set of type/routines to handle the storage of results in force_envs More...

Classes
struct	cp_result_value_type
	low level type for storing real informations More...
struct	cp_result_value_p_type
struct	cp_result_type
	contains arbitrary information which need to be stored More...
struct	cp_result_p_type
Functions
subroutine, public	cp_result_create (results, error)
	Allocates and intitializes the cp_result.
subroutine, public	cp_result_release (results, error)
	Releases cp_result type.
subroutine, public	cp_result_clean (results, error)
	Releases cp_result clean.
subroutine, public	cp_result_retain (results, error)
	Retains cp_result type.
subroutine, public	cp_result_value_create (value, error)
	Allocates and intitializes the cp_result_value type.
subroutine, public	cp_result_value_init (value, type_in_use, size_value, error)
	Setup of the cp_result_value type.
subroutine, public	cp_result_value_release (value, error)
	Releases the cp_result_value type.
subroutine, public	cp_result_copy (results_in, results_out, error)
	Copies the cp_result type.
subroutine, public	cp_result_value_copy (value_out, value_in, error)
	Copies the cp_result_value type.
subroutine, public	cp_result_value_p_reallocate (result_value, istart, iend, error)
	Reallocates the cp_result_value type.
Variables
CHARACTER(len=*), parameter, private	moduleN = 'cp_result_types'

Detailed Description

set of type/routines to handle the storage of results in force_envs

Author:: fschiff (12.2007)

History

10.2008 Teodoro Laino [tlaino] - University of Zurich major rewriting:
- information stored in a proper type (not in a character!)
- module more lean
- splitting types and creating methods for cp_results

Function Documentation

subroutine,public cp_result_types::cp_result_clean	(	TYPE(cp_result_type),pointer	results,
		TYPE(cp_error_type),intent(inout)	error
	)

Releases cp_result clean.

Author:: Teodoro Laino [tlaino] - University of Zurich - 10.2008

Definition at line 166 of file cp_result_types.f90.

References cp_result_value_release(), CPPostcondition, and timings::timeset().

Referenced by cp_result_copy(), cp_result_methods::cp_results_erase(), and cp_result_methods::cp_results_mp_bcast().

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subroutine,public cp_result_types::cp_result_copy	(	TYPE(cp_result_type),pointer	results_in,
		TYPE(cp_result_type),pointer	results_out,
		TYPE(cp_error_type),intent(inout)	error
	)

Copies the cp_result type.

Author:: Teodoro Laino [tlaino] - University of Zurich 10.2008

Definition at line 333 of file cp_result_types.f90.

References cp_result_clean(), cp_result_value_copy(), cp_result_value_create(), CPPostcondition, and timings::timeset().

Referenced by cp_result_methods::cp_results_erase(), force_env_methods::force_env_calc_energy_force(), and force_env_methods::mixed_energy_forces().

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subroutine,public cp_result_types::cp_result_create	(	TYPE(cp_result_type),pointer	results,
		TYPE(cp_error_type),intent(inout)	error
	)

Allocates and intitializes the cp_result.

History: 12.2007 created 10.2008 Teodoro Laino [tlaino] - major rewriting

Author:: fschiff

Definition at line 96 of file cp_result_types.f90.

References CPPostcondition, and timings::timeset().

Referenced by cp_result_methods::cp_results_erase(), fist_environment_types::init_fist_env(), mixed_environment_types::init_mixed_env(), qs_environment_types::init_qs_env(), and replica_methods::rep_env_init_low().

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subroutine,public cp_result_types::cp_result_release	(	TYPE(cp_result_type),pointer	results,
		TYPE(cp_error_type),intent(inout)	error
	)

Releases cp_result type.

History: 12.2007 created 10.2008 Teodoro Laino [tlaino] - major rewriting

Author:: fschiff

Definition at line 126 of file cp_result_types.f90.

References cp_result_value_release(), CPPostcondition, and timings::timeset().

Referenced by cp_result_methods::cp_results_erase(), force_env_types::force_env_release(), and force_env_types::force_env_set().

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subroutine,public cp_result_types::cp_result_retain	(	TYPE(cp_result_type),pointer	results,
		TYPE(cp_error_type),intent(inout)	error
	)

Retains cp_result type.

History: 12.2007 created

Author:: fschiff

Definition at line 202 of file cp_result_types.f90.

subroutine,public cp_result_types::cp_result_value_copy	(	TYPE(cp_result_value_type),pointer	value_out,
		TYPE(cp_result_value_type),pointer	value_in,
		TYPE(cp_error_type),intent(inout)	error
	)

Copies the cp_result_value type.

Author:: Teodoro Laino [tlaino] - University of Zurich 10.2008

Definition at line 369 of file cp_result_types.f90.

References CPPostcondition, input_val_types::integer_t, and timings::timeset().

Referenced by cp_result_copy(), cp_result_value_p_reallocate(), and cp_result_methods::cp_results_erase().

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subroutine,public cp_result_types::cp_result_value_create	(	TYPE(cp_result_value_type),pointer	value,
		TYPE(cp_error_type),intent(inout)	error
	)

Allocates and intitializes the cp_result_value type.

Author:: Teodoro Laino [tlaino] - University of Zurich 10.2008

Definition at line 223 of file cp_result_types.f90.

References CPPostcondition, and timings::timeset().

Referenced by cp_result_copy(), cp_result_value_p_reallocate(), cp_result_methods::cp_results_erase(), and cp_result_methods::cp_results_mp_bcast().

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subroutine,public cp_result_types::cp_result_value_init	(	TYPE(cp_result_value_type),pointer	value,
		INTEGER,intent(in)	type_in_use,
		INTEGER,intent(in)	size_value,
		TYPE(cp_error_type),intent(inout)	error
	)

Setup of the cp_result_value type.

Author:: Teodoro Laino [tlaino] - University of Zurich 10.2008

Definition at line 248 of file cp_result_types.f90.

References CPPostcondition, input_val_types::integer_t, and timings::timeset().

Referenced by cp_result_methods::cp_results_mp_bcast(), cp_result_methods::put_result_r1(), and cp_result_methods::put_result_r2().

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subroutine,public cp_result_types::cp_result_value_p_reallocate	(	TYPE(cp_result_value_p_type),dimension(:),pointer	result_value,
		INTEGER,intent(in)	istart,
		INTEGER,intent(in)	iend,
		TYPE(cp_error_type),intent(inout)	error
	)