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<hr><h1>sc::SphericalTransformComponent Class Reference</h1>This is a base class for a container for a component of a sparse Cartesian to solid harmonic basis function transformation.
<a href="#_details">More...</a>
<p>
<code>#include <<a class="el" href="chemistry_qc_basis_transform_h-source.html">transform.h</a>></code>
<p>
Inheritance diagram for sc::SphericalTransformComponent<p><center><img src="class_sc__SphericalTransformComponent_inherit_graph.gif" border="0" usemap="#sc::SphericalTransformComponent_inherit_map" alt="Inheritance graph"></center>
<map name="sc::SphericalTransformComponent_inherit_map">
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<center><font size="2">[<a href="graph_legend.html">legend</a>]</font></center><a href="class_sc__SphericalTransformComponent-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::SphericalTransformComponent::a"></a>
int </td><td valign=bottom><a class="el" href="class_sc__SphericalTransformComponent.html#a0">a</a> () const</td></tr>
<tr><td> </td><td><font size=-1><em>Returns the exponent of x.</em></font><br><br></td></tr>
<tr><td nowrap align=right valign=top><a name="a1" doxytag="sc::SphericalTransformComponent::b"></a>
int </td><td valign=bottom><a class="el" href="class_sc__SphericalTransformComponent.html#a1">b</a> () const</td></tr>
<tr><td> </td><td><font size=-1><em>Returns the exponent of y.</em></font><br><br></td></tr>
<tr><td nowrap align=right valign=top><a name="a2" doxytag="sc::SphericalTransformComponent::c"></a>
int </td><td valign=bottom><a class="el" href="class_sc__SphericalTransformComponent.html#a2">c</a> () const</td></tr>
<tr><td> </td><td><font size=-1><em>Returns the exponent of z.</em></font><br><br></td></tr>
<tr><td nowrap align=right valign=top><a name="a3" doxytag="sc::SphericalTransformComponent::cartindex"></a>
int </td><td valign=bottom><a class="el" href="class_sc__SphericalTransformComponent.html#a3">cartindex</a> () const</td></tr>
<tr><td> </td><td><font size=-1><em>Returns the index of the Cartesian basis function.</em></font><br><br></td></tr>
<tr><td nowrap align=right valign=top><a name="a4" doxytag="sc::SphericalTransformComponent::pureindex"></a>
int </td><td valign=bottom><a class="el" href="class_sc__SphericalTransformComponent.html#a4">pureindex</a> () const</td></tr>
<tr><td> </td><td><font size=-1><em>Returns the index solid harmonic basis function.</em></font><br><br></td></tr>
<tr><td nowrap align=right valign=top><a name="a5" doxytag="sc::SphericalTransformComponent::coef"></a>
double </td><td valign=bottom><a class="el" href="class_sc__SphericalTransformComponent.html#a5">coef</a> () const</td></tr>
<tr><td> </td><td><font size=-1><em>Returns the coefficient of this component of the transformation.</em></font><br><br></td></tr>
<tr><td nowrap align=right valign=top>virtual void </td><td valign=bottom><a class="el" href="class_sc__SphericalTransformComponent.html#a6">init</a> (int a, int b, int c, double coef, int pureindex)=0</td></tr>
<tr><td> </td><td><font size=-1><em>Initialize this object.</em> <a href="#a6">More...</a><em></em></font><br><br></td></tr>
<tr><td colspan=2><br><h2>Protected Attributes</h2></td></tr>
<tr><td nowrap align=right valign=top><a name="n0" doxytag="sc::SphericalTransformComponent::coef_"></a>
double </td><td valign=bottom><b>coef_</b></td></tr>
<tr><td nowrap align=right valign=top><a name="n1" doxytag="sc::SphericalTransformComponent::a_"></a>
int </td><td valign=bottom><b>a_</b></td></tr>
<tr><td nowrap align=right valign=top><a name="n2" doxytag="sc::SphericalTransformComponent::b_"></a>
int </td><td valign=bottom><b>b_</b></td></tr>
<tr><td nowrap align=right valign=top><a name="n3" doxytag="sc::SphericalTransformComponent::c_"></a>
int </td><td valign=bottom><b>c_</b></td></tr>
<tr><td nowrap align=right valign=top><a name="n4" doxytag="sc::SphericalTransformComponent::cartindex_"></a>
int </td><td valign=bottom><b>cartindex_</b></td></tr>
<tr><td nowrap align=right valign=top><a name="n5" doxytag="sc::SphericalTransformComponent::pureindex_"></a>
int </td><td valign=bottom><b>pureindex_</b></td></tr>
</table>
<hr><a name="_details"></a><h2>Detailed Description</h2>
This is a base class for a container for a component of a sparse Cartesian to solid harmonic basis function transformation.
<p>
<hr><h2>Member Function Documentation</h2>
<a name="a6" doxytag="sc::SphericalTransformComponent::init"></a><p>
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<td class="md">
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<td nowrap valign="top"><b>
void sc::SphericalTransformComponent::init (
</b></td>
<td valign="bottom"><b>
int <em>a</em>,
</b></td>
</tr>
<tr>
<td></td>
<td><b>
int <em>b</em>,
</b></td>
</tr>
<tr>
<td></td>
<td><b>
int <em>c</em>,
</b></td>
</tr>
<tr>
<td></td>
<td><b>
double <em>coef</em>,
</b></td>
</tr>
<tr>
<td></td>
<td><b>
int <em>pureindex</em> )<code> [pure virtual]</code>
</b></td>
</tr>
</table>
</td>
</tr>
</table>
<table cellspacing=5 cellpadding=0 border=0>
<tr>
<td>
</td>
<td>
<p>
Initialize this object.
<p>
This must be provided in all specializations of this class to establish the ordering between a, b and c and the index of the Cartesian basis function. Other things such as adjustment of the coefficient to account for normalization differences can be done as well. The default <a class="el" href="class_sc__SphericalTransform.html#b2">SphericalTransform::init</a>() implementation requires that only the x<sup>l</sup>, y<sup>l</sup> and z<sup>l</sup> basis functions are normalized to unity. </td>
</tr>
</table>
<hr>The documentation for this class was generated from the following file:<ul>
<li><a class="el" href="chemistry_qc_basis_transform_h-source.html">chemistry/qc/basis/transform.h</a></ul>
<hr>
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