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<div class="navpath"><b>sc</b>::<a class="el" href="classsc_1_1Int2eCCA.html">Int2eCCA</a>
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<h1>sc::Int2eCCA Class Reference</h1><!-- doxytag: class="sc::Int2eCCA" --><!-- doxytag: inherits="sc::RefCount" --><a class="el" href="classsc_1_1Int2eCCA.html" title="Int2eCCA adapts CCA integrals components for use within SC.">Int2eCCA</a> adapts CCA integrals components for use within SC.
<a href="#_details">More...</a>
<p>
<code>#include <<a class="el" href="intcca_2int2e_8h_source.html">int2e.h</a>></code>
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Inheritance diagram for sc::Int2eCCA:</div>
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<p><center><img src="classsc_1_1Int2eCCA.png" usemap="#sc::Int2eCCA_map" border="0" alt=""></center>
<map name="sc::Int2eCCA_map">
<area href="classsc_1_1RefCount.html" alt="sc::RefCount" shape="rect" coords="0,56,85,80">
<area href="classsc_1_1Identity.html" alt="sc::Identity" shape="rect" coords="0,0,85,24">
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<a href="classsc_1_1Int2eCCA-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="28d43f6999e67244092e7c8213f5d56c"></a><!-- doxytag: member="sc::Int2eCCA::Int2eCCA" ref="28d43f6999e67244092e7c8213f5d56c" args="(Integral *integral, const Ref< GaussianBasisSet > &b1, const Ref< GaussianBasisSet > &b2, const Ref< GaussianBasisSet > &b3, const Ref< GaussianBasisSet > &b4, int order, size_t storage, IntegralEvaluatorFactory, bool, string)" -->
</td><td class="memItemRight" valign="bottom"><b>Int2eCCA</b> (<a class="el" href="classsc_1_1Integral.html">Integral</a> *integral, const <a class="el" href="classsc_1_1Ref.html">Ref</a>< <a class="el" href="classsc_1_1GaussianBasisSet.html">GaussianBasisSet</a> > &b1, const <a class="el" href="classsc_1_1Ref.html">Ref</a>< <a class="el" href="classsc_1_1GaussianBasisSet.html">GaussianBasisSet</a> > &b2, const <a class="el" href="classsc_1_1Ref.html">Ref</a>< <a class="el" href="classsc_1_1GaussianBasisSet.html">GaussianBasisSet</a> > &b3, const <a class="el" href="classsc_1_1Ref.html">Ref</a>< <a class="el" href="classsc_1_1GaussianBasisSet.html">GaussianBasisSet</a> > &b4, int order, size_t storage, IntegralEvaluatorFactory, bool, string)</td></tr>
<tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="5f49087cf7bb3b8f36512f0ac1522567"></a><!-- doxytag: member="sc::Int2eCCA::buffer" ref="5f49087cf7bb3b8f36512f0ac1522567" args="()" -->
double * </td><td class="memItemRight" valign="bottom"><b>buffer</b> ()</td></tr>
<tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="591eaa9816c4e102c1f8951f7ce10382"></a><!-- doxytag: member="sc::Int2eCCA::compute_erep" ref="591eaa9816c4e102c1f8951f7ce10382" args="(int is, int js, int ks, int ls)" -->
void </td><td class="memItemRight" valign="bottom"><b>compute_erep</b> (int is, int js, int ks, int ls)</td></tr>
<tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="27cc96455c985dc32580b6a3e86f2ce1"></a><!-- doxytag: member="sc::Int2eCCA::compute_erep_1der" ref="27cc96455c985dc32580b6a3e86f2ce1" args="(int is, int js, int ks, int ls, Chemistry::QC::GaussianBasis::DerivCenters &dc)" -->
void </td><td class="memItemRight" valign="bottom"><b>compute_erep_1der</b> (int is, int js, int ks, int ls, Chemistry::QC::GaussianBasis::DerivCenters &dc)</td></tr>
<tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="e803a1dfe619837a7f4e233f67a0e91b"></a><!-- doxytag: member="sc::Int2eCCA::redundant" ref="e803a1dfe619837a7f4e233f67a0e91b" args="() const " -->
int </td><td class="memItemRight" valign="bottom"><b>redundant</b> () const </td></tr>
<tr><td class="memItemLeft" nowrap align="right" valign="top"><a class="anchor" name="83a75aa569979ee04706f42b9c9c6e7e"></a><!-- doxytag: member="sc::Int2eCCA::set_redundant" ref="83a75aa569979ee04706f42b9c9c6e7e" args="(int i)" -->
void </td><td class="memItemRight" valign="bottom"><b>set_redundant</b> (int i)</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="32c1b0876441628d132ce40287f0d367"></a><!-- doxytag: member="sc::Int2eCCA::integral_" ref="32c1b0876441628d132ce40287f0d367" args="" -->
<a class="el" href="classsc_1_1Integral.html">Integral</a> * </td><td class="memItemRight" valign="bottom"><b>integral_</b></td></tr>
</table>
<hr><a name="_details"></a><h2>Detailed Description</h2>
<a class="el" href="classsc_1_1Int2eCCA.html" title="Int2eCCA adapts CCA integrals components for use within SC.">Int2eCCA</a> adapts CCA integrals components for use within SC.
<p>
It is used by <a class="el" href="classsc_1_1TwoBodyIntCCA.html" title="This implements two body integrals through the CCA interface.">TwoBodyIntCCA</a> and <a class="el" href="classsc_1_1TwoBodyDerivIntCCA.html" title="This implements two body derivative integrals through the CCA interface.">TwoBodyDerivIntCCA</a> to implement the <a class="el" href="classsc_1_1IntegralCCA.html" title="IntegralCCA provides an SC client for CCA IntegralEvaluator components.">IntegralCCA</a> class. <hr>The documentation for this class was generated from the following file:<ul>
<li><a class="el" href="intcca_2int2e_8h_source.html">intcca/int2e.h</a></ul>
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Mandriva
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i586
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contrib-release
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files
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