occ::qm::cc::CCSDResult Struct Reference

#include <ccsd.h>

Public Attributes
double	e_corr {0.0}
Eigen::Tensor< double, 2 >	t1
	(nocc x nvir)
Eigen::Tensor< double, 4 >	t2
	(nocc x nocc x nvir x nvir)
int	iterations {0}
bool	converged {false}

Member Data Documentation

converged

bool occ::qm::cc::CCSDResult::converged {false}

e_corr

double occ::qm::cc::CCSDResult::e_corr {0.0}

iterations

int occ::qm::cc::CCSDResult::iterations {0}

t1

Eigen::Tensor<double, 2> occ::qm::cc::CCSDResult::t1

(nocc x nvir)

t2

Eigen::Tensor<double, 4> occ::qm::cc::CCSDResult::t2

(nocc x nocc x nvir x nvir)

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

• /home/runner/work/occ/occ/include/occ/qm/cc/ccsd.h