sirius::davidson_result_t Struct Reference

Result of Davidson solver. More...

#include <davidson.hpp>

Public Attributes
int	niter
	Number of iterations. More...
sddk::mdarray< double, 2 >	eval
	Eigen-values. More...
bool	converged
	True if all bands (up and dn) are converged. More...
int	num_unconverged [2]
	Number of unconverged bands for each spin channel. More...

Detailed Description

Result of Davidson solver.

Definition at line 37 of file davidson.hpp.

Member Data Documentation

niter

int sirius::davidson_result_t::niter

Number of iterations.

Definition at line 39 of file davidson.hpp.

eval

sddk::mdarray<double, 2> sirius::davidson_result_t::eval

Eigen-values.

Definition at line 41 of file davidson.hpp.

converged

bool sirius::davidson_result_t::converged

True if all bands (up and dn) are converged.

Definition at line 43 of file davidson.hpp.

num_unconverged

int sirius::davidson_result_t::num_unconverged[2]

Number of unconverged bands for each spin channel.

Definition at line 45 of file davidson.hpp.

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

• davidson.hpp