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|
!
! KIM-API: An API for interatomic models
! Copyright (c) 2013--2022, Regents of the University of Minnesota.
! All rights reserved.
!
! Contributors:
! Ryan S. Elliott
!
! SPDX-License-Identifier: LGPL-2.1-or-later
!
! This library is free software; you can redistribute it and/or
! modify it under the terms of the GNU Lesser General Public
! License as published by the Free Software Foundation; either
! version 2.1 of the License, or (at your option) any later version.
!
! This library is distributed in the hope that it will be useful,
! but WITHOUT ANY WARRANTY; without even the implied warranty of
! MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the GNU
! Lesser General Public License for more details.
!
! You should have received a copy of the GNU Lesser General Public License
! along with this library; if not, write to the Free Software Foundation,
! Inc., 51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA
!
!
! Release: This file is part of the kim-api.git repository.
!
!> \brief \copybrief KIM::ModelWriteParameterizedModel
!!
!! \sa KIM::ModelWriteParameterizedModel, KIM_ModelWriteParameterizedModel
!!
!! \since 2.0
module kim_model_write_parameterized_model_module
use, intrinsic :: iso_c_binding
implicit none
private
public &
! Derived types
kim_model_write_parameterized_model_handle_type, &
! Constants
KIM_MODEL_WRITE_PARAMETERIZED_MODEL_NULL_HANDLE, &
! Routines
operator(.eq.), &
operator(.ne.), &
kim_get_path, &
kim_get_model_name, &
kim_set_parameter_file_name, &
kim_get_model_buffer_pointer, &
kim_log_entry, &
kim_to_string
!> \brief \copybrief KIM::ModelWriteParameterizedModel
!!
!! \sa KIM::ModelWriteParameterizedModel, KIM_ModelWriteParameterizedModel
!!
!! \since 2.0
type, bind(c) :: kim_model_write_parameterized_model_handle_type
type(c_ptr) :: p = c_null_ptr
end type kim_model_write_parameterized_model_handle_type
!> \brief NULL handle for use in comparisons.
!!
!! \since 2.0
type(kim_model_write_parameterized_model_handle_type), protected, save &
:: KIM_MODEL_WRITE_PARAMETERIZED_MODEL_NULL_HANDLE
!> \brief Compares kim_model_write_parameterized_model_handle_type's for
!! equality.
!!
!! \since 2.0
interface operator(.eq.)
module procedure kim_model_write_parameterized_model_handle_equal
end interface operator(.eq.)
!> \brief Compares kim_model_write_parameterized_model_handle_type's for
!! inequality.
!!
!! \since 2.0
interface operator(.ne.)
module procedure kim_model_write_parameterized_model_handle_not_equal
end interface operator(.ne.)
!> \brief \copybrief KIM::ModelWriteParameterizedModel::GetPath
!!
!! \sa KIM::ModelWriteParameterizedModel::GetPath,
!! KIM_ModelWriteParameterizedModel_GetPath
!!
!! \since 2.0
interface kim_get_path
module procedure kim_model_write_parameterized_model_get_path
end interface kim_get_path
!> \brief \copybrief KIM::ModelWriteParameterizedModel::GetModelName
!!
!! \sa KIM::ModelWriteParameterizedModel::GetModelName,
!! KIM_ModelWriteParameterizedModel_GetModelName
!!
!! \since 2.0
interface kim_get_model_name
module procedure kim_model_write_parameterized_model_get_model_name
end interface kim_get_model_name
!> \brief \copybrief KIM::ModelWriteParameterizedModel::SetParameterFileName
!!
!! \sa KIM::ModelWriteParameterizedModel::SetParameterFileName,
!! KIM_ModelWriteParameterizedModel_SetParameterFileName
!!
!! \since 2.0
interface kim_set_parameter_file_name
module procedure kim_model_write_parameterized_model_set_parameter_file_name
end interface kim_set_parameter_file_name
!> \brief \copybrief KIM::ModelWriteParameterizedModel::GetModelBufferPointer
!!
!! \sa KIM::ModelWriteParameterizedModel::GetModelBufferPointer,
!! KIM_ModelWriteParameterizedModel_GetModelBufferPointer
!!
!! \since 2.0
interface kim_get_model_buffer_pointer
module procedure &
kim_model_write_parameterized_model_get_model_buffer_pointer
end interface kim_get_model_buffer_pointer
!> \brief \copybrief KIM::ModelWriteParameterizedModel::LogEntry
!!
!! \sa KIM::ModelWriteParameterizedModel::LogEntry,
!! KIM_ModelWriteParameterizedModel_LogEntry
!!
!! \since 2.0
interface kim_log_entry
module procedure kim_model_write_parameterized_model_log_entry
end interface kim_log_entry
!> \brief \copybrief KIM::ModelWriteParameterizedModel::ToString
!!
!! \sa KIM::ModelWriteParameterizedModel::ToString,
!! KIM_ModelWriteParameterizedModel_ToString
!!
!! \since 2.0
interface kim_to_string
module procedure kim_model_write_parameterized_model_to_string
end interface kim_to_string
contains
!> \brief Compares kim_model_write_parameterized_model_handle_type's for
!! equality.
!!
!! \since 2.0
logical recursive function kim_model_write_parameterized_model_handle_equal( &
lhs, rhs)
implicit none
type(kim_model_write_parameterized_model_handle_type), intent(in) :: lhs
type(kim_model_write_parameterized_model_handle_type), intent(in) :: rhs
if ((.not. c_associated(lhs%p)) .and. (.not. c_associated(rhs%p))) then
kim_model_write_parameterized_model_handle_equal = .true.
else
kim_model_write_parameterized_model_handle_equal = &
c_associated(lhs%p, rhs%p)
end if
end function kim_model_write_parameterized_model_handle_equal
!> \brief Compares kim_model_write_parameterized_model_handle_type's for
!! inequality.
!!
!! \since 2.0
logical recursive function &
kim_model_write_parameterized_model_handle_not_equal(lhs, rhs)
implicit none
type(kim_model_write_parameterized_model_handle_type), intent(in) :: lhs
type(kim_model_write_parameterized_model_handle_type), intent(in) :: rhs
kim_model_write_parameterized_model_handle_not_equal = .not. (lhs == rhs)
end function kim_model_write_parameterized_model_handle_not_equal
!> \brief \copybrief KIM::ModelWriteParameterizedModel::GetPath
!!
!! \sa KIM::ModelWriteParameterizedModel::GetPath,
!! KIM_ModelWriteParameterizedModel_GetPath
!!
!! \since 2.0
recursive subroutine kim_model_write_parameterized_model_get_path( &
model_write_parameterized_model_handle, path)
use kim_convert_string_module, only: kim_convert_c_char_ptr_to_string
use kim_interoperable_types_module, only: &
kim_model_write_parameterized_model_type
implicit none
interface
recursive subroutine get_path(model_write_parameterized_model, path) &
bind(c, name="KIM_ModelWriteParameterizedModel_GetPath")
use, intrinsic :: iso_c_binding
use kim_interoperable_types_module, only: &
kim_model_write_parameterized_model_type
implicit none
type(kim_model_write_parameterized_model_type), intent(in) &
:: model_write_parameterized_model
type(c_ptr), intent(out) :: path
end subroutine get_path
end interface
type(kim_model_write_parameterized_model_handle_type), intent(in) &
:: model_write_parameterized_model_handle
character(len=*, kind=c_char), intent(out) :: path
type(kim_model_write_parameterized_model_type), pointer &
:: model_write_parameterized_model
type(c_ptr) :: ppath
call c_f_pointer(model_write_parameterized_model_handle%p, &
model_write_parameterized_model)
call get_path(model_write_parameterized_model, ppath)
call kim_convert_c_char_ptr_to_string(ppath, path)
end subroutine kim_model_write_parameterized_model_get_path
!> \brief \copybrief KIM::ModelWriteParameterizedModel::GetModelName
!!
!! \sa KIM::ModelWriteParameterizedModel::GetModelName,
!! KIM_ModelWriteParameterizedModel_GetModelName
!!
!! \since 2.0
recursive subroutine kim_model_write_parameterized_model_get_model_name( &
model_write_parameterized_model_handle, model_name)
use kim_convert_string_module, only: kim_convert_c_char_ptr_to_string
use kim_interoperable_types_module, only: &
kim_model_write_parameterized_model_type
implicit none
interface
recursive subroutine get_model_name(model_write_parameterized_model, &
model_name) &
bind(c, name="KIM_ModelWriteParameterizedModel_GetModelName")
use, intrinsic :: iso_c_binding
use kim_interoperable_types_module, only: &
kim_model_write_parameterized_model_type
implicit none
type(kim_model_write_parameterized_model_type), intent(in) &
:: model_write_parameterized_model
type(c_ptr), intent(out) :: model_name
end subroutine get_model_name
end interface
type(kim_model_write_parameterized_model_handle_type), intent(in) &
:: model_write_parameterized_model_handle
character(len=*, kind=c_char), intent(out) :: model_name
type(kim_model_write_parameterized_model_type), pointer &
:: model_write_parameterized_model
type(c_ptr) :: pmodel_name
call c_f_pointer(model_write_parameterized_model_handle%p, &
model_write_parameterized_model)
call get_model_name(model_write_parameterized_model, pmodel_name)
call kim_convert_c_char_ptr_to_string(pmodel_name, model_name)
end subroutine kim_model_write_parameterized_model_get_model_name
!> \brief \copybrief KIM::ModelWriteParameterizedModel::SetParameterFileName
!!
!! \sa KIM::ModelWriteParameterizedModel::SetParameterFileName,
!! KIM_ModelWriteParameterizedModel_SetParameterFileName
!!
!! \since 2.0
recursive subroutine &
kim_model_write_parameterized_model_set_parameter_file_name( &
model_write_parameterized_model_handle, file_name)
use kim_interoperable_types_module, only: &
kim_model_write_parameterized_model_type
implicit none
interface
recursive subroutine set_parameter_file_name( &
model_write_parameterized_model, file_name) &
bind(c, name="KIM_ModelWriteParameterizedModel_SetParameterFileName")
use, intrinsic :: iso_c_binding
use kim_interoperable_types_module, only: &
kim_model_write_parameterized_model_type
implicit none
type(kim_model_write_parameterized_model_type), intent(in) &
:: model_write_parameterized_model
character(c_char), intent(in) :: file_name(*)
end subroutine set_parameter_file_name
end interface
type(kim_model_write_parameterized_model_handle_type), intent(in) &
:: model_write_parameterized_model_handle
character(len=*, kind=c_char), intent(in) :: file_name
type(kim_model_write_parameterized_model_type), pointer &
:: model_write_parameterized_model
call c_f_pointer(model_write_parameterized_model_handle%p, &
model_write_parameterized_model)
call set_parameter_file_name(model_write_parameterized_model, &
trim(file_name)//c_null_char)
end subroutine kim_model_write_parameterized_model_set_parameter_file_name
!> \brief \copybrief KIM::ModelWriteParameterizedModel::GetModelBufferPointer
!!
!! \sa KIM::ModelWriteParameterizedModel::GetModelBufferPointer,
!! KIM_ModelWriteParameterizedModel_GetModelBufferPointer
!!
!! \since 2.0
recursive subroutine &
kim_model_write_parameterized_model_get_model_buffer_pointer( &
model_write_parameterized_model_handle, ptr)
use kim_interoperable_types_module, only: &
kim_model_write_parameterized_model_type
implicit none
interface
recursive subroutine get_model_buffer_pointer( &
model_write_parameterized_model, ptr) &
bind(c, name="KIM_ModelCompute_GetModelBufferPointer")
use, intrinsic :: iso_c_binding
use kim_interoperable_types_module, only: &
kim_model_write_parameterized_model_type
implicit none
type(kim_model_write_parameterized_model_type), intent(in) &
:: model_write_parameterized_model
type(c_ptr), intent(out) :: ptr
end subroutine get_model_buffer_pointer
end interface
type(kim_model_write_parameterized_model_handle_type), intent(in) &
:: model_write_parameterized_model_handle
type(c_ptr), intent(out) :: ptr
type(kim_model_write_parameterized_model_type), pointer &
:: model_write_parameterized_model
call c_f_pointer(model_write_parameterized_model_handle%p, &
model_write_parameterized_model)
call get_model_buffer_pointer(model_write_parameterized_model, ptr)
end subroutine kim_model_write_parameterized_model_get_model_buffer_pointer
!> \brief \copybrief KIM::ModelWriteParameterizedModel::LogEntry
!!
!! \sa KIM::ModelWriteParameterizedModel::LogEntry,
!! KIM_ModelWriteParameterizedModel_LogEntry
!!
!! \since 2.0
recursive subroutine kim_model_write_parameterized_model_log_entry( &
model_write_parameterized_model_handle, log_verbosity, message)
use kim_log_verbosity_module, only: kim_log_verbosity_type
use kim_interoperable_types_module, only: &
kim_model_write_parameterized_model_type
implicit none
interface
recursive subroutine log_entry( &
model_write_parameterized_model, log_verbosity, message, line_number, &
file_name) bind(c, name="KIM_ModelCompute_LogEntry")
use, intrinsic :: iso_c_binding
use kim_log_verbosity_module, only: kim_log_verbosity_type
use kim_interoperable_types_module, only: &
kim_model_write_parameterized_model_type
implicit none
type(kim_model_write_parameterized_model_type), intent(in) &
:: model_write_parameterized_model
type(kim_log_verbosity_type), intent(in), value :: log_verbosity
character(c_char), intent(in) :: message(*)
integer(c_int), intent(in), value :: line_number
character(c_char), intent(in) :: file_name(*)
end subroutine log_entry
end interface
type(kim_model_write_parameterized_model_handle_type), intent(in) &
:: model_write_parameterized_model_handle
type(kim_log_verbosity_type), intent(in) :: log_verbosity
character(len=*, kind=c_char), intent(in) :: message
type(kim_model_write_parameterized_model_type), pointer &
:: model_write_parameterized_model
call c_f_pointer(model_write_parameterized_model_handle%p, &
model_write_parameterized_model)
call log_entry(model_write_parameterized_model, log_verbosity, &
trim(message)//c_null_char, 0, ""//c_null_char)
end subroutine kim_model_write_parameterized_model_log_entry
!> \brief \copybrief KIM::ModelWriteParameterizedModel::ToString
!!
!! \sa KIM::ModelWriteParameterizedModel::ToString,
!! KIM_ModelWriteParameterizedModel_ToString
!!
!! \since 2.0
recursive subroutine kim_model_write_parameterized_model_to_string( &
model_write_parameterized_model_handle, string)
use kim_convert_string_module, only: kim_convert_c_char_ptr_to_string
use kim_interoperable_types_module, only: &
kim_model_write_parameterized_model_type
implicit none
interface
type(c_ptr) recursive function model_write_parameterized_model_string( &
model_write_parameterized_model) &
bind(c, name="KIM_ModelCompute_ToString")
use, intrinsic :: iso_c_binding
use kim_interoperable_types_module, only: &
kim_model_write_parameterized_model_type
implicit none
type(kim_model_write_parameterized_model_type), intent(in) &
:: model_write_parameterized_model
end function model_write_parameterized_model_string
end interface
type(kim_model_write_parameterized_model_handle_type), intent(in) &
:: model_write_parameterized_model_handle
character(len=*, kind=c_char), intent(out) :: string
type(kim_model_write_parameterized_model_type), pointer &
:: model_write_parameterized_model
type(c_ptr) :: p
call c_f_pointer(model_write_parameterized_model_handle%p, &
model_write_parameterized_model)
p = model_write_parameterized_model_string(model_write_parameterized_model)
call kim_convert_c_char_ptr_to_string(p, string)
end subroutine kim_model_write_parameterized_model_to_string
end module kim_model_write_parameterized_model_module
|
