Builds the two-body part of the Fock matrix in AO basis using DF-based algorithm. More...

Inheritance diagram for sc::TwoBodyFockMatrixDFBuilder:

Public Member Functions
	TwoBodyFockMatrixDFBuilder (bool compute_F, bool compute_J, bool compute_K, const Ref< GaussianBasisSet > &brabasis, const Ref< GaussianBasisSet > &ketbasis, const Ref< GaussianBasisSet > &densitybasis, const RefSymmSCMatrix &density, const RefSymmSCMatrix &openshelldensity, const Ref< DensityFittingInfo > &df_info, const Ref< FockBuildRuntime::PSqrtRegistry > &psqrtregistry)

const ResultType &	F (unsigned int t=0) const

const ResultType &	J (unsigned int t=0) const

const ResultType &	K (unsigned int t=0) const

ResultType	F (SpinCase1 spin) const

ResultType	K (SpinCase1 spin) const

Public Member Functions inherited from sc::RefCount
size_t	identifier () const
	Return the unique identifier for this object that can be compared for different objects of different types. More...

int	lock_ptr () const
	Lock this object.

int	unlock_ptr () const
	Unlock this object.

void	use_locks (bool inVal)
	start and stop using locks on this object

refcount_t	nreference () const
	Return the reference count.

refcount_t	reference ()
	Increment the reference count and return the new count.

refcount_t	dereference ()
	Decrement the reference count and return the new count.

int	managed () const

void	unmanage ()
	Turn off the reference counting mechanism for this object. More...

Additional Inherited Members
Protected Member Functions inherited from sc::RefCount
	RefCount (const RefCount &)

RefCount &	operator= (const RefCount &)

Detailed Description

Builds the two-body part of the Fock matrix in AO basis using DF-based algorithm.

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

Public Member Functions