><a class="el" href="classsc_1_1PsiExEnv.html#f2b35b09d5a951b840dd3ea2d3987b8e">get_scratch</a> (int i) const </td></tr> <tr><td class="mdescLeft"> </td><td class="mdescRight">Returns the ith scratch location. <br></td></tr> <tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="ebce36c18ac55c2f37f040af29c3782a"></a><!-- doxytag: member="sc::PsiExEnv::print" ref="ebce36c18ac55c2f37f040af29c3782a" args="(std::ostream &o=ExEnv::out0()) const " --> void </td><td class="memItemRight" valign="bottom"><a class="el" href="classsc_1_1PsiExEnv.html#ebce36c18ac55c2f37f040af29c3782a">print</a> (std::ostream &o=ExEnv::out0()) const </td></tr> <tr><td class="mdescLeft"> </td><td class="mdescRight">Print the object. <br></td></tr> </table> <hr><a name="_details"></a><h2>Detailed Description</h2> <a class="el" href="classsc_1_1PsiExEnv.html" title="PsiExEnv specifies a Psi calculation.">PsiExEnv</a> specifies a Psi calculation. <hr>The documentation for this class was generated from the following file:<ul> <li><a class="el" href="psiexenv_8h_source.html">psiexenv.h</a></ul> </div> <hr> <address> <small> Generated at Wed Oct 14 14:12:15 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>