iphreeqc/SolutionIsotope.h

#if !defined(SOLUTIONISOTOPE_H_INCLUDED)
#define SOLUTIONISOTOPE_H_INCLUDED

#include "Parser.h"
#include <ostream>				// std::ostream
#include <string>				// std::string
#include <list>					// std::list

class cxxSolutionIsotope
{
  public:
	cxxSolutionIsotope(void);
	  cxxSolutionIsotope(struct isotope *isotope_ptr);
	 ~cxxSolutionIsotope(void);

	/*
	   enum STATUS {
	   ERROR = 0,
	   OK    = 1
	   };
	 */
	//cxxSolutionIsotope::STATUS read(CParser& parser);
	static struct isotope *list2isotope(std::list < cxxSolutionIsotope > &t);

	void dump_xml(std::ostream & os, unsigned int indent) const;
	void dump_raw(std::ostream & os, unsigned int indent) const;

	  CParser::STATUS_TYPE read_raw(CParser & parser);

	double get_isotope_number() const
	{
		return this->isotope_number;
	}
	void set_isotope_number(double d)
	{
		this->isotope_number = d;
	}
	char *get_elt_name() const
	{
		return this->elt_name;
	}
	void set_elt_name(char *cstring)
	{
		this->elt_name = cstring;
	}
	char *get_isotope_name() const
	{
		return this->isotope_name;
	}
	void set_isotope_name(char *cstring)
	{
		this->isotope_name = cstring;
	}
	double get_total() const
	{
		return this->total;
	}
	void set_total(double d)
	{
		this->total = d;
	}

	double get_ratio() const
	{
		return this->ratio;
	}

	double get_ratio_uncertainty() const
	{
		return this->ratio_uncertainty;
	}

	bool get_ratio_uncertainty_defined() const
	{
		return this->ratio_uncertainty_defined;
	}

	bool operator<(const cxxSolutionIsotope & conc) const;

	struct master *master(void);
	struct master *primary(void);

	void add(const cxxSolutionIsotope & isotope_ptr, double intensive,
			 double extensive);
	void multiply(double extensive);

  protected:
	friend class cxxSolutionIsotopeList;
	double isotope_number;
	char *elt_name;
	char *isotope_name;
	double total;
	double ratio;
	double ratio_uncertainty;
	//struct master *master;
	//struct master *primary;
	bool ratio_uncertainty_defined;
};
#endif // SOLUTIONISOTOPE_H_INCLUDED