pyEQL 1.4.0rc9__cp310-cp310-macosx_11_0_arm64.whl

pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/IPhreeqc.hpp

@@ -0,0 +1,1027 @@
+/*! @file IPhreeqc.hpp
+	@brief C++ Documentation
+*/
+
+#ifndef INC_IPHREEQC_HPP
+#define INC_IPHREEQC_HPP
+
+#include <exception>
+#include <list>
+#include <vector>
+#include <map>
+#include <cstdarg>
+#include "IPhreeqcCallbacks.h"      /* PFN_PRERUN_CALLBACK, PFN_POSTRUN_CALLBACK, PFN_CATCH_CALLBACK */
+#include "Var.h"                    /* VRESULT */
+#include "PHRQ_io.h"
+
+#include "PHRQ_exports.h"
+
+class Phreeqc;
+class IErrorReporter;
+class CSelectedOutput;
+class SelectedOutput;
+
+/**
+ * @class IPhreeqcStop
+ *
+ * @brief This class is derived from std::exception and is thrown
+ * when an unrecoverable error has occurred.
+ */
+class IPQ_DLL_EXPORT IPhreeqcStop : public std::exception 
+{
+public:
+  virtual const char *what() const throw () {return "Failure in IPhreeqc\n";}
+};
+
+/**
+ * @class IPhreeqc
+ *
+ * @brief Provides an interface to PHREEQC (Version 3)--A Computer
+ * Program for Speciation, Batch-Reaction, One-Dimensional Transport,
+ * and Inverse Geochemical Calculations
+ */
+
+class IPQ_DLL_EXPORT IPhreeqc : public PHRQ_io
+{
+public:
+	/**
+	 * Constructor.
+	 *  @anchor IPhreeqc_cpp
+	 *  @par Example:
+	 *  @include IPhreeqc.cpp
+	 */
+	IPhreeqc(void);
+
+	/**
+	 * Destructor
+	 */
+	virtual ~IPhreeqc(void);
+
+public:
+
+	/**
+	 *  Accumlulate line(s) for input to phreeqc.
+	 *  @param line             The line(s) to add for input to phreeqc.
+	 *  @retval VR_OK           Success
+	 *  @retval VR_OUTOFMEMORY  Out of memory
+	 *  @see                    ClearAccumulatedLines, OutputAccumulatedLines, RunAccumulated
+	 */
+	VRESULT                  AccumulateLine(const char *line);
+
+	/**
+	 *  Appends the given error message and increments the error count.
+	 *  Internally used to create an error condition.
+	 *  @param error_msg        The error message to display.
+	 *  @return                 The current error count.
+	 *  @see                    GetErrorString, GetErrorStringLine, GetErrorStringLineCount, OutputErrorString
+	 */
+	size_t                   AddError(const char* error_msg);
+
+	/**
+	 *  Appends the given warning message and increments the warning count.
+	 *  Internally used to create a warning condition.
+	 *  @param warning_msg      The warning message to display.
+	 *  @return                 The current warning count.
+	 *  @see                    GetWarningString, GetWarningStringLine, GetWarningStringLineCount, OutputWarningString
+	 */
+	size_t                   AddWarning(const char* warning_msg);
+
+	/**
+	 *  Clears the accumulated input buffer.  Input buffer is accumulated from calls to @ref AccumulateLine.
+	 *  @see                    AccumulateLine, GetAccumulatedLines, OutputAccumulatedLines, RunAccumulated
+	 */
+	void                     ClearAccumulatedLines(void);
+
+	/**
+	 *  Retrieve the accumulated input string.  The accumulated input string can be run
+	 *  with @ref RunAccumulated.
+	 *  @return                 The accumulated input string.
+	 *  @see                    AccumulateLine, ClearAccumulatedLines, OutputAccumulatedLines, RunAccumulated
+	 */
+	const std::string&       GetAccumulatedLines(void);
+
+	/**
+	 *  Retrieves the given component.
+	 *  @param n                The zero-based index of the component to retrieve.
+	 *  @return                 A null terminated string containing the given component.
+	 *                          Returns an empty string if n is out of range.
+	 *  @see                    GetComponentCount, ListComponents
+	 */
+	const char*              GetComponent(int n);
+
+	/**
+	 *  Retrieves the number of components in the current list of components.
+	 *  @return                 The current count of components.
+	 *  @see                    GetComponent, ListComponents
+	 */
+	size_t                   GetComponentCount(void);
+
+	/**
+	 *  Retrieves the current <B>SELECTED_OUTPUT</B> user number.  The initial setting is 1.
+	 *  @return                 The current <b>SELECTED_OUTPUT</b> user number.
+	 *  @see                    GetSelectedOutputColumnCount, GetSelectedOutputFileName, GetSelectedOutputRowCount, GetSelectedOutputString, GetSelectedOutputStringLine, GetSelectedOutputStringLineCount, GetSelectedOutputValue, SetCurrentSelectedOutputUserNumber
+	 */
+	int                      GetCurrentSelectedOutputUserNumber(void)const;
+
+	/**
+	 *  Retrieves the name of the dump file.  This file name is used if not specified within <B>DUMP</B> input.
+	 *  The default value is <B><I>dump.id.out</I></B>, where id is obtained from @ref GetId.
+	 *  @return filename        The name of the file to write <B>DUMP</B> output to.
+	 *  @see                    GetDumpFileOn, GetDumpString, GetDumpStringOn, GetDumpStringLine, GetDumpStringLineCount, SetDumpFileName, SetDumpFileOn, SetDumpStringOn
+	 */
+	const char*              GetDumpFileName(void)const;
+
+	/**
+	 *  Retrieves the current value of the dump file switch.
+	 *  @retval true            Output is written to the <B>DUMP</B> (<B><I>dump.id.out</I></B> if unspecified, where id is obtained from @ref GetId) file.
+	 *  @retval false           No output is written.
+	 *  @see                    GetDumpStringLine, GetDumpStringLineCount, GetDumpStringOn, GetDumpString, SetDumpFileOn, SetDumpStringOn
+	 */
+	bool                     GetDumpFileOn(void)const;
+
+	/**
+	 *  Retrieves the string buffer containing <b>DUMP</b> output.
+	 *  @return                 A null terminated string containing <b>DUMP</b> output.
+	 *  @pre                    
+	 *      @ref SetDumpStringOn must have been set to true in order to receive <b>DUMP</b> output.
+	 *  @see                    GetDumpStringLine, GetDumpFileOn, GetDumpStringLineCount, GetDumpStringOn, SetDumpFileOn, SetDumpStringOn
+	 */
+	const char*              GetDumpString(void)const;
+
+	/**
+	 *  Retrieves the given dump line.
+	 *  @param n                The zero-based index of the line to retrieve.
+	 *  @return                 A null terminated string containing the given line.
+	 *                          Returns an empty string if n is out of range.
+	 *  @pre                    @ref SetDumpStringOn must have been set to true.
+	 *  @see                    GetDumpFileOn, GetDumpString, GetDumpStringLineCount, GetDumpStringOn, SetDumpFileOn, SetDumpStringOn
+	 */
+	const char*              GetDumpStringLine(int n);
+
+	/**
+	 *  Retrieves the number of lines in the current dump string buffer.
+	 *  @return                 The number of lines.
+	 *  @pre                    @ref SetDumpStringOn must have been set to true.
+	 *  @see                    GetDumpFileOn, GetDumpString, GetDumpStringLine, GetDumpStringOn, SetDumpFileOn, SetDumpStringOn
+	 */
+	int                      GetDumpStringLineCount(void)const;
+
+	/**
+	 *  Retrieves the current value of the dump string switch.
+	 *  @retval true            Output defined by the <B>DUMP</B> keyword is stored.
+	 *  @retval false           No output is stored.
+	 *  @see                    GetDumpFileOn, GetDumpString, GetDumpStringLine, GetDumpStringLineCount, SetDumpFileOn, SetDumpStringOn
+	 */
+	bool                     GetDumpStringOn(void)const;
+
+	/**
+	 *  Retrieves the name of the error file. The default value is <B><I>phreeqc.id.err</I></B>, where id is obtained from @ref GetId.
+	 *  @return filename        The name of the file to write to.
+	 *  @see                    GetErrorFileOn, GetErrorString, GetErrorStringOn, GetErrorStringLine, GetErrorStringLineCount, SetErrorFileName, SetErrorFileOn, SetErrorStringOn
+	 */
+	const char*              GetErrorFileName(void)const;
+
+	/**
+	 *  Retrieves the current value of the error file switch.
+	 *  @retval true            Errors are written to the <B><I>phreeqc.id.err</I></B> (where id is obtained from @ref GetId) file.
+	 *  @retval false           No errors are written.
+	 *  @see                    SetErrorFileOn
+	 */
+	bool                     GetErrorFileOn(void)const;
+
+	/**
+	 *  Retrieves the current value of the error switch.
+	 *  @retval true            Error messages are sent to the error file and to the string buffer
+	 *  @retval false           No errors are sent.
+	 *  @see                    SetErrorOn
+	 */
+	bool                     GetErrorOn(void)const;
+
+	/**
+	 *  Retrieves the error messages from the last call to @ref RunAccumulated, @ref RunFile, @ref RunString, @ref LoadDatabase, or @ref LoadDatabaseString.
+	 *  @return                 A null terminated string containing error messages.
+	 *  @see                    GetErrorStringLine, GetErrorStringLineCount, GetErrorFileOn, OutputErrorString, SetErrorFileOn
+	 */
+	const char*              GetErrorString(void);
+
+	/**
+	 *  Retrieves the given error line.
+	 *  @return                 A null terminated string containing the given line of the error string buffer.
+	 *  @param n                The zero-based index of the line to retrieve.
+	 *  @see                    GetErrorStringLineCount, OutputErrorString
+	 */
+	const char*              GetErrorStringLine(int n);
+
+	/**
+	 *  Retrieves the number of lines in the current error string buffer.
+	 *  @return                 The number of lines.
+	 *  @see                    GetErrorStringLine, OutputErrorString
+	 */
+	int                      GetErrorStringLineCount(void)const;
+
+	/**
+	 *  Retrieves the current value of the error string switch.
+	 *  @retval true            Error output is stored.
+	 *  @retval false           No error output is stored.
+	 *  @see                    GetErrorFileOn, GetErrorString, GetErrorStringLine, GetErrorStringLineCount, SetErrorFileOn, SetErrorStringOn
+	 */
+	bool                     GetErrorStringOn(void)const;
+
+	/**
+	 *  Retrieves the id of this object.  Each instance receives an id which is incremented for each instance
+	 *  starting with the value zero.
+	 *  @return                 The id.
+	 */
+	int                      GetId(void)const;
+
+	/**
+	 *  Retrieves the name of the log file. The default value is <B><I>phreeqc.id.log</I></B>, where id is obtained from @ref GetId.
+	 *  @return filename        The name of the file to write to.
+	 *  @see                    GetLogFileOn, GetLogString, GetLogStringOn, GetLogStringLine, GetLogStringLineCount, SetLogFileName, SetLogFileOn, SetLogStringOn
+	 */
+	const char*              GetLogFileName(void)const;
+
+	/**
+	 *  Retrieves the current value of the log file switch.
+	 *  @retval true            Log messages are written to the <B><I>phreeqc.id.log</I></B> (where id is obtained from @ref GetId) file.
+	 *  @retval false           No log messages are written.
+	 *  @remarks
+	 *      Logging must be enabled through the use of the KNOBS -logfile option in order to receive any log messages.
+	 *  @see                    SetLogFileOn
+	 */
+	bool                     GetLogFileOn(void)const;
+
+	/**
+	 *  Retrieves the string buffer containing phreeqc log output.
+	 *  @return                 A null terminated string containing log output.
+	 *  @pre
+	 *      @ref SetLogStringOn must have been set to true and enabled through the use of the KNOBS -logfile option in order to receive any log messages.
+	 *  @see                    GetLogStringLine, GetLogFileOn, GetLogStringLineCount, GetLogStringOn, SetLogFileOn, SetLogStringOn
+	 */
+	const char*              GetLogString(void)const;
+
+	/**
+	 *  Retrieves the given log line.
+	 *  @param n                The zero-based index of the line to retrieve.
+	 *  @return                 A null terminated string containing the given line.
+	 *                          Returns an empty string if n is out of range.
+	 *  @pre                    @ref SetLogStringOn must have been set to true and enabled through the use of the KNOBS -logfile option in order to receive any log messages.
+	 *  @see                    GetLogFileOn, GetLogString, GetLogStringLineCount, GetLogStringOn, SetLogFileOn, SetLogStringOn
+	 */
+	const char*              GetLogStringLine(int n)const;
+
+	/**
+	 *  Retrieves the number of lines in the current log string buffer.
+	 *  @return                 The number of lines.
+	 *  @pre                    @ref SetLogStringOn must have been set to true and enabled through the use of the KNOBS -logfile option in order to receive any log messages.
+	 *  @see                    GetLogFileOn, GetLogString, GetLogStringLine, GetLogStringOn, SetLogFileOn, SetLogStringOn
+	 */
+	int                      GetLogStringLineCount(void)const;
+
+	/**
+	 *  Retrieves the current value of the log string switch.
+	 *  @retval true            Log output is stored.
+	 *  @retval false           No log output is stored.
+	 *  @see                    GetLogFileOn, GetLogString, GetLogStringLine, GetLogStringLineCount, SetLogFileOn, SetLogStringOn
+	 */
+	bool                     GetLogStringOn(void)const;
+
+	/**
+	 *  Retrieves the nth user number of the currently defined <B>SELECTED_OUTPUT</B> blocks.
+	 *  @param n                The zero-based index of the <B>SELECTED_OUTPUT</B> user number to retrieve.
+	 *  @return                 The nth defined user number; a negative value indicates an error occurred.
+	 *  @see                    GetCurrentSelectedOutputUserNumber, GetSelectedOutputCount, SetCurrentSelectedOutputUserNumber
+	 */
+	int                      GetNthSelectedOutputUserNumber(int n)const;
+
+	/**
+	 *  Retrieves the name of the output file. The default value is <B><I>phreeqc.id.out</I></B>, where id is obtained from @ref GetId.
+	 *  @return filename        The name of the file to write phreeqc output to.
+	 *  @see                    GetOutputFileOn, GetOutputString, GetOutputStringOn, GetOutputStringLine, GetOutputStringLineCount, SetOutputFileName, SetOutputFileOn, SetOutputStringOn
+	 */
+	const char*              GetOutputFileName(void)const;
+
+	/**
+	 *  Retrieves the current value of the output file switch.
+	 *  @retval true            Output is written to the <B><I>phreeqc.id.out</I></B> (where id is obtained from @ref GetId) file.
+	 *  @retval false           No output is written.
+	 *  @see                    GetOutputFileOn, GetOutputString, GetOutputStringOn, GetOutputStringLine, GetOutputStringLineCount, SetOutputFileName, SetOutputFileOn, SetOutputStringOn
+	 */
+	bool                     GetOutputFileOn(void)const;
+
+	/**
+	 *  Retrieves the string buffer containing phreeqc output.
+	 *  @return                 A null terminated string containing phreeqc output.
+	 *  @pre
+	 *      @ref SetOutputStringOn must have been set to true in order to receive output.
+	 *  @see                    GetOutputStringLine, GetOutputFileOn, GetOutputStringLineCount, GetOutputStringOn, SetOutputFileOn, SetOutputStringOn
+	 */
+	const char*              GetOutputString(void)const;
+
+	/**
+	 *  Retrieves the given output line.
+	 *  @param n                The zero-based index of the line to retrieve.
+	 *  @return                 A null terminated string containing the given line.
+	 *                          Returns an empty string if n is out of range.
+	 *  @pre                    @ref SetOutputStringOn must have been set to true.
+	 *  @see                    GetOutputFileOn, GetOutputString, GetOutputStringLineCount, GetOutputStringOn, SetOutputFileOn, SetOutputStringOn
+	 */
+	const char*              GetOutputStringLine(int n)const;
+
+	/**
+	 *  Retrieves the number of lines in the current output string buffer.
+	 *  @return                 The number of lines.
+	 *  @pre                    @ref SetOutputStringOn must have been set to true.
+	 *  @see                    GetOutputFileOn, GetOutputString, GetOutputStringLine, GetOutputStringOn, SetOutputFileOn, SetOutputStringOn
+	 */
+	int                      GetOutputStringLineCount(void)const;
+
+	/**
+	 *  Retrieves the current value of the output string switch.
+	 *  @retval true            Phreeqc output is stored.
+	 *  @retval false           No phreeqc output is stored.
+	 *  @see                    GetOutputFileOn, GetOutputString, GetOutputStringLine, GetOutputStringLineCount, SetOutputFileOn, SetOutputStringOn
+	 */
+	bool                     GetOutputStringOn(void)const;
+
+	/**
+	 *  Retrieves the number of columns in the current selected-output buffer (see @ref SetCurrentSelectedOutputUserNumber).
+	 *  @return                 The number of columns.
+	 *  @see                    GetCurrentSelectedOutputUserNumber, GetSelectedOutputRowCount, GetSelectedOutputValue, SetCurrentSelectedOutputUserNumber
+	 */
+	int                      GetSelectedOutputColumnCount(void)const;
+
+	/**
+	 *  Retrieves the count of <B>SELECTED_OUTPUT</B> blocks that are currently defined.
+	 *  @return                 The number of <B>SELECTED_OUTPUT</B> blocks.
+	 *  @see                    GetCurrentSelectedOutputUserNumber, GetNthSelectedOutputUserNumber, SetCurrentSelectedOutputUserNumber
+	 */
+	int                      GetSelectedOutputCount(void)const;
+
+	/**
+	 *  Retrieves the name of the current selected output file (see @ref SetCurrentSelectedOutputUserNumber).  This file name is used if not specified within <B>SELECTED_OUTPUT</B> input.
+	 *  The default value is <B><I>selected_n.id.out</I></B>, where id is obtained from @ref GetId.
+	 *  @return filename        The name of the file to write to.
+	 *  @see                    GetCurrentSelectedOutputUserNumber, GetSelectedOutputFileOn, GetSelectedOutputString, GetSelectedOutputStringOn, GetSelectedOutputStringLine, GetSelectedOutputStringLineCount, SetCurrentSelectedOutputUserNumber, SetSelectedOutputFileName, SetSelectedOutputFileOn, SetSelectedOutputStringOn
+	 */
+	const char*              GetSelectedOutputFileName(void)const;
+
+	/**
+	 *  Retrieves the current selected-output file switch (see @ref SetCurrentSelectedOutputUserNumber).
+	 *  @retval true            Output is written to the selected-output (<B><I>selected_n.id.out</I></B> if unspecified, where id is obtained from @ref GetId) file.
+	 *  @retval false           No output is written.
+	 *  @see                    GetSelectedOutputValue, GetSelectedOutputColumnCount, GetSelectedOutputRowCount, SetCurrentSelectedOutputUserNumber, SetSelectedOutputFileOn
+	 */
+	bool                     GetSelectedOutputFileOn(void)const;
+
+	/**
+	 *  Retrieves the number of rows in the current selected-output buffer (see @ref SetCurrentSelectedOutputUserNumber).
+	 *  @return                 The number of rows.
+	 *  @see                    GetCurrentSelectedOutputUserNumber, GetSelectedOutputColumnCount, GetSelectedOutputFileOn, GetSelectedOutputValue, SetCurrentSelectedOutputUserNumber, SetSelectedOutputFileOn
+	 */
+	int                      GetSelectedOutputRowCount(void)const;
+
+	/**
+	 *  Retrieves the string buffer containing <b>SELECTED_OUTPUT</b> for the currently selected user number (see @ref SetCurrentSelectedOutputUserNumber).
+	 *  @return                 A null terminated string containing <b>SELECTED_OUTPUT</b>.
+	 *  @pre
+	 *      @ref SetSelectedOutputStringOn must have been set to true in order to receive <b>SELECTED_OUTPUT</b>.
+	 *  @see                    GetCurrentSelectedOutputUserNumber, GetSelectedOutputStringLine, GetSelectedOutputFileOn, GetSelectedOutputStringLineCount, GetSelectedOutputStringOn, GetSelectedOutputString, SetCurrentSelectedOutputUserNumber, SetSelectedOutputFileOn, SetSelectedOutputStringOn
+	 */
+	const char*              GetSelectedOutputString(void)const;
+
+	/**
+	 *  Retrieves the given selected output line of the currently selected user number (see @ref SetCurrentSelectedOutputUserNumber).
+	 *  @param n                The zero-based index of the line to retrieve.
+	 *  @return                 A null terminated string containing the given line.
+	 *                          Returns an empty string if n is out of range.
+	 *  @pre                    @ref SetSelectedOutputStringOn must have been set to true.
+	 *  @see                    GetCurrentSelectedOutputUserNumber, GetSelectedOutputFileOn, GetSelectedOutputString, GetSelectedOutputStringLineCount, GetSelectedOutputStringOn, SetCurrentSelectedOutputUserNumber, SetSelectedOutputFileOn, SetSelectedOutputStringOn
+	 */
+	const char*              GetSelectedOutputStringLine(int n);
+
+	/**
+	 *  Retrieves the number of lines in the current selected output string buffer (see @ref SetCurrentSelectedOutputUserNumber).
+	 *  @return                 The number of lines.
+	 *  @pre                    @ref SetSelectedOutputStringOn must have been set to true.
+	 *  @see                    GetCurrentSelectedOutputUserNumber, GetSelectedOutputFileOn, GetSelectedOutputString, GetSelectedOutputStringLine, GetSelectedOutputStringOn, SetCurrentSelectedOutputUserNumber, SetSelectedOutputFileOn, SetSelectedOutputStringOn
+	 */
+	int                      GetSelectedOutputStringLineCount(void)const;
+
+	/**
+	 *  Retrieves the value of the current selected output string switch (see @ref SetCurrentSelectedOutputUserNumber).
+	 *  @retval true            Output defined by the <B>SELECTED_OUTPUT</B> keyword is stored.
+	 *  @retval false           No output is stored.
+	 *  @see                    GetSelectedOutputFileOn, GetSelectedOutputString, GetSelectedOutputStringLine, GetSelectedOutputStringLineCount, SetCurrentSelectedOutputUserNumber, SetSelectedOutputFileOn, SetSelectedOutputStringOn
+	 */
+	bool                     GetSelectedOutputStringOn(void)const;
+
+	/**
+	 *  Returns the @c VAR associated with the specified row and column.  The current <b>SELECTED_OUTPUT</b> block is set using the @ref SetCurrentSelectedOutputUserNumber method.
+	 *  @param row              The row index.
+	 *  @param col              The column index.
+	 *  @param pVAR             Pointer to the @c VAR to receive the requested data.
+	 *  @retval VR_OK           Success.
+	 *  @retval VR_INVALIDROW   The given row is out of range.
+	 *  @retval VR_INVALIDCOL   The given column is out of range.
+	 *  @retval VR_OUTOFMEMORY  Memory could not be allocated.
+	 *  @retval VR_BADINSTANCE  The given id is invalid.
+	 *  @see                    GetCurrentSelectedOutputUserNumber, GetSelectedOutputColumnCount, GetSelectedOutputFileOn, GetSelectedOutputRowCount, GetSelectedOutputValue2, SetCurrentSelectedOutputUserNumber, SetSelectedOutputFileOn
+	 *  @remarks
+	 *      Row 0 contains the column headings to the selected_ouput.
+	 *  @par Examples:
+	 *  The headings will include a suffix and/or prefix in order to differentiate the
+	 *  columns.
+	 *  @htmlonly
+	<p>
+	<table border=1>
+
+	<TR VALIGN="top">
+	<TH width=65%>
+	Input
+	</TH>
+	<TH width=35%>
+	Headings
+	</TH>
+	</TR>
+
+	<TR VALIGN="top">
+	<TD width=65%>
+	<CODE><PRE>
+	  SELECTED_OUTPUT
+		-reset false
+		-totals Ca Na
+	</PRE></CODE>
+	</TD>
+	<TD width=35%>
+	<CODE><PRE>
+	  Ca(mol/kgw)  Na(mol/kgw)
+	</PRE></CODE>
+	</TD>
+	</TR>
+
+	<TR VALIGN="top">
+	<TD width=65%>
+	<CODE><PRE>
+	  SELECTED_OUTPUT
+		-reset false
+		-molalities Fe+2 Hfo_sOZn+
+	</PRE></CODE>
+	</TD>
+	<TD width=35%>
+	<CODE><PRE>
+	  m_Fe+2(mol/kgw)  m_Hfo_sOZn+(mol/kgw)
+	</PRE></CODE>
+	</TD>
+	</TR>
+
+	<TR VALIGN="top">
+	<TD width=65%>
+	<CODE><PRE>
+	  SELECTED_OUTPUT
+		-reset false
+		-activities H+ Ca+2
+	</PRE></CODE>
+	</TD>
+	<TD width=35%>
+	<CODE><PRE>
+	  la_H+  la_Ca+2
+	</PRE></CODE>
+	</TD>
+	</TR>
+
+	<TR VALIGN="top">
+	<TD width=65%>
+	<CODE><PRE>
+	  SELECTED_OUTPUT
+		-reset false
+		-equilibrium_phases Calcite Dolomite
+	</PRE></CODE>
+	</TD>
+	<TD width=35%>
+	<CODE><PRE>
+	  Calcite  d_Calcite  Dolomite  d_Dolomite
+	</PRE></CODE>
+	</TD>
+	</TR>
+
+	<TR VALIGN="top">
+	<TD width=65%>
+	<CODE><PRE>
+	  SELECTED_OUTPUT
+		-reset false
+		-saturation_indices CO2(g) Siderite
+	</PRE></CODE>
+	</TD>
+	<TD width=35%>
+	<CODE><PRE>
+	  si_CO2(g)  si_Siderite
+	</PRE></CODE>
+	</TD>
+	</TR>
+
+	<TR VALIGN="top">
+	<TD width=65%>
+	<CODE><PRE>
+	  SELECTED_OUTPUT
+		-reset false
+		-gases CO2(g) N2(g)
+	</PRE></CODE>
+	</TD>
+	<TD width=35%>
+	<CODE><PRE>
+	  pressure "total mol" volume g_CO2(g) g_N2(g)
+	</PRE></CODE>
+	</TD>
+	</TR>
+
+	<TR VALIGN="top">
+	<TD width=65%>
+	<CODE><PRE>
+	  SELECTED_OUTPUT
+		-reset false
+		-kinetic_reactants CH2O Pyrite
+	</PRE></CODE>
+	</TD>
+	<TD width=35%>
+	<CODE><PRE>
+	  k_CH2O dk_CH2O k_Pyrite dk_Pyrite
+	</PRE></CODE>
+	</TD>
+	</TR>
+
+	<TR VALIGN="top">
+	<TD width=65%>
+	<CODE><PRE>
+	  SELECTED_OUTPUT
+		-reset false
+		-solid_solutions CaSO4 SrSO4
+	</PRE></CODE>
+	</TD>
+	<TD width=35%>
+	<CODE><PRE>
+	  s_CaSO4 s_SrSO4
+	</PRE></CODE>
+	</TD>
+	</TR>
+
+	</table>
+	 *  @endhtmlonly
+	 */
+	VRESULT                  GetSelectedOutputValue(int row, int col, VAR* pVAR);
+
+	/**
+	 *  Returns the associated data with the specified row and column.  The current <b>SELECTED_OUTPUT</b> block is set using the @ref SetCurrentSelectedOutputUserNumber method.
+	 *  @param row               The row index.
+	 *  @param col               The column index.
+	 *  @param vtype             Receives the variable type.  See @ref VAR_TYPE.
+	 *  @param dvalue            Receives the numeric value when (VTYPE=@ref TT_DOUBLE) or (VTYPE=@ref TT_LONG).
+	 *  @param svalue            Receives the string variable when (VTYPE=@ref TT_STRING).  When (VTYPE=@ref TT_DOUBLE) or (VTYPE=@ref TT_LONG) this variable is filled with a string equivalent of DVALUE.
+	 *  @param svalue_length     The length of the svalue buffer.
+	 *  @retval IPQ_OK           Success.
+	 *  @retval IPQ_INVALIDROW   The given row is out of range.
+	 *  @retval IPQ_INVALIDCOL   The given column is out of range.
+	 *  @retval IPQ_OUTOFMEMORY  Memory could not be allocated.
+	 *  @retval IPQ_BADINSTANCE  The given id is invalid.
+	 *  @see                     GetSelectedOutputFileOn, GetSelectedOutputColumnCount, GetSelectedOutputRowCount, GetSelectedOutputValue, SetCurrentSelectedOutputUserNumber, SetSelectedOutputFileOn
+	 *  @remarks
+	 *  Row 0 contains the column headings to the selected_ouput.
+	 *  @par Examples:
+	 *  See @ref GetSelectedOutputValue.
+	 */
+	VRESULT                  GetSelectedOutputValue2(int row, int col, int *vtype, double* dvalue, char* svalue, unsigned int svalue_length);
+
+	/**
+	 *  Retrieves the string buffer containing the version in the form of X.X.X-XXXX.
+	 *  @return                 A null terminated string containing the IPhreeqc version number.
+	 */
+	static const char*       GetVersionString(void);
+
+	/**
+	 *  Retrieves the warning messages from the last call to @ref RunAccumulated, @ref RunFile, @ref RunString, @ref LoadDatabase, or @ref LoadDatabaseString.
+	 *  @return                 A null terminated string containing warning messages.
+	 *  @see                    GetWarningStringLine, GetWarningStringLineCount, OutputWarningString
+	 */
+	const char*              GetWarningString(void);
+
+	/**
+	 *  Retrieves the given warning line.
+	 *  @param n                The zero-based index of the line to retrieve.
+	 *  @return                 A null terminated string containing the given warning line message.
+	 *  @see                    GetWarningStringLineCount, OutputWarningString
+	 */
+	const char*              GetWarningStringLine(int n);
+
+	/**
+	 *  Retrieves the number of lines in the current warning string buffer.
+	 *  @return                 The number of lines.
+	 *  @see                    GetWarningStringLine, GetWarningString, OutputWarningString
+	 */
+	int                      GetWarningStringLineCount(void)const;
+
+	/**
+	 *  Retrieves the current list of components.
+	 *  @return                 The current list of components.
+	 *  @see                    GetComponent, GetComponentCount
+	 */
+	std::list< std::string > ListComponents(void);
+
+	/**
+	 *  Load the specified database file into phreeqc.
+	 *  @param filename         The name of the phreeqc database to load.
+	 *                          The full path (or relative path with respect to the working directory) will be required if the file is not
+	 *                          in the current working directory.
+	 *  @return                 The number of errors encountered.
+	 *  @see                    LoadDatabaseString
+	 *  @remarks
+	 *      All previous definitions are cleared.
+	 */
+	int                      LoadDatabase(const char* filename);
+
+	/**
+	 *  Load the specified string as a database into phreeqc.
+	 *  @param input            String containing data to be used as the phreeqc database.
+	 *  @return                 The number of errors encountered.
+	 *  @see                    LoadDatabaseString
+	 *  @remarks
+	 *      All previous definitions are cleared.
+	 */
+	int                      LoadDatabaseString(const char* input);
+
+	/**
+	 *  Output the accumulated input buffer to stdout.  The input buffer can be run with a call to @ref RunAccumulated.
+	 *  @see                    AccumulateLine, ClearAccumulatedLines, RunAccumulated
+	 */
+	void                     OutputAccumulatedLines(void);
+
+	/**
+	 *  Output the error messages normally stored in the <B><I>phreeqc.id.err</I></B> (where id is obtained from @ref GetId)
+	 *  file to stdout.
+	 *  @see                    GetErrorStringLine, GetErrorStringLineCount, GetErrorFileOn, SetErrorFileOn
+	 */
+	void                     OutputErrorString(void);
+
+	/**
+	 *  Output the warning messages to stdout.
+	 *  @see                    GetWarningStringLine, GetWarningStringLineCount, GetWarningString
+	 */
+	void                     OutputWarningString(void);
+
+	/**
+	 *  Runs the input buffer as defined by calls to @ref AccumulateLine.
+	 *  @return                 The number of errors encountered.
+	 *  @see                    AccumulateLine, ClearAccumulatedLines, OutputAccumulatedLines, RunFile, RunString
+	 *  @remarks
+	 *      The accumulated input is cleared at the next call to @ref AccumulateLine.
+	 *  @pre
+	 *      @ref LoadDatabase/@ref LoadDatabaseString must have been called and returned 0 (zero) errors.
+	 */
+	int                      RunAccumulated(void);
+
+	/**
+	 *  Runs the specified phreeqc input file.
+	 *  @param filename         The name of the phreeqc input file to run.
+	 *  @return                 The number of errors encountered during the run.
+	 *  @see                    RunAccumulated, RunString
+	 *  @pre
+	 *      @ref LoadDatabase/@ref LoadDatabaseString must have been called and returned 0 (zero) errors.
+	 */
+	int                      RunFile(const char* filename);
+
+	/**
+	 *  Runs the specified string as input to phreeqc.
+	 *  @param input            String containing phreeqc input.
+	 *  @return                 The number of errors encountered during the run.
+	 *  @see                    RunAccumulated, RunFile
+	 *  @pre
+	 *      @ref LoadDatabase/@ref LoadDatabaseString must have been called and returned 0 (zero) errors.
+	 */
+	int                      RunString(const char* input);
+
+	/**
+	 *  Sets a C callback function for Basic programs. The syntax for the Basic command is
+	 *  10 result = CALLBACK(x1, x2, string$)
+	 *  The syntax for the C function is
+	 *  double my_callback(double x1, double x2, const char * string)
+	 *  @param fcn              The name of a user-defined function.
+	 *  @param cookie1          A user defined value to be passed to the callback function.
+	 *  @see                    SetBasicFortranCallback
+	 */
+	void                     SetBasicCallback(double (*fcn)(double x1, double x2, const char *str, void *cookie), void * cookie1);
+
+	/**
+	 *  Sets a Fortran callback function for Basic programs. The syntax for the Basic command is
+	 *  10 result = CALLBACK(x1, x2, string$)
+	 *  The syntax for the Fortran function is
+	 *  real(kind=8) my_callback(x1, x2, string), where x1 and x2 are real(kind=8) and string is a character variable.
+	 *  @param fcn              The name of a user-defined function.
+	 *  @see                    SetBasicCallback
+	 */
+#ifdef IPHREEQC_NO_FORTRAN_MODULE
+	void                     SetBasicFortranCallback(double (*fcn)(double *x1, double *x2, const char *str, size_t l));
+#else
+	void                     SetBasicFortranCallback(double (*fcn)(double *x1, double *x2, const char *str, int l));
+#endif
+
+	/**
+	 *  Sets the current <B>SELECTED_OUTPUT</B> user number for use in subsequent calls to (@ref GetSelectedOutputColumnCount, 
+     *  @ref GetSelectedOutputFileName, @ref GetSelectedOutputRowCount, @ref GetSelectedOutputString, @ref GetSelectedOutputStringLine, 
+     *  @ref GetSelectedOutputStringLineCount, @ref GetSelectedOutputValue, @ref GetSelectedOutputValue2) routines.
+	 *  The initial setting is 1.
+	 *  @param n                The user number as specified in the <B>SELECTED_OUTPUT</B> block.
+	 *  @retval VR_OK           Success
+	 *  @retval VR_INVALIDARG   The given user number has not been defined.
+	 *  @see                    GetCurrentSelectedOutputUserNumber, GetSelectedOutputColumnCount, GetSelectedOutputFileName, GetSelectedOutputRowCount, GetSelectedOutputString, GetSelectedOutputStringLine, GetSelectedOutputStringLineCount, GetSelectedOutputValue
+	 */
+	VRESULT                  SetCurrentSelectedOutputUserNumber(int n);
+
+	/**
+	 *  Sets the name of the dump file.  This file name is used if not specified within <B>DUMP</B> input.
+	 *  The default value is <B><I>dump.id.out</I></B>, where id is obtained from @ref GetId.
+	 *  @param filename         The name of the file to write <B>DUMP</B> output to.
+	 *  @see                    GetDumpFileName, GetDumpFileOn, GetDumpString, GetDumpStringOn, GetDumpStringLine, GetDumpStringLineCount, SetDumpStringOn
+	 */
+	void                     SetDumpFileName(const char *filename);
+
+	/**
+	 *  Sets the dump file switch on or off.  This switch controls whether or not phreeqc writes to the <B>DUMP</B> (<B><I>dump.id.out</I></B>
+	 *  if unspecified, where id is obtained from @ref GetId) file.
+	 *  The initial setting is false.
+	 *  @param bValue           If true, turns on output to the <B>DUMP</B> file;
+	 *                          if false, turns off output to the <B>DUMP</B> file.
+	 *  @see                    GetDumpFileOn, GetDumpString, GetDumpStringOn, GetDumpStringLine, GetDumpStringLineCount, SetDumpStringOn
+	 */
+	void                     SetDumpFileOn(bool bValue);
+
+	/**
+	 *  Sets the dump string switch on or off.  This switch controls whether or not the data normally sent
+	 *  to the dump file are stored in a buffer for retrieval.  The initial setting is false.
+	 *  @param bValue           If true, captures the output defined by the <B>DUMP</B> keyword into a string buffer;
+	 *                          if false, output defined by the <B>DUMP</B> keyword is not captured to a string buffer.
+	 *  @see                    GetDumpFileOn, GetDumpString, GetDumpStringOn, GetDumpStringLine, GetDumpStringLineCount, SetDumpFileOn
+	 */
+	void                     SetDumpStringOn(bool bValue);
+
+	/**
+	 *  Sets the name of the error file. The default value is <B><I>phreeqc.id.err</I></B>, where id is obtained from @ref GetId.
+	 *  @param filename         The name of the file to write error output to.
+	 *  @see                    GetErrorFileName, GetErrorFileOn, GetErrorString, GetErrorStringOn, GetErrorStringLine, GetErrorStringLineCount, SetErrorFileOn, SetErrorStringOn
+	 */
+	void                     SetErrorFileName(const char *filename);
+
+	/**
+	 *  Sets the error file switch on or off.  This switch controls whether or not
+	 *  error messages are written to the <B><I>phreeqc.id.err</I></B> (where id is obtained from @ref GetId) file.
+	 *  The initial setting is true.
+	 *  @param bValue           If true, writes errors to the error file; if false, no errors are written to the error file.
+	 *  @see                    GetErrorStringLine, GetErrorStringLineCount, GetErrorFileOn, OutputErrorString
+	 */
+	void                     SetErrorFileOn(bool bValue);
+
+	/**
+	 *  Sets the error switch on or off.  This switch controls whether
+	 *  error messages are are generated and displayed.
+	 *  The initial setting is true.
+	 *  @param bValue           If true, error messages are sent to the error file and error string buffer; if false, no error messages are generated.
+	 *  @see                    GetErrorOn, GetErrorStringLine, GetErrorStringLineCount, GetErrorFileOn, OutputErrorString
+	 */
+	void                     SetErrorOn(bool bValue);
+
+	/**
+	 *  Sets the error string switch on or off.  This switch controls whether or not the data normally sent
+	 *  to the error file are stored in a buffer for retrieval.  The initial setting is true.
+	 *  @param bValue           If true, captures error output into a string buffer; if false, error output is not captured to a string buffer.
+	 *  @see                    GetErrorFileOn, GetErrorString, GetErrorStringOn, GetErrorStringLine, GetErrorStringLineCount, SetErrorFileOn
+	 */
+	void                     SetErrorStringOn(bool bValue);
+
+	/**
+	 *  Sets the name of the log file. The default value is <B><I>phreeqc.id.log</I></B>, where id is obtained from @ref GetId.
+	 *  @param filename         The name of the file to write log output to.
+	 *  @see                    GetLogFileName, GetLogFileOn, GetLogString, GetLogStringOn, GetLogStringLine, GetLogStringLineCount, SetLogFileOn, SetLogStringOn
+	 */
+	void                     SetLogFileName(const char *filename);
+
+	/**
+	 *  Sets the log file switch on or off.  This switch controls whether or not phreeqc
+	 *  writes log messages to the <B><I>phreeqc.id.log</I></B> (where id is obtained from @ref GetId) file.  The initial setting is false.
+	 *  @param bValue           If true, turns on output to the log file; if false, no log messages are written to the log file.
+	 *  @remarks
+	 *      Logging must be enabled through the use of the KNOBS -logfile option in order to receive any log messages.
+	 *  @see                    GetLogFileOn
+	 */
+	void                     SetLogFileOn(bool bValue);
+
+	/**
+	 *  Sets the log string switch on or off.  This switch controls whether or not the data normally sent
+	 *  to the log file are stored in a buffer for retrieval.  The initial setting is false.
+	 *  @param bValue           If true, captures log output into a string buffer; if false, log output is not captured to a string buffer.
+	 *  @see                    GetLogFileOn, GetLogString, GetLogStringOn, GetLogStringLine, GetLogStringLineCount, SetLogFileOn
+	 */
+	void                     SetLogStringOn(bool bValue);
+
+	/**
+	 *  Sets the name of the output file. The default value is <B><I>phreeqc.id.out</I></B>, where id is obtained from @ref GetId.
+	 *  @param filename         The name of the file to write phreeqc output to.
+	 *  @see                    GetOutputFileName, GetOutputFileOn, GetOutputString, GetOutputStringOn, GetOutputStringLine, GetOutputStringLineCount, SetOutputFileOn, SetOutputStringOn
+	 */
+	void                     SetOutputFileName(const char *filename);
+
+	/**
+	 *  Sets the output file switch on or off.  This switch controls whether or not phreeqc
+	 *  writes to the <B><I>phreeqc.id.out</I></B> file (where id is obtained from @ref GetId).  This is the output that is normally generated
+	 *  when phreeqc is run.  The initial setting is false.
+	 *  @param bValue           If true, writes output to the output file; if false, no output is written to the output file.
+	 *  @see                    GetOutputFileOn
+	 */
+	void                     SetOutputFileOn(bool bValue);
+
+	/**
+	 *  Sets the output string switch on or off.  This switch controls whether or not the data normally sent
+	 *  to the output file are stored in a buffer for retrieval.  The initial setting is false.
+	 *  @param bValue           If true, captures output into a string buffer; if false, output is not captured to a string buffer.
+	 *  @see                    GetOutputFileOn, GetOutputString, GetOutputStringOn, GetOutputStringLine, GetOutputStringLineCount, SetOutputFileOn
+	 */
+	void                     SetOutputStringOn(bool bValue);
+
+	/**
+	 *  Sets the name of the current selected output file (see @ref SetCurrentSelectedOutputUserNumber).  This file name is used if not specified within <B>SELECTED_OUTPUT</B> input.
+	 *  The default value is <B><I>selected_n.id.out</I></B>, where id is obtained from @ref GetId.
+	 *  @param filename         The name of the file to write <B>SELECTED_OUTPUT</B> output to.
+	 *  @see                    GetSelectedOutputFileName, GetSelectedOutputFileOn, GetSelectedOutputString, GetSelectedOutputStringOn, GetSelectedOutputStringLine, GetSelectedOutputStringLineCount, SetCurrentSelectedOutputUserNumber, SetSelectedOutputStringOn
+	 */
+	void                     SetSelectedOutputFileName(const char *filename);
+
+	/**
+	 *  Sets the selected-output file switch on or off.  This switch controls whether or not phreeqc writes output to
+	 *  the current <B>SELECTED_OUTPUT</B> (<B><I>selected_n.id.out</I></B> if unspecified, where id is obtained from @ref GetId) file.
+	 *  The initial setting is false.
+	 *  @param bValue           If true, writes output to the selected-output file; if false, no output is written to the selected-output file.
+	 *  @see                    GetSelectedOutputColumnCount, GetSelectedOutputFileOn, GetSelectedOutputRowCount, GetSelectedOutputValue, SetCurrentSelectedOutputUserNumber
+	 */
+	void                     SetSelectedOutputFileOn(bool bValue);
+
+	/**
+	 *  Sets the selected output string switch on or off.  This switch controls whether or not the data normally sent
+	 *  to the current <B>SELECTED_OUTPUT</B> file (see @ref SetCurrentSelectedOutputUserNumber) are stored in a buffer for retrieval.
+	 *  The initial setting is false.
+	 *  @param bValue           If true, captures the output defined by the <B>SELECTED_OUTPUT</B> keyword into a string buffer;
+	 *                          if false, output defined by the <B>SELECTED_OUTPUT</B> keyword is not captured to a string buffer.
+	 *  @see                    GetSelectedOutputFileOn, GetSelectedOutputString, GetSelectedOutputStringOn, GetSelectedOutputStringLine, GetSelectedOutputStringLineCount, SetCurrentSelectedOutputUserNumber, SetSelectedOutputFileOn
+	 */
+	void                     SetSelectedOutputStringOn(bool bValue);
+
+public:
+	// overrides
+	virtual void error_msg(const char *str, bool stop=false);
+	virtual void log_msg(const char * str);
+	virtual void output_msg(const char *str);
+	virtual void punch_msg(const char *str);
+	virtual void screen_msg(const char *str);
+	virtual void warning_msg(const char *str);
+
+	virtual void fpunchf(const char *name, const char *format, double d);
+	virtual void fpunchf(const char *name, const char *format, char * d);
+	virtual void fpunchf(const char *name, const char *format, int d);
+	virtual void fpunchf_end_row(const char *format);
+
+	virtual bool output_open(const char *file_name, std::ios_base::openmode mode = std::ios_base::out);
+	virtual bool punch_open(const char *file_name, std::ios_base::openmode mode = std::ios_base::out, int n_user = 1);
+
+protected:
+	int EndRow(void);
+	void AddSelectedOutput(const char* name, const char* format, va_list argptr);
+	void UnLoadDatabase(void);
+
+	void check_database(const char* sz_routine);
+	int close_input_files(void);
+	int close_output_files(void);
+	void open_output_files(const char* sz_routine);
+
+	void do_run(const char* sz_routine, std::istream* pis, PFN_PRERUN_CALLBACK pfn_pre, PFN_POSTRUN_CALLBACK pfn_post, void *cookie);
+
+	void update_errors(void);
+
+	int load_db(const char* filename);
+	int load_db_str(const char* filename);
+	int test_db(void);
+
+	bool get_sel_out_file_on(int n)const;
+	std::string sel_file_name(int n_user);
+
+	std::string create_file_name(const char *prefix, const char *suffix);
+
+	bool get_sel_out_string_on(int n)const;
+
+protected:
+#if defined(_MSC_VER)
+/* disable warning C4251: 'identifier' : class 'type' needs to have dll-interface to be used by clients of class 'type2' */
+#pragma warning(disable:4251)
+#endif
+
+	bool                       DatabaseLoaded;
+	bool                       ClearAccumulated;
+	bool                       UpdateComponents;
+	std::map< int, bool >      SelectedOutputFileOnMap;
+
+	bool                       OutputFileOn;
+
+	bool                       LogFileOn;
+	bool                       ErrorFileOn;
+	bool                       DumpOn;
+
+	bool                       DumpStringOn;
+
+	bool                       OutputStringOn;
+	std::string                OutputString;
+	std::vector< std::string > OutputLines;
+
+	bool                       LogStringOn;
+	std::string                LogString;
+	std::vector< std::string > LogLines;
+
+	bool                       ErrorStringOn;
+	IErrorReporter            *ErrorReporter;
+	std::string                ErrorString;
+	std::vector< std::string > ErrorLines;
+
+	bool                       WarningStringOn;
+	IErrorReporter            *WarningReporter;
+	std::string                WarningString;
+	std::vector< std::string > WarningLines;
+
+	int                                           CurrentSelectedOutputUserNumber;
+	std::map< int, CSelectedOutput* >             SelectedOutputMap;
+	std::string                                   StringInput;
+
+	std::string                DumpString;
+	std::vector< std::string > DumpLines;
+
+	std::list< std::string >   Components;
+	std::list< std::string >   EquilibriumPhasesList;
+	const std::list<std::string> &GetEquilibriumPhasesList() { return this->EquilibriumPhasesList; };
+	std::list< std::string >   GasComponentsList;
+	const std::list<std::string> &GetGasComponentsList() { return this->GasComponentsList; };
+	std::list< std::string >   KineticReactionsList;
+	const std::list<std::string> &GetKineticReactionsList() { return this->KineticReactionsList; };
+	std::list< std::string >   SolidSolutionComponentsList;
+	const std::list<std::string> &GetSolidSolutionComponentsList() { return this->SolidSolutionComponentsList; };
+	std::list< std::string >   SolidSolutionNamesList;
+	const std::list<std::string> &GetSolidSolutionNamesList() { return this->SolidSolutionNamesList; };
+	//std::list< std::string >   SurfaceSpeciesList;
+	//const std::list<std::string> &GetSurfaceSpeciesList() { return this->SurfaceSpeciesList; };
+	std::list< std::string >   SurfaceTypeList;
+	const std::list<std::string> &GetSurfaceTypeList() { return this->SurfaceTypeList; };
+	std::list< std::string >   SurfaceNamesList;
+	const std::list<std::string> &GetSurfaceNamesList() { return this->SurfaceNamesList; };
+	//std::list< std::string >   ExchangeSpeciesList;
+	//const std::list<std::string> &GetExchangeSpeciesList() { return this->ExchangeSpeciesList; };
+	std::list< std::string >   ExchangeNamesList;
+	const std::list<std::string> &GetExchangeNamesList() { return this->ExchangeNamesList; };
+
+	std::map< int, std::string > SelectedOutputFileNameMap;
+
+	std::string                OutputFileName;
+	std::string                ErrorFileName;
+	std::string                LogFileName;
+	std::string                DumpFileName;
+
+	std::map< int, bool >                         SelectedOutputStringOn;
+	std::map< int, std::string >                  SelectedOutputStringMap;
+	std::map< int, std::vector< std::string > >   SelectedOutputLinesMap;
+
+protected:
+	Phreeqc* PhreeqcPtr;
+	FILE *input_file;
+	FILE *database_file;
+
+	friend class IPhreeqcLib;
+	static std::map<size_t, IPhreeqc*> Instances;
+	static size_t InstancesIndex;
+	size_t Index;
+
+	static std::string Version;
+
+#if defined(_MSC_VER)
+/* reset warning C4251 */
+#pragma warning(default:4251)
+#endif
+
+#if defined(CPPUNIT)
+	friend class TestIPhreeqc;
+	friend class TestSelectedOutput;
+#endif
+
+private:
+	/**
+	 *  Copy constructor not supported
+	 */
+	IPhreeqc(const IPhreeqc&);
+
+	/**
+	 *  operator= not supported
+	 */
+	IPhreeqc& operator=(const IPhreeqc&);
+};
+
+#endif // INC_IPHREEQC_HPP