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SumDenFunctional Class Reference

The SumDenFunctional computes energies and densities using the a sum of energy density functions method. More...

#include <functional.h>

Inheritance diagram for SumDenFunctional

[legend]Collaboration diagram for SumDenFunctional:

[legend]List of all members.

Public Methods
	SumDenFunctional ()
	SumDenFunctional (const Ref< KeyVal > &)
	SumDenFunctional (StateIn &)
	~SumDenFunctional ()
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	set_spin_polarized (int)
void	set_compute_potential (int)
int	need_density_gradient ()
void	point (const PointInputData &, PointOutputData &)
void	print (std::ostream &=ExEnv::out()) const
	Print the object.
Protected Attributes
int	n_
Ref<DenFunctional>*	funcs_
double*	coefs_

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Detailed Description

The SumDenFunctional computes energies and densities using the a sum of energy density functions method.

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Member Function Documentation

void SumDenFunctional::save_data_state ( StateOut & s ) [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 DenFunctional. Reimplemented in StdDenFunctional.

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The documentation for this class was generated from the following file:

• functional.h

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