mirror of
https://git.gfz-potsdam.de/naaice/iphreeqc.git
synced 2025-12-16 16:44:49 +01:00
7eeeab4569
NameDouble, StorageBinListItem. NumKeyword inherits from PHRQ_base, others inherit NumKeyword. ChartHandler and ChartObject inherit from PHRQ_base. CurveObject does not inherit from PHRQ_base. git-svn-id: svn://136.177.114.72/svn_GW/phreeqcpp/branches/ErrorHandling@5637 1feff8c3-07ed-0310-ac33-dd36852eb9cd
77 lines
2.1 KiB
C++
77 lines
2.1 KiB
C++
#if !defined(PPASSEMBLAGE_H_INCLUDED)
|
|
#define PPASSEMBLAGE_H_INCLUDED
|
|
|
|
#include <cassert> // assert
|
|
#include <map> // std::map
|
|
#include <string> // std::string
|
|
#include <list> // std::list
|
|
#include <vector> // std::vector
|
|
|
|
#include "NumKeyword.h"
|
|
#include "PPassemblageComp.h"
|
|
class cxxMix;
|
|
|
|
class cxxPPassemblage:public cxxNumKeyword
|
|
{
|
|
|
|
public:
|
|
cxxPPassemblage(PHRQ_io * io=NULL);
|
|
cxxPPassemblage(struct pp_assemblage *, PHRQ_io * io=NULL);
|
|
cxxPPassemblage(PHREEQC_PTR_ARG_COMMA const std::map < int, cxxPPassemblage > &entity_map,
|
|
cxxMix & mx, int n_user, PHRQ_io * io=NULL);
|
|
~cxxPPassemblage();
|
|
|
|
struct pp_assemblage *cxxPPassemblage2pp_assemblage(PHREEQC_PTR_ARG);
|
|
|
|
struct pure_phase *cxxPPassemblageComp2pure_phase();
|
|
|
|
void dump_raw(std::ostream & s_oss, unsigned int indent) const;
|
|
|
|
void read_raw(PHREEQC_PTR_ARG_COMMA CParser & parser, bool check = true);
|
|
|
|
const cxxNameDouble & get_totals() const
|
|
{
|
|
return this->totals;
|
|
};
|
|
const cxxNameDouble & get_eltList() const
|
|
{
|
|
return this->eltList;
|
|
};
|
|
std::map <std::string, cxxPPassemblageComp > & get_ppAssemblageComps()
|
|
{
|
|
return this->ppAssemblageComps;
|
|
};
|
|
#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 totalize(PHREEQC_PTR_ARG);
|
|
#ifdef ORCHESTRA
|
|
void ORCH_write_chemistry(std::ostream & chemistry_dat);
|
|
void ORCH_write_output_vars(std::ostream & outstream);
|
|
void ORCH_read(std::vector < std::pair < std::string,
|
|
double >>output_vector,
|
|
std::vector < std::pair < std::string,
|
|
double >>::iterator & it);
|
|
void ORCH_store_global(std::map < std::string, double >output_map);
|
|
#endif
|
|
|
|
private:
|
|
void add(PHREEQC_PTR_ARG_COMMA const cxxPPassemblage & addee, double extensive);
|
|
// not written
|
|
void dump_xml(std::ostream & os, unsigned int indent = 0) const;
|
|
|
|
protected:
|
|
//std::list < cxxPPassemblageComp > ppAssemblageComps;
|
|
std::map <std::string, cxxPPassemblageComp > ppAssemblageComps;
|
|
cxxNameDouble eltList;
|
|
cxxNameDouble totals;
|
|
|
|
public:
|
|
//static std::map<int, cxxPPassemblage>& map;
|
|
|
|
};
|
|
|
|
#endif // !defined(PPASSEMBLAGE_H_INCLUDED)
|