madness::ExchangeCommutator::KffKResult Struct Reference

#include <exchange_commutator.h>

Public Attributes
std::string	algo
	"6d" / "lrf" / "lrf-direct" / "lrf-split-alpha"
std::vector< CCPairFunction< double, 6 > >	fK
	f₁₂ K̂ | i j ⟩
std::vector< CCPairFunction< double, 6 > >	Kf
	K̂ f₁₂ | i j ⟩
std::vector< CCPairFunction< double, 6 > >	KffK
	[K̂, f₁₂] | i j ⟩ = Kf − fK (signs baked in)
double	mem_gb = 0.0
	combined size of pair factors (GByte)
long	rank = 0
	combined LRF rank (0 for 6D)
double	t_wall = 0.0
	wall time (s)

Detailed Description

Uniform result envelope for every algorithm path. Each "piece" may be empty when the algorithm only produces the combined commutator (e.g. lrf-split-alpha constructs KffK directly).

Member Data Documentation

algo

std::string madness::ExchangeCommutator::KffKResult::algo

"6d" / "lrf" / "lrf-direct" / "lrf-split-alpha"

Referenced by madness::CCPotentials::apply_KffK(), madness::ExchangeCommutator::apply_KffK_6d(), madness::ExchangeCommutator::apply_KffK_lowrank_split_alpha(), and madness::ExchangeCommutator::apply_KffK_lowrank_three_range().

fK

std::vector<CCPairFunction<double, 6> > madness::ExchangeCommutator::KffKResult::fK

f₁₂ K̂ | i j ⟩

Referenced by madness::CCPotentials::apply_KffK(), madness::ExchangeCommutator::apply_KffK_6d(), madness::ExchangeCommutator::apply_KffK_lowrank_split_alpha(), and madness::ExchangeCommutator::apply_KffK_lowrank_three_range().

Kf

std::vector<CCPairFunction<double, 6> > madness::ExchangeCommutator::KffKResult::Kf

K̂ f₁₂ | i j ⟩

Referenced by madness::CCPotentials::apply_KffK(), madness::ExchangeCommutator::apply_KffK_6d(), madness::ExchangeCommutator::apply_KffK_lowrank_split_alpha(), and madness::ExchangeCommutator::apply_KffK_lowrank_three_range().

KffK

std::vector<CCPairFunction<double, 6> > madness::ExchangeCommutator::KffKResult::KffK

[K̂, f₁₂] | i j ⟩ = Kf − fK (signs baked in)

Referenced by madness::CCPotentials::apply_KffK(), madness::ExchangeCommutator::apply_KffK_6d(), madness::ExchangeCommutator::apply_KffK_lowrank_split_alpha(), and madness::ExchangeCommutator::apply_KffK_lowrank_three_range().

mem_gb

double madness::ExchangeCommutator::KffKResult::mem_gb = 0.0

combined size of pair factors (GByte)

rank

long madness::ExchangeCommutator::KffKResult::rank = 0

combined LRF rank (0 for 6D)

Referenced by madness::ExchangeCommutator::apply_KffK_lowrank_split_alpha(), and madness::ExchangeCommutator::apply_KffK_lowrank_three_range().

t_wall

double madness::ExchangeCommutator::KffKResult::t_wall = 0.0

wall time (s)

Referenced by madness::ExchangeCommutator::apply_KffK_6d(), madness::ExchangeCommutator::apply_KffK_lowrank_split_alpha(), and madness::ExchangeCommutator::apply_KffK_lowrank_three_range().

---

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

• exchange_commutator.h