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https://git.gfz-potsdam.de/naaice/iphreeqc.git
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7683982877
git-svn-id: svn://136.177.114.72/svn_GW/phreeqcpp/branches/ErrorHandling@6038 1feff8c3-07ed-0310-ac33-dd36852eb9cd
92 lines
2.0 KiB
C++
92 lines
2.0 KiB
C++
#if !defined(SSASSEMBLAGESS_H_INCLUDED)
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#define SSASSEMBLAGESS_H_INCLUDED
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#include <cassert> // assert
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#include <map> // std::map
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#include <string> // std::string
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#include <list> // std::list
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#include <vector> // std::vector
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#include "phrqtype.h"
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#include "NameDouble.h"
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#include "Phreeqc_class.h"
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class cxxSS: public PHRQ_base
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{
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public:
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cxxSS(PHRQ_io *io=NULL);
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cxxSS(struct s_s *, PHRQ_io *io=NULL);
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~cxxSS();
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enum SS_PARAMETER_TYPE
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{
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SS_PARM_NONE = -1,
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SS_PARM_A0_A1 = 0,
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SS_PARM_GAMMAS = 1,
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SS_PARM_DIST_COEF = 2,
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SS_PARM_MISCIBILITY = 3,
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SS_PARM_SPINODAL = 4,
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SS_PARM_CRITICAL = 5,
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SS_PARM_ALYOTROPIC = 6,
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SS_PARM_DIM_GUGG = 7,
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SS_PARM_WALDBAUM = 8,
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SS_PARM_MARGULES = 9
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};
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void dump_xml(std::ostream & os, unsigned int indent = 0) const;
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void dump_raw(std::ostream & s_oss, unsigned int indent) const;
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void read_raw(CParser & parser, bool check = true);
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const std::string &Get_name() const
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{
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return this->name;
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}
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void Set_name (const char * s)
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{
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if (s != NULL)
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this->name = std::string(s);
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else
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this->name.clear();
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}
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void totalize(PHREEQC_PTR_ARG);
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const cxxNameDouble & Get_totals() const
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{
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return (this->totals);
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};
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const cxxNameDouble & Get_comps() const
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{
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return (this->comps);
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};
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#ifdef USE_MPI
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void mpi_pack(std::vector < int >&ints, std::vector < LDBLE >&doubles);
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void mpi_unpack(int *ints, int *ii, LDBLE *doubles, int *dd);
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#endif
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void add(const cxxSS & comp, LDBLE extensive);
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void multiply(LDBLE extensive);
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LDBLE Get_a0() const {return (this->a0);};
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LDBLE Get_a1() const {return (this->a1);};
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LDBLE Get_ag0() const {return (this->ag0);};
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LDBLE Get_ag1() const {return (this->ag1);};
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bool Get_miscibility() const {return (this->miscibility);};
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LDBLE Get_xb1() const {return (this->xb1);};
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LDBLE Get_xb2() const {return (this->xb2);};
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protected:
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std::string name;
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cxxNameDouble comps;
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LDBLE a0, a1;
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LDBLE ag0, ag1;
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bool miscibility;
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LDBLE xb1, xb2;
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cxxNameDouble totals;
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public:
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};
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#endif // !defined(SSASSEMBLAGESS_H_INCLUDED)
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