qs_dftb_parameters Module Reference

Functions/Subroutines
subroutine, public	qs_dftb_param_init (atomic_kind_set, qs_kind_set, dftb_control, dftb_potential, subsys_section, para_env)
	...

Detailed Description

Author

JGH (27.02.2007)

Function/Subroutine Documentation

qs_dftb_param_init()

subroutine, public qs_dftb_parameters::qs_dftb_param_init	(	type(atomic_kind_type), dimension(:), pointer	atomic_kind_set,
		type(qs_kind_type), dimension(:), pointer	qs_kind_set,
		type(dftb_control_type), intent(inout)	dftb_control,
		type(qs_dftb_pairpot_type), dimension(:, :), pointer	dftb_potential,
		type(section_vals_type), pointer	subsys_section,
		type(mp_para_env_type), pointer	para_env
	)

...

Parameters

atomic_kind_set	...
qs_kind_set	...
dftb_control	...
dftb_potential	...
subsys_section	...
para_env	...

Definition at line 79 of file qs_dftb_parameters.F.

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