iphreeqc/SSassemblageSS.h
David L Parkhurst 7830f46d8d Merged 1727 through 2055 from orchestra/phreeqcpp_for_orch into phreeeqcpp trunk
git-svn-id: svn://136.177.114.72/svn_GW/phreeqcpp/trunk@2057 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2007-05-30 23:43:59 +00:00

75 lines
2.0 KiB
C++

#if !defined(SSASSEMBLAGESS_H_INCLUDED)
#define SSASSEMBLAGESS_H_INCLUDED
#include "NameDouble.h"
#define EXTERNAL extern
#include "global.h"
#include <cassert> // assert
#include <map> // std::map
#include <string> // std::string
#include <list> // std::list
#include <vector> // std::vector
#include "char_star.h"
class cxxSSassemblageSS
{
public:
cxxSSassemblageSS();
cxxSSassemblageSS(struct s_s *);
~cxxSSassemblageSS();
enum SS_PARAMETER_TYPE {
SS_PARM_NONE = -1,
SS_PARM_A0_A1 = 0,
SS_PARM_GAMMAS = 1,
SS_PARM_DIST_COEF = 2,
SS_PARM_MISCIBILITY = 3,
SS_PARM_SPINODAL = 4,
SS_PARM_CRITICAL = 5,
SS_PARM_ALYOTROPIC = 6,
SS_PARM_DIM_GUGG = 7,
SS_PARM_WALDBAUM = 8,
SS_PARM_MARGULES = 9
};
static struct s_s *cxxSSassemblageSS2s_s(std::list<cxxSSassemblageSS>& el);
void dump_xml(std::ostream& os, unsigned int indent = 0)const;
void dump_raw(std::ostream& s_oss, unsigned int indent)const;
void read_raw(CParser& parser);
char *get_name()const {return this->name;}
void totalize();
const cxxNameDouble &get_totals()const
{
return (this->totals);
};
#ifdef USE_MPI
void mpi_pack(std::vector<int>& ints, std::vector<double>& doubles);
void mpi_unpack(int *ints, int *ii, double *doubles, int *dd);
#endif
void add(const cxxSSassemblageSS &comp, double extensive);
void multiply(double extensive);
protected:
char *name;
cxxNameDouble comps;
double a0, a1;
double ag0, ag1;
bool miscibility;
double xb1, xb2;
cxxNameDouble totals;
public:
};
#endif // !defined(SSASSEMBLAGESS_H_INCLUDED)