DIISManagerUnrestricted Class Reference

#include <diis_unrestricted.h>

Inheritance diagram for DIISManagerUnrestricted:

List of all members.

Public Member Functions
	DIISManagerUnrestricted ()
	~DIISManagerUnrestricted ()
int	AddIterationToList (symmMatrix &F_alpha, symmMatrix &F_beta, normalMatrix &E_alpha, normalMatrix &E_beta)
int	ClearList ()
int	GetCombinedFockMatrices (symmMatrix &result_alpha, symmMatrix &result_beta)

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Constructor & Destructor Documentation

DIISManagerUnrestricted::DIISManagerUnrestricted

(

)

DIISManagerUnrestricted::~DIISManagerUnrestricted

(

)

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Member Function Documentation

int DIISManagerUnrestricted::AddIterationToList	(	symmMatrix &	F_alpha,
		symmMatrix &	F_beta,
		normalMatrix &	E_alpha,
		normalMatrix &	E_beta
	)

int DIISManagerUnrestricted::ClearList

(

)

int DIISManagerUnrestricted::GetCombinedFockMatrices	(	symmMatrix &	result_alpha,
		symmMatrix &	result_beta
	)

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

• source/scf/diis_unrestricted.h
• source/scf/diis_unrestricted.cc

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