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<div class="navpath"><b>sc</b>::<a class="el" href="classsc_1_1P86CFunctional.html">P86CFunctional</a>
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<h1>sc::P86CFunctional Class Reference</h1><!-- doxytag: class="sc::P86CFunctional" --><!-- doxytag: inherits="sc::DenFunctional" -->Implements the Perdew 1986 (P86) correlation functional.
<a href="#_details">More...</a>
<p>
<code>#include <<a class="el" href="functional_8h_source.html">functional.h</a>></code>
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Inheritance diagram for sc::P86CFunctional:</div>
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<p><center><img src="classsc_1_1P86CFunctional.png" usemap="#sc::P86CFunctional_map" border="0" alt=""></center>
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<p>
<a href="classsc_1_1P86CFunctional-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="008ebc09f378c227612c90ca61e392d4"></a><!-- doxytag: member="sc::P86CFunctional::P86CFunctional" ref="008ebc09f378c227612c90ca61e392d4" args="(const Ref< KeyVal > &)" -->
</td><td class="memItemRight" valign="bottom"><b>P86CFunctional</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="dae57d734d1b295a77b1b5ef0a588251"></a><!-- doxytag: member="sc::P86CFunctional::P86CFunctional" ref="dae57d734d1b295a77b1b5ef0a588251" args="(StateIn &)" -->
</td><td class="memItemRight" valign="bottom"><b>P86CFunctional</b> (<a class="el" href="classsc_1_1StateIn.html">StateIn</a> &)</td></tr>
<tr><td class="memItemLeft" nowrap align="right" valign="top">void </td><td class="memItemRight" valign="bottom"><a class="el" href="classsc_1_1P86CFunctional.html#92b4da081ddcfdc4311c850446808daa">save_data_state</a> (<a class="el" href="classsc_1_1StateOut.html">StateOut</a> &)</td></tr>
<tr><td class="mdescLeft"> </td><td class="mdescRight">Save the base classes (with save_data_state) and the members in the same order that the <a class="el" href="classsc_1_1StateIn.html" title="Restores objects that derive from SavableState.">StateIn</a> CTOR initializes them. <a href="#92b4da081ddcfdc4311c850446808daa"></a><br></td></tr>
<tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="44217f9c41cd6bd280d05c3d2a6d73d4"></a><!-- doxytag: member="sc::P86CFunctional::need_density_gradient" ref="44217f9c41cd6bd280d05c3d2a6d73d4" args="()" -->
int </td><td class="memItemRight" valign="bottom"><b>need_density_gradient</b> ()</td></tr>
<tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="bc9cb18cd633f58b36e7c7217fa86e89"></a><!-- doxytag: member="sc::P86CFunctional::point" ref="bc9cb18cd633f58b36e7c7217fa86e89" args="(const PointInputData &, PointOutputData &)" -->
void </td><td class="memItemRight" valign="bottom"><b>point</b> (const <a class="el" href="structsc_1_1PointInputData.html">PointInputData</a> &, <a class="el" href="structsc_1_1PointOutputData.html">PointOutputData</a> &)</td></tr>
<tr><td colspan="2"><br><h2>Protected Member Functions</h2></td></tr>
<tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="f87075a654b718df835ae78d712e9439"></a><!-- doxytag: member="sc::P86CFunctional::init_constants" ref="f87075a654b718df835ae78d712e9439" args="()" -->
void </td><td class="memItemRight" valign="bottom"><b>init_constants</b> ()</td></tr>
<tr><td colspan="2"><br><h2>Protected Attributes</h2></td></tr>
<tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="6763c2f3f3813f505e19c54a6a8a2433"></a><!-- doxytag: member="sc::P86CFunctional::a_" ref="6763c2f3f3813f505e19c54a6a8a2433" args="" -->
double </td><td class="memItemRight" valign="bottom"><b>a_</b></td></tr>
<tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="ae8bf2d6d739f75ff62cb637e8d2ab77"></a><!-- doxytag: member="sc::P86CFunctional::C1_" ref="ae8bf2d6d739f75ff62cb637e8d2ab77" args="" -->
double </td><td class="memItemRight" valign="bottom"><b>C1_</b></td></tr>
<tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="4afae10f13dfd66b20de5470d579a265"></a><!-- doxytag: member="sc::P86CFunctional::C2_" ref="4afae10f13dfd66b20de5470d579a265" args="" -->
double </td><td class="memItemRight" valign="bottom"><b>C2_</b></td></tr>
<tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="d55f14b87ecc1405237ddfa5a18e0f0b"></a><!-- doxytag: member="sc::P86CFunctional::C3_" ref="d55f14b87ecc1405237ddfa5a18e0f0b" args="" -->
double </td><td class="memItemRight" valign="bottom"><b>C3_</b></td></tr>
<tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="39777e33fa2f43af49ed3576627e4600"></a><!-- doxytag: member="sc::P86CFunctional::C4_" ref="39777e33fa2f43af49ed3576627e4600" args="" -->
double </td><td class="memItemRight" valign="bottom"><b>C4_</b></td></tr>
<tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="eac5a80ae03e060a398335682ffa9f6c"></a><!-- doxytag: member="sc::P86CFunctional::C5_" ref="eac5a80ae03e060a398335682ffa9f6c" args="" -->
double </td><td class="memItemRight" valign="bottom"><b>C5_</b></td></tr>
<tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="88a7968662c45a787284da903378f5d7"></a><!-- doxytag: member="sc::P86CFunctional::C6_" ref="88a7968662c45a787284da903378f5d7" args="" -->
double </td><td class="memItemRight" valign="bottom"><b>C6_</b></td></tr>
<tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="6412c124cc7d24b5d4c6453c60239dd8"></a><!-- doxytag: member="sc::P86CFunctional::C7_" ref="6412c124cc7d24b5d4c6453c60239dd8" args="" -->
double </td><td class="memItemRight" valign="bottom"><b>C7_</b></td></tr>
</table>
<hr><a name="_details"></a><h2>Detailed Description</h2>
Implements the Perdew 1986 (P86) correlation functional.
<p>
J. P. Perdew, Phys. Rev. B, 33(12), pp. 8822-8824.<p>
J. P. Perdew, Phys. Rev. B. 34(10), pp. 7406. <hr><h2>Member Function Documentation</h2>
<a class="anchor" name="92b4da081ddcfdc4311c850446808daa"></a><!-- doxytag: member="sc::P86CFunctional::save_data_state" ref="92b4da081ddcfdc4311c850446808daa" args="(StateOut &)" -->
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<td class="memname">void sc::P86CFunctional::save_data_state </td>
<td>(</td>
<td class="paramtype"><a class="el" href="classsc_1_1StateOut.html">StateOut</a> & </td>
<td class="paramname"> </td>
<td> ) </td>
<td><code> [virtual]</code></td>
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<p>
Save the base classes (with save_data_state) and the members in the same order that the <a class="el" href="classsc_1_1StateIn.html" title="Restores objects that derive from SavableState.">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="classsc_1_1DenFunctional.html#d4eedef269673357cfe99e6267a235da">sc::DenFunctional</a>.</p>
</div>
</div><p>
<hr>The documentation for this class was generated from the following file:<ul>
<li><a class="el" href="functional_8h_source.html">functional.h</a></ul>
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i586
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contrib-release
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247b28499c443e092731ffba814075f2
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