EquilibriumBalance.hpp

// Reaktoro is a unified framework for modeling chemically reactive systems.
//
// Copyright (C) 2014-2018 Allan Leal
//
// 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, see <http://www.gnu.org/licenses/>.
 
#pragma once
 
// C++ includes
#include <memory>
 
// Reaktoro includes
#include <Reaktoro/Math/Matrix.hpp>
 
namespace Reaktoro {
 
// Forward declarations
class ChemicalSystem;
class Partition;
class EquilibriumReactions;
 
class EquilibriumBalance
{
public:
    EquilibriumBalance(const ChemicalSystem& system);
 
    EquilibriumBalance(const ChemicalSystem& system, const Partition& partition);
 
    EquilibriumBalance(const EquilibriumReactions& reactions);
 
    EquilibriumBalance(const EquilibriumBalance& other);
 
    virtual ~EquilibriumBalance();
 
    auto operator=(EquilibriumBalance other) -> EquilibriumBalance&;
 
    auto regularizedMatrix() const -> MatrixConstRef;
 
    auto regularizedVector(Vector b) const -> Vector;
 
private:
    struct Impl;
 
    std::unique_ptr<Impl> pimpl;
};
 
 
} // namespace Reaktoro