Implements a minimizer algorithm for SCF calculations. More...

Detailed Description

Implements a minimizer algorithm for SCF calculations.

Definition at line 128 of file minimizer_scf.F90.

Inheritance diagram for minimizer_scf_oct_m::minimizer_scf_t:

Private Member Functions
procedure	do_operation => minimizer_scf_do_operation

Additional Inherited Members
Public Attributes inherited from minimizer_algorithm_oct_m::minimizer_algorithm_t
class(system_t), pointer, public	system
	The system using this minimizer. More...

integer, public	max_iter
	Maximum number of iterations for self-consistent minimizers. More...

logical, public	converged = .false.

Public Attributes inherited from algorithm_oct_m::algorithm_t
type(algorithm_iterator_t), public	iter
	Iterator for algorithmic operations. More...

type(algorithmic_operation_t), public	start_operation
	algorithm specific initialization operation; More...

type(algorithmic_operation_t), public	final_operation
	algorithm specific finalization operation More...

integer, public	algo_steps
	Number of 'algorithmic steps' per algorithmic iteration. More...

type(iteration_counter_t), public	iteration
	Keep track at which iteration this algorithm is. More...

real(real64), public	elapsed_time = M_ZERO
	Elapsed wall clock time for printing info. More...

Public Attributes inherited from linked_list_oct_m::linked_list_t
integer, public	size = 0

Member Function/Subroutine Documentation

procedure minimizer_scf_oct_m::minimizer_scf_t::do_operation

private

Definition at line 131 of file minimizer_scf.F90.

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