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

CLHF Class Reference

CLHF is a Hartree-Fock specialization of CLSCF. More...

#include <clhf.h>

Inheritance diagram for CLHF:

CLSCF SCF OneBodyWavefunction Wavefunction MolecularEnergy Function SavableState Compute DescribedClass RefCount Identity List of all members.

Public Methods

 CLHF (StateIn &)
 CLHF (const Ref< KeyVal > &)
 ~CLHF ()
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 print (std::ostream &o=ExEnv::out()) const
 Print information about the object.

void two_body_energy (double &ec, double &ex)
int value_implemented () const
 Information about the availability of values, gradients, and hessians.

int gradient_implemented () const

Protected Methods

void ao_fock (double accuracy)
void two_body_deriv (double *)

Detailed Description

CLHF is a Hartree-Fock specialization of CLSCF.


Member Function Documentation

void CLHF::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 CLSCF.


The documentation for this class was generated from the following file:
Generated at Sat Nov 9 12:43:32 2002 for MPQC 2.0.4 using the documentation package Doxygen 1.2.15.