Homec4science
Diffusion SpecMiCP / ReactMiCP (configuration) Browse

specmicp/src/reactmicp/io/saturated_react.hpp
e809292d7440configuration

Last Change
Raw File

saturated_react.hpp
View Options

/*-------------------------------------------------------------------------------
Copyright (c) 2014,2015 F. Georget <fabieng@princeton.edu>, Princeton University
All rights reserved.
Redistribution and use in source and binary forms, with or without modification,
are permitted provided that the following conditions are met:
1. Redistributions of source code must retain the above copyright notice, this
list of conditions and the following disclaimer.
2. Redistributions in binary form must reproduce the above copyright notice,
this list of conditions and the following disclaimer in the documentation and/or
other materials provided with the distribution.
3. Neither the name of the copyright holder nor the names of its contributors
may be used to endorse or promote products derived from this software without
specific prior written permission.
THIS SOFTWARE IS PROVIDED BY THE COPYRIGHT HOLDERS AND CONTRIBUTORS "AS IS" AND
ANY EXPRESS OR IMPLIED WARRANTIES, INCLUDING, BUT NOT LIMITED TO, THE IMPLIED
WARRANTIES OF MERCHANTABILITY AND FITNESS FOR A PARTICULAR PURPOSE ARE
DISCLAIMED. IN NO EVENT SHALL THE COPYRIGHT HOLDER OR CONTRIBUTORS BE LIABLE FOR
ANY DIRECT, INDIRECT, INCIDENTAL, SPECIAL, EXEMPLARY, OR CONSEQUENTIAL DAMAGES
(INCLUDING, BUT NOT LIMITED TO, PROCUREMENT OF SUBSTITUTE GOODS OR SERVICES;
LOSS OF USE, DATA, OR PROFITS; OR BUSINESS INTERRUPTION) HOWEVER CAUSED AND ON
ANY THEORY OF LIABILITY, WHETHER IN CONTRACT, STRICT LIABILITY, OR TORT
(INCLUDING NEGLIGENCE OR OTHERWISE) ARISING IN ANY WAY OUT OF THE USE OF THIS
SOFTWARE, EVEN IF ADVISED OF THE POSSIBILITY OF SUCH DAMAGE.
-----------------------------------------------------------------------------*/
#ifndef SPECMICP_IO_SATURATEDREACT_HPP
#define SPECMICP_IO_SATURATEDREACT_HPP
//! \file saturated_react.hpp
//! \brief Print information about the saturated reactive transport module
#include "../../types.hpp"
#include "../../utils/io/csv_formatter.hpp"
#include "../../physics/units.hpp"
#include <iosfwd>
#include <memory>
#include <functional>
namespace specmicp {
// forward declarations
class AdimensionalSystemSolutionExtractor;
namespace database
{
struct DataContainer;
} //end namespace database
using RawDatabasePtr = std::shared_ptr<database::DataContainer>;
namespace mesh {
class Mesh1D;
using Mesh1DPtr = std::shared_ptr<Mesh1D>;
} //end namespace mesh
namespace reactmicp {
namespace solver {
class VariablesBase;
using VariablesBasePtr = std::shared_ptr<VariablesBase>;
} //end namespace solver
namespace systems {
namespace satdiff {
class SaturatedVariables;
using SaturatedVariablesPtr = std::shared_ptr<SaturatedVariables>;
} //end namespace satdiff
} //end namespace systems
} //end namespace reactmicp
namespace io {
using namespace specmicp::reactmicp::systems::satdiff;
//! \brief Print the total aqueous concentrations in the CSV format in the file 'filepath'
void SPECMICP_DLL_PUBLIC print_components_total_aqueous_concentration(
RawDatabasePtr the_database,
SaturatedVariablesPtr variables,
mesh::Mesh1DPtr the_mesh,
const units::UnitsSet& units_set,
const std::string& filepath
);
//! \brief Print the total solid concentrations in the CSV format in the file 'filepath'
void SPECMICP_DLL_PUBLIC print_components_total_solid_concentration(
RawDatabasePtr the_database,
SaturatedVariablesPtr variables,
mesh::Mesh1DPtr the_mesh,
const units::UnitsSet& units_set,
const std::string& filepath
);
//! \brief Print the solid phases profiles in 'filepath'
void SPECMICP_DLL_PUBLIC print_minerals_profile(
RawDatabasePtr the_database,
SaturatedVariablesPtr variables,
mesh::Mesh1DPtr the_mesh,
const units::UnitsSet& units_set,
const std::string& filepath
);
//! \brief Output Nodal variables requested by the user
//!
//! This class can be used during a ReacMiCP simulation to
//! output nodal variables in CSV files
class SPECMICP_DLL_PUBLIC OutputNodalVariables
{
public:
OutputNodalVariables(RawDatabasePtr the_database,
mesh::Mesh1DPtr the_mesh,
const units::UnitsSet& the_units);
//! \brief The total aqueous concentration of 'component' will be saved in 'filepath'
void register_total_aqueous_concentration(index_t component, const std::string& filepath);
//! \brief The total solid concentration of 'component' will be saved in 'filepath'
void register_total_solid_concentration(index_t component, const std::string& filepath);
//! \brief The total concentration of 'component' will be saved in 'filepath'
void register_total_concentration(index_t component, const std::string& filepath);
//! \brief The porosity will be saved in 'filepath'
void register_porosity(const std::string& filepath);
//! \brief The diffusion_coefficient will be save in 'filepath'
void register_diffusion_coefficient(const std::string& filepath);
//! \brief The molality of 'component' will be saved in 'filepath'
void register_molality_component(index_t component, const std::string& filepath);
//! \brief The pH will be saved in 'filepath'
void register_pH(const std::string& filepath);
//! \brief The volume fraction of 'mineral' will be saved in 'filepath'
void register_volume_fraction_mineral(index_t mineral, const std::string& filepath);
//! \brief Output the variables in their respective files
void output(scalar_t time, SaturatedVariablesPtr var);
//! \brief Output the variables in their respective files
void output(scalar_t time, reactmicp::solver::VariablesBasePtr var);
//! \brief Return the output function for the ReactMiCP solver
std::function<void (scalar_t, reactmicp::solver::VariablesBasePtr)> get_output_for_reactmicp();
RawDatabasePtr get_database() {return m_database;}
private:
using equilibrium_var_f = std::function<scalar_t (AdimensionalSystemSolutionExtractor*)> ;
RawDatabasePtr m_database;
mesh::Mesh1DPtr m_mesh;
units::UnitsSet m_units;
std::vector<index_t> m_index_aqueous {};
std::vector<index_t> m_index_solid {};
std::vector<index_t> m_index_conc {};
CSVFile m_out_poro {};
CSVFile m_out_diffusivity {};
std::vector<CSVFile> m_out_aqueous {};
std::vector<CSVFile> m_out_solid {};
std::vector<CSVFile> m_out_conc {};
std::vector<CSVFile> m_out_equilibrium_vars {};
std::vector<equilibrium_var_f> m_func_equilibrium_vars {};
};
} // end namespace io
} // end namespace specmicp
#endif // SPECMICP_IO_SATURATEDREACT_HPP
c4science · Help