Main Page   Class Hierarchy   Compound List   File List   Compound Members   Related Pages  

sc::R12IntEval Class Reference

Class R12IntEval is the top-level R12 intermediate evaluator. More...

#include <vxb_eval.h>

Inheritance diagram for sc::R12IntEval:

Inheritance graph
[legend]
Collaboration diagram for sc::R12IntEval:

Collaboration graph
[legend]
List of all members.

Public Methods

 R12IntEval (StateIn &)
 R12IntEval (MBPT2_R12 *)
 ~R12IntEval ()
void save_data_state (StateOut &)
 Save the base classes (with save_data_state) and the members in the same order that the StateIn CTOR initializes them. More...

void obsolete ()
 Makes the evaluator obsolete, the next call to compute() will cause the intermediates to be recomputed.

void set_stdapprox (LinearR12::StandardApproximation stdapprox)
void set_spinadapted (bool spinadapted)
void set_debug (int debug)
void set_dynamic (bool dynamic)
void set_memory (size_t nbytes)
Ref< R12IntEvalInfor12info () const
RefSCDimension dim_aa () const
RefSCDimension dim_ab () const
RefSCDimension dim_s () const
RefSCDimension dim_t () const
RefSCMatrix V_aa ()
RefSCMatrix X_aa ()
RefSCMatrix B_aa ()
RefSCMatrix V_ab ()
RefSCMatrix X_ab ()
RefSCMatrix B_ab ()
RefSCVector emp2_aa ()
RefSCVector emp2_ab ()
void compute ()
RefDiagSCMatrix evals () const

Detailed Description

Class R12IntEval is the top-level R12 intermediate evaluator.


Member Function Documentation

void sc::R12IntEval::save_data_state StateOut   [virtual]
 

Save the base classes (with save_data_state) and the members in the same order that the StateIn CTOR initializes them.

This must be implemented by the derived class if the class has data.

Reimplemented from sc::SavableState.


The documentation for this class was generated from the following file:
Generated at Fri Dec 26 11:19:37 2003 for MPQC 2.2.1 using the documentation package Doxygen 1.2.14.