sc::EriCints Class Reference

EriCints is a specialization of Int2eCints that computes electron repulsion integrals. More...

#include <chemistry/qc/cints/eri.h>

Inheritance diagram for sc::EriCints:

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List of all members.

Public Member Functions
	EriCints (Integral *, const Ref< GaussianBasisSet > &, const Ref< GaussianBasisSet > &, const Ref< GaussianBasisSet > &, const Ref< GaussianBasisSet > &, size_t storage)
double *	buffer (unsigned int t) const
	Returns the location of the buffer with target integrals.
void	compute_quartet (int *, int *, int *, int *)
	Evaluate the target quartet of integrals.
Static Public Member Functions
static size_t	storage_required (const Ref< GaussianBasisSet > &b1, const Ref< GaussianBasisSet > &b2=0, const Ref< GaussianBasisSet > &b3=0, const Ref< GaussianBasisSet > &b4=0)

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Detailed Description

EriCints is a specialization of Int2eCints that computes electron repulsion integrals.

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

• src/lib/chemistry/qc/cints/eri.h