Sophie

Sophie

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mpqc-2.1.2-4mdk.ppc.rpm

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<hr><h1>sc::DenIntegrator Member List</h1>This is the complete list of members for <a class="el" href="class_sc__DenIntegrator.html">sc::DenIntegrator</a>, including all inherited members.<ul>
<li><b>accuracy_</b> (defined in <a class="el" href="class_sc__DenIntegrator.html">sc::DenIntegrator</a>)<code> [protected]</code><li><b>alpha_dmat_</b> (defined in <a class="el" href="class_sc__DenIntegrator.html">sc::DenIntegrator</a>)<code> [protected]</code><li><a class="el" href="class_sc__DenIntegrator.html#a10">alpha_vmat</a>() const
<code> [inline]</code><li><b>alpha_vmat_</b> (defined in <a class="el" href="class_sc__DenIntegrator.html">sc::DenIntegrator</a>)<code> [protected]</code><li><b>beta_dmat_</b> (defined in <a class="el" href="class_sc__DenIntegrator.html">sc::DenIntegrator</a>)<code> [protected]</code><li><a class="el" href="class_sc__DenIntegrator.html#a11">beta_vmat</a>() const
<code> [inline]</code><li><b>beta_vmat_</b> (defined in <a class="el" href="class_sc__DenIntegrator.html">sc::DenIntegrator</a>)<code> [protected]</code><li><a class="el" href="class_sc__DescribedClass.html#a4">class_desc</a>() const
<li><a class="el" href="class_sc__DescribedClass.html#a5">class_name</a>() const
<li><a class="el" href="class_sc__DescribedClass.html#a6">class_version</a>() const
<li><b>compute_potential_integrals_</b> (defined in <a class="el" href="class_sc__DenIntegrator.html">sc::DenIntegrator</a>)<code> [protected]</code><li><a class="el" href="class_sc__DenIntegrator.html#a0">DenIntegrator</a>()
<li><a class="el" href="class_sc__DenIntegrator.html#a1">DenIntegrator</a>(const Ref&lt; KeyVal &gt; &amp;)
<li><a class="el" href="class_sc__DenIntegrator.html#a2">DenIntegrator</a>(StateIn &amp;)
<li><b>density_</b> (defined in <a class="el" href="class_sc__DenIntegrator.html">sc::DenIntegrator</a>)<code> [protected]</code><li><a class="el" href="class_sc__RefCount.html#a6">dereference</a>()
<code> [inline]</code><li><b>DescribedClass</b>() (defined in <a class="el" href="class_sc__DescribedClass.html">sc::DescribedClass</a>)<li><b>DescribedClass</b>(const DescribedClass &amp;) (defined in <a class="el" href="class_sc__DescribedClass.html">sc::DescribedClass</a>)<li><b>dir_restore_state</b>(StateIn &amp;si, const char *objectname, const char *keyword=0) (defined in <a class="el" href="class_sc__SavableState.html">sc::SavableState</a>)<code> [static]</code><li><b>dmat_bound_</b> (defined in <a class="el" href="class_sc__DenIntegrator.html">sc::DenIntegrator</a>)<code> [protected]</code><li><a class="el" href="class_sc__DenIntegrator.html#a13">done</a>()
<code> [virtual]</code><li><b>done_integration</b>() (defined in <a class="el" href="class_sc__DenIntegrator.html">sc::DenIntegrator</a>)<code> [protected]</code><li><b>extent_</b> (defined in <a class="el" href="class_sc__DenIntegrator.html">sc::DenIntegrator</a>)<code> [protected]</code><li><b>get_accuracy</b>(void) (defined in <a class="el" href="class_sc__DenIntegrator.html">sc::DenIntegrator</a>)<code> [inline]</code><li><a class="el" href="class_sc__Identity.html#a1">identifier</a>()
<code> [inline]</code><li><a class="el" href="class_sc__DenIntegrator.html#a12">init</a>(const Ref&lt; Wavefunction &gt; &amp;)
<code> [virtual]</code><li><b>init_integration</b>(const Ref&lt; DenFunctional &gt; &amp;func, const RefSymmSCMatrix &amp;densa, const RefSymmSCMatrix &amp;densb, double *nuclear_gradient) (defined in <a class="el" href="class_sc__DenIntegrator.html">sc::DenIntegrator</a>)<code> [protected]</code><li><b>init_object</b>() (defined in <a class="el" href="class_sc__DenIntegrator.html">sc::DenIntegrator</a>)<code> [protected]</code><li><a class="el" href="class_sc__DenIntegrator.html#a14">integrate</a>(const Ref&lt; DenFunctional &gt; &amp;, const RefSymmSCMatrix &amp;densa=0, const RefSymmSCMatrix &amp;densb=0, double *nuclear_grad=0)=0
<code> [pure virtual]</code><li><a class="el" href="class_sc__SavableState.html#d2">key_restore_state</a>(StateIn &amp;si, const char *keyword)
<code> [static]</code><li><b>linear_scaling_</b> (defined in <a class="el" href="class_sc__DenIntegrator.html">sc::DenIntegrator</a>)<code> [protected]</code><li><a class="el" href="class_sc__RefCount.html#a1">lock_ptr</a>() const
<li><a class="el" href="class_sc__RefCount.html#a7">managed</a>() const
<code> [inline]</code><li><a class="el" href="class_sc__RefCount.html#a9">managed</a>() const
<code> [inline]</code><li><b>messagegrp_</b> (defined in <a class="el" href="class_sc__DenIntegrator.html">sc::DenIntegrator</a>)<code> [protected]</code><li><b>natom_</b> (defined in <a class="el" href="class_sc__DenIntegrator.html">sc::DenIntegrator</a>)<code> [protected]</code><li><b>nbasis_</b> (defined in <a class="el" href="class_sc__DenIntegrator.html">sc::DenIntegrator</a>)<code> [protected]</code><li><b>need_density_</b> (defined in <a class="el" href="class_sc__DenIntegrator.html">sc::DenIntegrator</a>)<code> [protected]</code><li><a class="el" href="class_sc__RefCount.html#a4">nreference</a>() const
<code> [inline]</code><li><b>nshell_</b> (defined in <a class="el" href="class_sc__DenIntegrator.html">sc::DenIntegrator</a>)<code> [protected]</code><li><b>operator=</b>(const SavableState &amp;) (defined in <a class="el" href="class_sc__SavableState.html">sc::SavableState</a>)<li><b>operator=</b>(const DescribedClass &amp;) (defined in <a class="el" href="class_sc__DescribedClass.html">sc::DescribedClass</a>)<li><b>operator=</b>(const RefCount &amp;) (defined in <a class="el" href="class_sc__RefCount.html">sc::RefCount</a>)<code> [inline, protected]</code><li><a class="el" href="class_sc__DescribedClass.html#a7">print</a>(std::ostream &amp;=ExEnv::out0()) const
<code> [virtual]</code><li><b>RefCount</b>() (defined in <a class="el" href="class_sc__RefCount.html">sc::RefCount</a>)<code> [inline, protected]</code><li><b>RefCount</b>(const RefCount &amp;) (defined in <a class="el" href="class_sc__RefCount.html">sc::RefCount</a>)<code> [inline, protected]</code><li><a class="el" href="class_sc__RefCount.html#a5">reference</a>()
<code> [inline]</code><li><a class="el" href="class_sc__SavableState.html#d1">restore_state</a>(StateIn &amp;si)
<code> [static]</code><li><b>SavableState</b>() (defined in <a class="el" href="class_sc__SavableState.html">sc::SavableState</a>)<code> [protected]</code><li><b>SavableState</b>(const SavableState &amp;) (defined in <a class="el" href="class_sc__SavableState.html">sc::SavableState</a>)<code> [protected]</code><li><a class="el" href="class_sc__SavableState.html#b2">SavableState</a>(StateIn &amp;)
<code> [protected]</code><li><a class="el" href="class_sc__DenIntegrator.html#a4">save_data_state</a>(StateOut &amp;)
<code> [virtual]</code><li><a class="el" href="class_sc__SavableState.html#a3">save_object_state</a>(StateOut &amp;)
<li><a class="el" href="class_sc__SavableState.html#a2">save_state</a>(StateOut &amp;)
<li><b>save_state</b>(SavableState *s, StateOut &amp;) (defined in <a class="el" href="class_sc__SavableState.html">sc::SavableState</a>)<code> [static]</code><li><a class="el" href="class_sc__SavableState.html#a4">save_vbase_state</a>(StateOut &amp;)
<code> [virtual]</code><li><a class="el" href="class_sc__DenIntegrator.html#a7">set_accuracy</a>(double a)
<code> [inline]</code><li><a class="el" href="class_sc__DenIntegrator.html#a9">set_compute_potential_integrals</a>(int)
<li><b>spin_polarized_</b> (defined in <a class="el" href="class_sc__DenIntegrator.html">sc::DenIntegrator</a>)<code> [protected]</code><li><b>threadgrp_</b> (defined in <a class="el" href="class_sc__DenIntegrator.html">sc::DenIntegrator</a>)<code> [protected]</code><li><a class="el" href="class_sc__RefCount.html#a2">unlock_ptr</a>() const
<li><a class="el" href="class_sc__RefCount.html#a8">unmanage</a>()
<code> [inline]</code><li><b>use_dmat_bound_</b> (defined in <a class="el" href="class_sc__DenIntegrator.html">sc::DenIntegrator</a>)<code> [protected]</code><li><a class="el" href="class_sc__RefCount.html#a3">use_locks</a>(bool inVal)
<li><a class="el" href="class_sc__DenIntegrator.html#a6">value</a>() const
<code> [inline]</code><li><b>value_</b> (defined in <a class="el" href="class_sc__DenIntegrator.html">sc::DenIntegrator</a>)<code> [protected]</code><li><a class="el" href="class_sc__DenIntegrator.html#a5">wavefunction</a>() const
<code> [inline]</code><li><b>wfn_</b> (defined in <a class="el" href="class_sc__DenIntegrator.html">sc::DenIntegrator</a>)<code> [protected]</code><li><b>~DenIntegrator</b>() (defined in <a class="el" href="class_sc__DenIntegrator.html">sc::DenIntegrator</a>)<li><b>~DescribedClass</b>() (defined in <a class="el" href="class_sc__DescribedClass.html">sc::DescribedClass</a>)<code> [virtual]</code><li><b>~Identity</b>() (defined in <a class="el" href="class_sc__Identity.html">sc::Identity</a>)<code> [virtual]</code><li><b>~RefCount</b>() (defined in <a class="el" href="class_sc__RefCount.html">sc::RefCount</a>)<code> [virtual]</code><li><b>~SavableState</b>() (defined in <a class="el" href="class_sc__SavableState.html">sc::SavableState</a>)<code> [virtual]</code></ul>
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