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d4721e493e
However, now need 4 configurations for IPhreeqc Debug/Release USE_MPI. git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@7036 1feff8c3-07ed-0310-ac33-dd36852eb9cd
74 lines
2.5 KiB
C++
74 lines
2.5 KiB
C++
#if !defined(SURFACECOMP_H_INCLUDED)
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#define SURFACECOMP_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 "NameDouble.h"
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class cxxSurfaceComp: public PHRQ_base
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{
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public:
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cxxSurfaceComp(PHRQ_io *io=NULL);
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virtual ~cxxSurfaceComp();
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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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void add(const cxxSurfaceComp & comp, LDBLE extensive);
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void multiply(LDBLE extensive);
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const std::string &Get_formula() const {return this->formula;}
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void Set_formula(const char * f) {this->formula = f ? f : "";}
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LDBLE Get_formula_z(void) const {return formula_z;};
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void Set_formula_z(LDBLE t) {this->formula_z = t;}
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LDBLE Get_moles(void) const {return moles;}
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void Set_moles(LDBLE t) {this->moles = t;}
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cxxNameDouble & Get_totals() {return (this->totals);}
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void Set_totals(cxxNameDouble & nd) {this->totals = nd;}
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LDBLE Get_la(void) const {return la;};
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void Set_la(LDBLE t) {this->la = t;}
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LDBLE Get_charge_balance() const {return this->charge_balance;}
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void Set_charge_balance(LDBLE d) {this->charge_balance = d;}
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const std::string &Get_charge_name() const {return this->charge_name;}
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void Set_charge_name(const char * f) {this->charge_name = f ? f : "";}
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const std::string &Get_phase_name() const {return this->phase_name;}
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void Set_phase_name(const char * f) {this->phase_name = f ? f : "";}
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LDBLE Get_phase_proportion(void) const {return phase_proportion;}
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void Set_phase_proportion(LDBLE d) {this->phase_proportion = d;}
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const std::string &Get_rate_name() const {return this->rate_name;}
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void Set_rate_name(const char * f) {this->rate_name = f ? f : "";}
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LDBLE Get_Dw(void) const {return Dw;}
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void Set_Dw(LDBLE d) {this->Dw = d;}
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const std::string &Get_master_element() const {return this->master_element;}
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void Set_master_element(const char * f) {this->master_element = f ? f : "";}
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#ifdef USE_MPI_SKIP
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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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protected:
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std::string formula;
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LDBLE formula_z;
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LDBLE moles;
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cxxNameDouble totals;
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LDBLE la;
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std::string charge_name;
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LDBLE charge_balance;
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std::string phase_name;
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LDBLE phase_proportion;
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std::string rate_name;
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LDBLE Dw;
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std::string master_element;
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const static std::vector < std::string > vopts;
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public:
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};
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#endif // !defined(SURFACECOMP_H_INCLUDED)
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