qs_cdft_opt_types.F File Reference

#include "./base/base_uses.f90"

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Data Types
type	qs_cdft_opt_types::cdft_opt_type
	contains the parameters needed by CDFT specific optimizers More...

Modules
module	qs_cdft_opt_types
	Control parameters for optimizers that work with CDFT constraints.

Functions/Subroutines
subroutine, public	qs_cdft_opt_types::cdft_opt_type_create (cdft_opt_control)
	allocates and initializes the CDFT optimizer control object with default values
subroutine, public	qs_cdft_opt_types::cdft_opt_type_release (cdft_opt_control)
	releases the CDFT optimizer control object
subroutine, public	qs_cdft_opt_types::cdft_opt_type_read (cdft_opt_control, inp_section)
	reads the parameters of the CDFT optimizer type
subroutine, public	qs_cdft_opt_types::cdft_opt_type_write (cdft_opt_control, optimizer, output_unit)
	writes information about the CDFT optimizer object
subroutine, public	qs_cdft_opt_types::cdft_opt_type_copy (new, old)
	copies settings between two CDFT optimizer control objects retaining both