VRR Recurrence Relation for 1-e overlap integrals. More...
#include <vrr_1_onep_1.h>
Inheritance diagram for libint2::VRR_1_Overlap_1< BFSet, where >:
Collaboration diagram for libint2::VRR_1_Overlap_1< BFSet, where >:
Public Types | |
| typedef VRR_1_Overlap_1 | ThisType |
| typedef BFSet | BasisFunctionType |
| typedef GenIntegralSet_1_1< BFSet, OverlapOper, EmptySet > | TargetType |
| typedef GenericRecurrenceRelation< ThisType, BFSet, TargetType > | ParentType |
 Public Types inherited from libint2::GenericRecurrenceRelation< VRR_1_Overlap_1< BFSet, where >, BFSet, GenIntegralSet_1_1< BFSet, OverlapOper, EmptySet > > | |
| typedef BFSet | BasisFunctionType |
| typedef GenIntegralSet_1_1< BFSet, OverlapOper, EmptySet > | TargetType |
| typedef RecurrenceRelation | ParentType |
| typedef ParentType::ExprType | ExprType |
| Public Types inherited from libint2::RecurrenceRelation | |
| typedef RecurrenceRelation | this_type |
| typedef AlgebraicOperator< DGVertex > | ExprType |
| Numerical expression of a recurrence relation is always expressed as an AlgebraicOperator<DGVertex> | |
Static Public Member Functions | |
| static bool | directional () |
| Default directionality. | |
| static std::shared_ptr< RRImpl > | Instance (const std::shared_ptr< TargetType > &Tint, unsigned int dir) |
| Return an instance if applicable, or a null pointer otherwise. | |
| Static Public Member Functions inherited from libint2::GenericRecurrenceRelation< VRR_1_Overlap_1< BFSet, where >, BFSet, GenIntegralSet_1_1< BFSet, OverlapOper, EmptySet > > | |
| static std::shared_ptr< VRR_1_Overlap_1< BFSet, where > > | Instance (const std::shared_ptr< TargetType > &Tint, unsigned int dir) |
| Return an instance if applicable, or a null pointer otherwise. | |
Static Public Attributes | |
| static const unsigned int | max_nchildren = 9 |
Friends | |
| class | GenericRecurrenceRelation< ThisType, BFSet, TargetType > |
Additional Inherited Members | |
| Public Member Functions inherited from libint2::GenericRecurrenceRelation< VRR_1_Overlap_1< BFSet, where >, BFSet, GenIntegralSet_1_1< BFSet, OverlapOper, EmptySet > > | |
| unsigned int | num_children () const override |
| Implementation of RecurrenceRelation::num_children() | |
| std::shared_ptr< DGVertex > | rr_target () const override |
| Implementation of RecurrenceRelation::rr_target() | |
| std::shared_ptr< DGVertex > | rr_child (unsigned int i) const override |
| Implementation of RecurrenceRelation::rr_child() | |
| std::string | generate_label () const override |
| Implementation of RecurrenceRelation::generate_label() | |
| Public Member Functions inherited from libint2::RecurrenceRelation | |
| const std::shared_ptr< ExprType > & | rr_expr () const |
| Returns the expression. | |
| virtual bool | invariant_type () const |
| Returns true is the type of target and all children are exactly the same. | |
| virtual int | partindex_direction () const |
| virtual BraketDirection | braket_direction () const |
| size_t | size_of_children () const |
| const std::string & | label () const |
| label() returns a unique, short, descriptive label of this RR (e.g. | |
| virtual std::string | description () const |
| description() returns a verbose description of this RR | |
| virtual void | generate_code (const std::shared_ptr< CodeContext > &context, const std::shared_ptr< ImplicitDimensions > &dims, const std::string &funcname, std::ostream &decl, std::ostream &def) |
| Generate declaration and definition for the recurrence relation. | |
| virtual void | generate_generic_code (const std::shared_ptr< CodeContext > &context, const std::shared_ptr< ImplicitDimensions > &dims, const std::string &funcname, std::ostream &decl, std::ostream &def) |
| Generate declaration and definition for the recurrence relation using generic code (typically, a manually written code) | |
| virtual std::string | spfunction_call (const std::shared_ptr< CodeContext > &context, const std::shared_ptr< ImplicitDimensions > &dims) const |
| Generate a callback for this recurrence relation. | |
| unsigned int | nflops () const |
| Return the number of FLOPs per this recurrence relation. | |
| void | inst_id (const SingletonStack< RecurrenceRelation, std::string >::InstanceID &i) |
| RecurrenceRelation is managed by SingletonStack but doesn't need to keep track of instance ID. | |
| Protected Member Functions inherited from libint2::GenericRecurrenceRelation< VRR_1_Overlap_1< BFSet, where >, BFSet, GenIntegralSet_1_1< BFSet, OverlapOper, EmptySet > > | |
| GenericRecurrenceRelation (const std::shared_ptr< TargetType > &Tint, unsigned int dir) | |
| unsigned int | dir () const |
| const std::shared_ptr< DGVertex > & | add_child (const std::shared_ptr< DGVertex > &child) |
| add child | |
| const std::shared_ptr< DGVertex > & | make_child (const typename RealChildType::BasisFunctionType &A, const typename RealChildType::BasisFunctionType &B, const typename RealChildType::BasisFunctionType &C, const typename RealChildType::BasisFunctionType &D, const typename RealChildType::AuxIndexType &aux=typename RealChildType::AuxIndexType(), const typename RealChildType::OperType &oper=typename RealChildType::OperType()) |
| make_child should really looks something like this, but gcc 4.3.0 craps out TODO test is this works | |
| Protected Member Functions inherited from libint2::RecurrenceRelation | |
| void | add_expr (const std::shared_ptr< ExprType > &a, int minus=1) |
| Adds a (or -a, if minus = -1) to expr_. | |
| template<class RR > | |
| bool | register_with_rrstack () |
| Registers with the stack. | |
| Static Protected Member Functions inherited from libint2::GenericRecurrenceRelation< VRR_1_Overlap_1< BFSet, where >, BFSet, GenIntegralSet_1_1< BFSet, OverlapOper, EmptySet > > | |
| static bool | default_directional () |
| is this recurrence relation parameterized by a direction (x, y, or z). | |
| Protected Attributes inherited from libint2::GenericRecurrenceRelation< VRR_1_Overlap_1< BFSet, where >, BFSet, GenIntegralSet_1_1< BFSet, OverlapOper, EmptySet > > | |
| std::shared_ptr< TargetType > | target_ |
| Protected Attributes inherited from libint2::RecurrenceRelation | |
| unsigned int | nflops_ |
| std::string | label_ |
| std::shared_ptr< ExprType > | expr_ |
Detailed Description
template<class BFSet, FunctionPosition where>
class libint2::VRR_1_Overlap_1< BFSet, where >
class libint2::VRR_1_Overlap_1< BFSet, where >
VRR Recurrence Relation for 1-e overlap integrals.
- Template Parameters
-
where specifies whether angular momentum is decreased, in bra or ket.
The documentation for this class was generated from the following file:
