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https://git.gfz-potsdam.de/naaice/iphreeqc.git
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git-svn-id: svn://136.177.114.72/svn_GW/IPhreeqc/trunk@8016 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2065 lines
72 KiB
C
2065 lines
72 KiB
C
/*! @file IPhreeqc.h
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@brief C/Fortran Documentation
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*/
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#ifndef INC_IPHREEQC_H
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#define INC_IPHREEQC_H
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#include "Var.h"
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/**
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* @mainpage IPhreeqc Library Documentation
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*
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* @htmlonly
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* <table>
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* <tr><td class="indexkey"><a class="el" href="IPhreeqc_8h.html">IPhreeqc.h</a> </td><td class="indexvalue">C/Fortran Documentation </td></tr>
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* <tr><td class="indexkey"><a class="el" href="IPhreeqc_8hpp.html">IPhreeqc.hpp</a> </td><td class="indexvalue">C++ Documentation </td></tr>
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* <tr><td class="indexkey"><a class="el" href="Var_8h.html">Var.h</a></td><td class="indexvalue">IPhreeqc VARIANT Documentation </td></tr>
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* </table>
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* @endhtmlonly
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*/
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/*! \brief Enumeration used to return error codes.
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*/
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typedef enum {
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IPQ_OK = 0, /*!< Success */
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IPQ_OUTOFMEMORY = -1, /*!< Failure, Out of memory */
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IPQ_BADVARTYPE = -2, /*!< Failure, Invalid VAR type */
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IPQ_INVALIDARG = -3, /*!< Failure, Invalid argument */
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IPQ_INVALIDROW = -4, /*!< Failure, Invalid row */
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IPQ_INVALIDCOL = -5, /*!< Failure, Invalid column */
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IPQ_BADINSTANCE = -6 /*!< Failure, Invalid instance id */
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} IPQ_RESULT;
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#if defined(__cplusplus)
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extern "C" {
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#endif
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/**
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* Accumlulate line(s) for input to phreeqc.
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* @param id The instance id returned from \ref CreateIPhreeqc.
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* @param line The line(s) to add for input to phreeqc.
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* @retval IPQ_OK Success
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* @retval IPQ_OUTOFMEMORY Out of memory
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* @see ClearAccumulatedLines, OutputAccumulatedLines, RunAccumulated
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* @par Fortran90 Interface:
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* @htmlonly
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* <CODE>
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* <PRE>
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* FUNCTION AccumulateLine(ID,LINE)
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* INTEGER(KIND=4), INTENT(IN) :: ID
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* CHARACTER(LEN=*), INTENT(IN) :: LINE
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* INTEGER(KIND=4) :: AccumulateLine
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* END FUNCTION AccumulateLine
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* </PRE>
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* </CODE>
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* @endhtmlonly
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*
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* @par C Example:
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* \include AccumulateLine.c
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*
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* @par Fortran90 Example:
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* see \ref GetDumpStringLine_f90 "GetDumpStringLine"
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*/
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IPQ_DLL_EXPORT IPQ_RESULT AccumulateLine(int id, const char *line);
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/**
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* Appends the given error message and increments the error count.
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* Internally used to create an error condition.
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* @param id The instance id returned from \ref CreateIPhreeqc.
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* @param error_msg The error message to display.
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* @return The current error count if successful; otherwise a negative value indicates an error occured (see \ref IPQ_RESULT).
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* @see GetErrorString, GetErrorStringLine, GetErrorStringLineCount, OutputErrorString
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* @par Fortran90 Interface:
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* @htmlonly
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* <CODE>
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* <PRE>
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* FUNCTION AddError(ID,ERROR_MSG)
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* INTEGER(KIND=4), INTENT(IN) :: ID
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* CHARACTER(LEN=*), INTENT(IN) :: ERROR_MSG
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* INTEGER(KIND=4) :: AddError
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* END FUNCTION AddError
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* </PRE>
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* </CODE>
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* @endhtmlonly
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*/
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IPQ_DLL_EXPORT int AddError(int id, const char* error_msg);
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/**
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* Appends the given warning message and increments the warning count.
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* Internally used to create a warning condition.
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* @param id The instance id returned from \ref CreateIPhreeqc.
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* @param warn_msg The warning message to display.
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* @return The current warning count if successful; otherwise a negative value indicates an error occured (see \ref IPQ_RESULT).
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* @see GetWarningString, GetWarningStringLine, GetWarningStringLineCount, OutputWarningString
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* @par Fortran90 Interface:
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* @htmlonly
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* <CODE>
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* <PRE>
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* FUNCTION AddWarning(ID,WARN_MSG)
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* INTEGER(KIND=4), INTENT(IN) :: ID
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* CHARACTER(LEN=*), INTENT(IN) :: WARN_MSG
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* INTEGER(KIND=4) :: AddWarning
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* END FUNCTION AddWarning
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* </PRE>
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* </CODE>
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* @endhtmlonly
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*/
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IPQ_DLL_EXPORT int AddWarning(int id, const char* warn_msg);
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/**
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* Clears the accumulated input buffer. Input buffer is accumulated from calls to \ref AccumulateLine.
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* @retval IPQ_OK Success.
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* @retval IPQ_BADINSTANCE The given id is invalid.
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* @see AccumulateLine, OutputAccumulatedLines, RunAccumulated
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* @par Fortran90 Interface:
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* @htmlonly
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* <CODE>
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* <PRE>
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* FUNCTION ClearAccumulatedLines(ID)
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* INTEGER(KIND=4), INTENT(IN) :: ID
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* INTEGER(KIND=4) :: ClearAccumulatedLines
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* END FUNCTION ClearAccumulatedLines
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* </PRE>
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* </CODE>
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* @endhtmlonly
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*/
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IPQ_DLL_EXPORT IPQ_RESULT ClearAccumulatedLines(int id);
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/**
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* Create a new IPhreeqc instance.
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* @return A non-negative value if successful; otherwise a negative value indicates an error occured (see \ref IPQ_RESULT).
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* @see DestroyIPhreeqc
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* @par Fortran90 Interface:
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* @htmlonly
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* <CODE>
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* <PRE>
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* FUNCTION CreateIPhreeqc()
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* INTEGER(KIND=4) :: CreateIPhreeqc
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* END FUNCTION CreateIPhreeqc
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* </PRE>
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* </CODE>
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* @endhtmlonly
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*
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* \anchor CreateIPhreeqc_c
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* @par C Example:
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* \include CreateIPhreeqc.c
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*
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* \anchor CreateIPhreeqc_f90
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* @par Fortran90 Example:
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* \include F90CreateIPhreeqc.f90
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*/
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IPQ_DLL_EXPORT int CreateIPhreeqc(void);
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/**
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* Release an IPhreeqc instance from memory.
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* @param id The instance id returned from \ref CreateIPhreeqc.
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* @retval IPQ_OK Success
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* @retval IPQ_BADINSTANCE The given id is invalid.
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* @see CreateIPhreeqc
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* @par Fortran90 Interface:
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* @htmlonly
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* <CODE>
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* <PRE>
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* FUNCTION DestroyIPhreeqc(ID)
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* INTEGER(KIND=4), INTENT(IN) :: ID
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* INTEGER(KIND=4) :: DestroyIPhreeqc
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* END FUNCTION DestroyIPhreeqc
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* </PRE>
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* </CODE>
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* @endhtmlonly
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*
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* @par C Example:
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* see \ref CreateIPhreeqc_c "CreateIPhreeqc"
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*
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* @par Fortran90 Example:
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* see \ref CreateIPhreeqc_f90 "CreateIPhreeqc"
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*/
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IPQ_DLL_EXPORT IPQ_RESULT DestroyIPhreeqc(int id);
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/**
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* Retrieves the given component.
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* @param id The instance id returned from \ref CreateIPhreeqc.
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* @param n The zero-based index of the component to retrieve.
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* @return A null terminated string containing the given component.
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* Returns an empty string if n is out of range.
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* @see GetComponentCount
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* @par Fortran90 Interface:
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* (Note: N is one-based for the Fortran interface)
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* @htmlonly
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* <CODE>
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* <PRE>
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* SUBROUTINE GetComponent(ID,N,COMP)
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* INTEGER(KIND=4), INTENT(IN) :: ID
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* INTEGER(KIND=4), INTENT(IN) :: N
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* CHARACTER(LEN=*), INTENT(OUT) :: COMP
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* END SUBROUTINE GetComponent
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* </PRE>
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* </CODE>
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* @endhtmlonly
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*
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* \anchor GetComponent_c
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* @par C Example:
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* \include GetComponent.c
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*
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* \anchor GetComponent_f90
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* @par Fortran90 Example:
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* \include F90GetComponent.f90
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*/
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IPQ_DLL_EXPORT const char* GetComponent(int id, int n);
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/**
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* Retrieves the number of components in the current component list.
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* @param id The instance id returned from \ref CreateIPhreeqc.
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* @return The current count of components.
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* A negative value indicates an error occured (see \ref IPQ_RESULT).
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* @see GetComponent
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* @par Fortran90 Interface:
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* @htmlonly
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* <CODE>
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* <PRE>
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* FUNCTION GetComponentCount(ID)
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* INTEGER(KIND=4), INTENT(IN) :: ID
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* INTEGER(KIND=4) :: GetComponentCount
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* END FUNCTION GetComponentCount
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* </PRE>
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* </CODE>
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* @endhtmlonly
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*
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* @par C Example:
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* see \ref GetComponent_c "GetComponent"
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*
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* @par Fortran90 Example:
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* see \ref GetComponent_f90 "GetComponent"
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*/
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IPQ_DLL_EXPORT int GetComponentCount(int id);
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/**
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* Sets the currently active <b>SELECTED_OUTPUT</b> user number for use in subsequent calls to GetSelectedOutputXXX routines.
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* The initial setting after calling \ref CreateIPhreeqc is 1.
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* @param id The instance id returned from \ref CreateIPhreeqc.
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* @return The current active <b>SELECTED_OUTPUT</b> user number.
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* @see GetNthSelectedOutputUserNumber, GetSelectedOutputCount, SetCurrentSelectedOutputUserNumber
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* @par Fortran90 Interface:
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* @htmlonly
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* <CODE>
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* <PRE>
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* FUNCTION GetCurrentSelectedOutputUserNumber(ID)
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* INTEGER(KIND=4), INTENT(IN) :: ID
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* INTEGER(KIND=4) :: GetCurrentSelectedOutputUserNumber
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* END FUNCTION GetCurrentSelectedOutputUserNumber
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* </PRE>
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* </CODE>
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* @endhtmlonly
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*/
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IPQ_DLL_EXPORT int GetCurrentSelectedOutputUserNumber(int id);
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/**
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* Retrieves the name of the dump file. This file name is used if not specified within <B>DUMP</B> input.
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* The default value is <B><I>dump.id.out</I></B>.
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* @param id The instance id returned from \ref CreateIPhreeqc.
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* @return filename The name of the file to write <B>DUMP</B> output to.
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* @see GetDumpFileOn, GetDumpString, GetDumpStringOn, GetDumpStringLine, GetDumpStringLineCount, SetDumpFileName, SetDumpFileOn, SetDumpStringOn
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* @par Fortran90 Interface:
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* @htmlonly
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* <CODE>
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* <PRE>
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* SUBROUTINE GetDumpFileName(ID,FILENAME)
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* INTEGER(KIND=4), INTENT(IN) :: ID
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* CHARACTER(LEN=*), INTENT(OUT) :: FILENAME
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* END SUBROUTINE GetDumpFileName
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* </PRE>
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* </CODE>
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* @endhtmlonly
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*/
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IPQ_DLL_EXPORT const char* GetDumpFileName(int id);
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/**
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* Retrieves the current value of the dump file switch.
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* @param id The instance id returned from \ref CreateIPhreeqc.
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* @return Non-zero if output is written to the <B>DUMP</B> (<B><I>dump.id.out</I></B> if unspecified) file, 0 (zero) otherwise.
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* @see GetDumpString, GetDumpStringLine, GetDumpStringLineCount, GetDumpStringOn, SetDumpFileOn, SetDumpStringOn
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* @par Fortran90 Interface:
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* @htmlonly
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* <CODE>
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* <PRE>
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* FUNCTION GetDumpFileOn(ID)
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* INTEGER(KIND=4), INTENT(IN) :: ID
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* LOGICAL(KIND=4) :: GetDumpFileOn
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* END FUNCTION GetDumpFileOn
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* </PRE>
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* </CODE>
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* @endhtmlonly
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*/
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IPQ_DLL_EXPORT int GetDumpFileOn(int id);
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/**
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* Retrieves the string buffer containing <b>DUMP</b> output.
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* @param id The instance id returned from \ref CreateIPhreeqc.
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* @return A null terminated string containing <b>DUMP</b> output.
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* @pre \ref SetDumpStringOn must have been set to true (non-zero) in order to receive <b>DUMP</b> output.
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* @see GetDumpFileOn, GetDumpStringLine, GetDumpStringLineCount, SetDumpFileOn, GetDumpStringOn, SetDumpStringOn
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* @par Fortran90 Interface:
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* Not implemented. (see \ref GetDumpStringLineCount, \ref GetDumpStringLine)
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*
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* \anchor GetDumpString_c
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* @par C Example:
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* \include GetDumpString.c
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*/
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IPQ_DLL_EXPORT const char* GetDumpString(int id);
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/**
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* Retrieves the given dump line.
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* @param id The instance id returned from \ref CreateIPhreeqc.
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* @param n The zero-based index of the line to retrieve.
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* @return A null terminated string containing the given line.
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* Returns an empty string if n is out of range.
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* @pre \ref SetDumpStringOn must have been set to true (non-zero).
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* @see GetDumpFileOn, GetDumpString, GetDumpStringLineCount, GetDumpStringOn, SetDumpFileOn, SetDumpStringOn
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* @par Fortran90 Interface:
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* @htmlonly
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* (Note: N is one-based for the Fortran interface.)
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* <CODE>
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* <PRE>
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* SUBROUTINE GetDumpStringLine(ID,N,LINE)
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* INTEGER(KIND=4), INTENT(IN) :: ID
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* INTEGER(KIND=4), INTENT(IN) :: N
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* CHARACTER(LEN=*), INTENT(OUT) :: LINE
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* END SUBROUTINE GetDumpStringLine
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* </PRE>
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* </CODE>
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* @endhtmlonly
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*
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* \anchor GetDumpStringLine_f90
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* @par Fortran90 Example:
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* \include F90GetDumpStringLine.f90
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*/
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IPQ_DLL_EXPORT const char* GetDumpStringLine(int id, int n);
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/**
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* Retrieves the number of lines in the current dump string buffer.
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* @param id The instance id returned from \ref CreateIPhreeqc.
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* @return The number of lines.
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* @pre \ref SetDumpStringOn must have been set to true (non-zero).
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* @see GetDumpFileOn, GetDumpString, GetDumpStringLine, GetDumpStringOn, SetDumpFileOn, SetDumpStringOn
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* @par Fortran90 Interface:
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* @htmlonly
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* <CODE>
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* <PRE>
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* FUNCTION GetDumpStringLineCount(ID)
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* INTEGER(KIND=4), INTENT(IN) :: ID
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* INTEGER(KIND=4) :: GetDumpStringLineCount
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* END FUNCTION GetDumpStringLineCount
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* </PRE>
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* </CODE>
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* @endhtmlonly
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*
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* @par Fortran90 Example:
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* see \ref GetDumpStringLine_f90 "GetDumpStringLine"
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*/
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IPQ_DLL_EXPORT int GetDumpStringLineCount(int id);
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/**
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* Retrieves the current value of the dump string switch.
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* @param id The instance id returned from \ref CreateIPhreeqc.
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* @return Non-zero if output defined by the <B>DUMP</B> keyword is stored, 0 (zero) otherwise.
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* @see GetDumpFileOn, GetDumpString, GetDumpStringLine, GetDumpStringLineCount, SetDumpFileOn, SetDumpStringOn
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* @par Fortran90 Interface:
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* @htmlonly
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* <CODE>
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* <PRE>
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* FUNCTION GetDumpStringOn(ID)
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* INTEGER(KIND=4), INTENT(IN) :: ID
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* LOGICAL(KIND=4) :: GetDumpStringOn
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* END FUNCTION GetDumpStringOn
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* </PRE>
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* </CODE>
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* @endhtmlonly
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*/
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IPQ_DLL_EXPORT int GetDumpStringOn(int id);
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/**
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* Retrieves the name of the error file. The default name is <B><I>phreeqc.id.err</I></B>.
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* @param id The instance id returned from \ref CreateIPhreeqc.
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* @return filename The name of the error file.
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* @see GetErrorFileOn, GetErrorString, GetErrorStringOn, GetErrorStringLine, GetErrorStringLineCount, SetErrorFileName, SetErrorFileOn, SetErrorStringOn
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* @par Fortran90 Interface:
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* @htmlonly
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* <CODE>
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* <PRE>
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* SUBROUTINE GetErrorFileName(ID,FILENAME)
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* INTEGER(KIND=4), INTENT(IN) :: ID
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* CHARACTER(LEN=*), INTENT(OUT) :: FILENAME
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* END SUBROUTINE GetErrorFileName
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* </PRE>
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* </CODE>
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* @endhtmlonly
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*/
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IPQ_DLL_EXPORT const char* GetErrorFileName(int id);
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/**
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* Retrieves the current value of the error file switch.
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* @param id The instance id returned from \ref CreateIPhreeqc.
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* @return Non-zero if errors are written to the <B><I>phreeqc.id.err</I></B> file, 0 (zero) otherwise.
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* @see SetErrorFileOn
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* @par Fortran90 Interface:
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* @htmlonly
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* <CODE>
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* <PRE>
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* FUNCTION GetErrorFileOn(ID)
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* INTEGER(KIND=4), INTENT(IN) :: ID
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* LOGICAL(KIND=4) :: GetErrorFileOn
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* END FUNCTION GetErrorFileOn
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* </PRE>
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* </CODE>
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* @endhtmlonly
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*/
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IPQ_DLL_EXPORT int GetErrorFileOn(int id);
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/**
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* Retrieves the error messages from the last call to \ref RunAccumulated, \ref RunFile, \ref RunString, \ref LoadDatabase, or \ref LoadDatabaseString.
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* @param id The instance id returned from \ref CreateIPhreeqc.
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* @return A null terminated string containing error messages.
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* @see GetErrorFileOn, GetErrorStringLine, GetErrorStringLineCount, OutputErrorString, SetErrorFileOn
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* @par Fortran90 Interface:
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* Not implemented. (see \ref GetErrorStringLineCount, \ref GetErrorStringLine, \ref OutputErrorString)
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*
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* \anchor GetErrorString_c
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* @par C Example:
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* \include GetErrorString.c
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*/
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IPQ_DLL_EXPORT const char* GetErrorString(int id);
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/**
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* Retrieves the given error line.
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* @param id The instance id returned from \ref CreateIPhreeqc.
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* @param n The zero-based index of the line to retrieve.
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* @return A null terminated string containing the given line of the error string buffer.
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* @see GetErrorFileOn, GetErrorString, GetErrorStringLineCount, OutputErrorString, SetErrorFileOn
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* @par Fortran90 Interface:
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* (Note: N is one-based for the Fortran interface.)
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* @htmlonly
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* <CODE>
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* <PRE>
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* SUBROUTINE GetErrorStringLine(ID,N,LINE)
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* INTEGER(KIND=4), INTENT(IN) :: ID
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* INTEGER(KIND=4), INTENT(IN) :: N
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* CHARACTER(LEN=*), INTENT(OUT) :: LINE
|
|
* END SUBROUTINE GetErrorStringLine
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*
|
|
* \anchor GetErrorStringLine_f90
|
|
* @par Fortran90 Example:
|
|
* \include F90GetErrorStringLine.f90
|
|
*/
|
|
IPQ_DLL_EXPORT const char* GetErrorStringLine(int id, int n);
|
|
|
|
|
|
/**
|
|
* Retrieves the number of lines in the current error string buffer.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @return The number of lines.
|
|
* @see GetErrorFileOn, GetErrorString, GetErrorStringLine, OutputErrorString, SetErrorFileOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION GetErrorStringLineCount(ID)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* INTEGER(KIND=4) :: GetErrorStringLineCount
|
|
* END FUNCTION GetErrorStringLineCount
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT int GetErrorStringLineCount(int id);
|
|
|
|
/**
|
|
* Retrieves the current value of the error string switch.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @return Non-zero if output is stored, 0 (zero) otherwise.
|
|
* @see GetErrorFileOn, GetErrorString, GetErrorStringLine, GetErrorStringLineCount, SetErrorFileOn, SetErrorStringOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION GetErrorStringOn(ID)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* LOGICAL(KIND=4) :: GetErrorStringOn
|
|
* END FUNCTION GetErrorStringOn
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT int GetErrorStringOn(int id);
|
|
|
|
/**
|
|
* Retrieves the name of the log file. The default name is <B><I>phreeqc.id.log</I></B>.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @return filename The name of the log file.
|
|
* @see GetLogFileOn, GetLogString, GetLogStringOn, GetLogStringLine, GetLogStringLineCount, SetLogFileName, SetLogFileOn, SetLogStringOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* SUBROUTINE GetLogFileName(ID,FILENAME)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* CHARACTER(LEN=*), INTENT(OUT) :: FILENAME
|
|
* END SUBROUTINE GetLogFileName
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT const char* GetLogFileName(int id);
|
|
|
|
|
|
/**
|
|
* Retrieves the current value of the log file switch.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @return Non-zero if log messages are written to the <B><I>phreeqc.id.log</I></B> file, 0 (zero) otherwise.
|
|
* @remarks Logging must be enabled through the use of the KNOBS -logfile option in order to receive any log messages.
|
|
* @see SetLogFileOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION GetLogFileOn(ID)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* LOGICAL(KIND=4) :: GetLogFileOn
|
|
* END FUNCTION GetLogFileOn
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT int GetLogFileOn(int id);
|
|
|
|
|
|
/**
|
|
* Retrieves the string buffer containing log output.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @return A null terminated string containing log output.
|
|
* @remarks Logging must be enabled through the use of the KNOBS -logfile option in order to receive any log messages.
|
|
* @pre \ref SetLogStringOn must have been set to true (non-zero) in order to receive log output.
|
|
* @see GetLogFileOn, GetLogStringLine, GetLogStringLineCount, SetLogFileOn, GetLogStringOn, SetLogStringOn
|
|
* @par Fortran90 Interface:
|
|
* Not implemented. (see \ref GetLogStringLineCount, \ref GetLogStringLine)
|
|
*
|
|
* \anchor GetLogString_c
|
|
* @par C Example:
|
|
* \include GetLogString.c
|
|
*/
|
|
IPQ_DLL_EXPORT const char* GetLogString(int id);
|
|
|
|
|
|
/**
|
|
* Retrieves the given log line.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @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 (non-zero).
|
|
* @see GetLogFileOn, GetLogString, GetLogStringLineCount, GetLogStringOn, SetLogFileOn, SetLogStringOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* (Note: N is one-based for the Fortran interface.)
|
|
* <CODE>
|
|
* <PRE>
|
|
* SUBROUTINE GetLogStringLine(ID,N,LINE)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* INTEGER(KIND=4), INTENT(IN) :: N
|
|
* CHARACTER(LEN=*), INTENT(OUT) :: LINE
|
|
* END SUBROUTINE GetLogStringLine
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*
|
|
* \anchor GetLogStringLine_f90
|
|
* @par Fortran90 Example:
|
|
* \include F90GetLogStringLine.f90
|
|
*/
|
|
IPQ_DLL_EXPORT const char* GetLogStringLine(int id, int n);
|
|
|
|
/**
|
|
* Retrieves the number of lines in the current log string buffer.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @return The number of lines.
|
|
* @pre \ref SetLogStringOn must have been set to true (non-zero).
|
|
* @see GetLogFileOn, GetLogString, GetLogStringLine, GetLogStringOn, SetLogFileOn, SetLogStringOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION GetLogStringLineCount(ID)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* INTEGER(KIND=4) :: GetLogStringLineCount
|
|
* END FUNCTION GetLogStringLineCount
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*
|
|
* @par Fortran90 Example:
|
|
* see \ref GetLogStringLine_f90 "GetLogStringLine"
|
|
*/
|
|
IPQ_DLL_EXPORT int GetLogStringLineCount(int id);
|
|
|
|
|
|
/**
|
|
* Retrieves the current value of the log string switch.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @return Non-zero if output is stored, 0 (zero) otherwise.
|
|
* @see GetLogFileOn, GetLogString, GetLogStringLine, GetLogStringLineCount, SetLogFileOn, SetLogStringOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION GetLogStringOn(ID)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* LOGICAL(KIND=4) :: GetLogStringOn
|
|
* END FUNCTION GetLogStringOn
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT int GetLogStringOn(int id);
|
|
|
|
|
|
/**
|
|
* Retrieves the nth user number of the currently defined <B>SELECTED_OUTPUT</B> keyword blocks.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @return The nth defined user number; a negative value indicates an error occured.
|
|
* @see GetCurrentSelectedOutputUserNumber, GetSelectedOutputCount, SetCurrentSelectedOutputUserNumber
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* (Note: N is one-based for the Fortran interface.)
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION GetNthSelectedOutputUserNumber(ID)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* INTEGER(KIND=4), INTENT(IN) :: N
|
|
* INTEGER(KIND=4) :: GetNthSelectedOutputUserNumber
|
|
* END FUNCTION GetNthSelectedOutputUserNumber
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT int GetNthSelectedOutputUserNumber(int id, int n);
|
|
|
|
/**
|
|
* Retrieves the name of the output file. The default name is <B><I>phreeqc.id.out</I></B>.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @return filename The name of the output file.
|
|
* @see GetOutputFileOn, GetOutputString, GetOutputStringOn, GetOutputStringLine, GetOutputStringLineCount, SetOutputFileName, SetOutputFileOn, SetOutputStringOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* SUBROUTINE GetOutputFileName(ID,FILENAME)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* CHARACTER(LEN=*), INTENT(OUT) :: FILENAME
|
|
* END SUBROUTINE GetOutputFileName
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT const char* GetOutputFileName(int id);
|
|
|
|
|
|
/**
|
|
* Retrieves the current value of the output file switch.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @return Non-zero if output is written to the <B><I>phreeqc.id.out</I></B> file, 0 (zero) otherwise.
|
|
* @see SetOutputFileOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION GetOutputFileOn(ID)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* LOGICAL(KIND=4) :: GetOutputFileOn
|
|
* END FUNCTION GetOutputFileOn
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT int GetOutputFileOn(int id);
|
|
|
|
/**
|
|
* Retrieves the string buffer containing phreeqc output.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @return A null terminated string containing phreeqc output.
|
|
* @pre \ref SetOutputStringOn must have been set to true (non-zero) in order to receive phreeqc output.
|
|
* @see GetOutputFileOn, GetOutputStringLine, GetOutputStringLineCount, SetOutputFileOn, GetOutputStringOn, SetOutputStringOn
|
|
* @par Fortran90 Interface:
|
|
* Not implemented. (see \ref GetOutputStringLineCount, \ref GetOutputStringLine)
|
|
*
|
|
* \anchor GetOutputString_c
|
|
* @par C Example:
|
|
* \include GetOutputString.c
|
|
*/
|
|
IPQ_DLL_EXPORT const char* GetOutputString(int id);
|
|
|
|
/**
|
|
* Retrieves the given output line.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @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 (non-zero).
|
|
* @see GetOutputFileOn, GetOutputString, GetOutputStringLineCount, GetOutputStringOn, SetOutputFileOn, SetOutputStringOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* (Note: N is one-based for the Fortran interface.)
|
|
* <CODE>
|
|
* <PRE>
|
|
* SUBROUTINE GetOutputStringLine(ID,N,LINE)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* INTEGER(KIND=4), INTENT(IN) :: N
|
|
* CHARACTER(LEN=*), INTENT(OUT) :: LINE
|
|
* END SUBROUTINE GetOutputStringLine
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*
|
|
* \anchor GetOutputStringLine_f90
|
|
* @par Fortran90 Example:
|
|
* \include F90GetOutputStringLine.f90
|
|
*/
|
|
IPQ_DLL_EXPORT const char* GetOutputStringLine(int id, int n);
|
|
|
|
/**
|
|
* Retrieves the number of lines in the current output string buffer.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @return The number of lines.
|
|
* @pre \ref SetOutputStringOn must have been set to true (non-zero).
|
|
* @see GetOutputFileOn, GetOutputString, GetOutputStringLine, GetOutputStringOn, SetOutputFileOn, SetOutputStringOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION GetOutputStringLineCount(ID)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* INTEGER(KIND=4) :: GetOutputStringLineCount
|
|
* END FUNCTION GetOutputStringLineCount
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*
|
|
* @par Fortran90 Example:
|
|
* see \ref GetOutputStringLine_f90 "GetOutputStringLine"
|
|
*/
|
|
IPQ_DLL_EXPORT int GetOutputStringLineCount(int id);
|
|
|
|
/**
|
|
* Retrieves the current value of the output string switch.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @return Non-zero if output is stored, 0 (zero) otherwise.
|
|
* @see GetOutputFileOn, GetOutputString, GetOutputStringLine, GetOutputStringLineCount, SetOutputFileOn, SetOutputStringOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION GetOutputStringOn(ID)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* LOGICAL(KIND=4) :: GetOutputStringOn
|
|
* END FUNCTION GetOutputStringOn
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT int GetOutputStringOn(int id);
|
|
|
|
|
|
/**
|
|
* Retrieves the number of columns in the selected-output buffer.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @return The number of columns.
|
|
* @see GetSelectedOutputFileOn, GetSelectedOutputRowCount, GetSelectedOutputValue, SetSelectedOutputFileOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION GetSelectedOutputColumnCount(ID)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* INTEGER(KIND=4) :: GetSelectedOutputColumnCount
|
|
* END FUNCTION GetSelectedOutputColumnCount
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT int GetSelectedOutputColumnCount(int id);
|
|
|
|
/**
|
|
* Retrieves the count of <B>SELECTED_OUTPUT</B> blocks that are currently defined.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @return The number of <B>SELECTED_OUTPUT</B> blocks.
|
|
* @see GetCurrentSelectedOutputUserNumber, GetNthSelectedOutputUserNumber, SetCurrentSelectedOutputUserNumber
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION GetSelectedOutputCount(ID)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* INTEGER(KIND=4) :: GetSelectedOutputCount
|
|
* END FUNCTION GetSelectedOutputCount
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT int GetSelectedOutputCount(int id);
|
|
|
|
|
|
/**
|
|
* Retrieves the name of the selected output file. This file name is used if not specified within <B>SELECTED_OUTPUT</B> input.
|
|
* The default value is <B><I>selected.id.out</I></B>.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @return filename The name of the file to write <B>SELECTED_OUTPUT</B> output to.
|
|
* @see GetSelectedOutputFileOn, GetSelectedOutputString, GetSelectedOutputStringOn, GetSelectedOutputStringLine, GetSelectedOutputStringLineCount, SetSelectedOutputFileName, SetSelectedOutputFileOn, SetSelectedOutputStringOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* SUBROUTINE GetSelectedOutputFileName(ID,FILENAME)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* CHARACTER(LEN=*), INTENT(OUT) :: FILENAME
|
|
* END SUBROUTINE GetSelectedOutputFileName
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT const char* GetSelectedOutputFileName(int id);
|
|
|
|
|
|
/**
|
|
* Retrieves the selected-output file switch.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @return Non-zero if output is written to the selected-output (<B><I>selected.id.out</I></B> if unspecified) file, 0 (zero) otherwise.
|
|
* @see GetSelectedOutputColumnCount, GetSelectedOutputRowCount, GetSelectedOutputValue, SetSelectedOutputFileOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION GetSelectedOutputFileOn(ID)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* LOGICAL(KIND=4) :: GetSelectedOutputFileOn
|
|
* END FUNCTION GetSelectedOutputFileOn
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT int GetSelectedOutputFileOn(int id);
|
|
|
|
|
|
/**
|
|
* Retrieves the string buffer containing <b>SELECTED_OUTPUT</b>.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @return A null terminated string containing <b>SELECTED_OUTPUT</b>.
|
|
* @pre \ref SetSelectedOutputStringOn must have been set to true (non-zero) in order to receive <b>SELECTED_OUTPUT</b>.
|
|
* @see GetSelectedOutputFileOn, GetSelectedOutputStringLine, GetSelectedOutputStringLineCount, SetSelectedOutputFileOn, GetSelectedOutputStringOn, SetSelectedOutputStringOn
|
|
* @par Fortran90 Interface:
|
|
* Not implemented. (see \ref GetSelectedOutputStringLineCount, \ref GetSelectedOutputStringLine)
|
|
*
|
|
* \anchor GetSelectedOutputString_c
|
|
* @par C Example:
|
|
* \include GetSelectedOutputString.c
|
|
*/
|
|
IPQ_DLL_EXPORT const char* GetSelectedOutputString(int id);
|
|
|
|
|
|
/**
|
|
* Retrieves the given selected output line.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @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 (non-zero).
|
|
* @see GetSelectedOutputFileOn, GetSelectedOutputString, GetSelectedOutputStringLineCount, GetSelectedOutputStringOn, SetSelectedOutputFileOn, SetSelectedOutputStringOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* (Note: N is one-based for the Fortran interface.)
|
|
* <CODE>
|
|
* <PRE>
|
|
* SUBROUTINE GetSelectedOutputStringLine(ID,N,LINE)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* INTEGER(KIND=4), INTENT(IN) :: N
|
|
* CHARACTER(LEN=*), INTENT(OUT) :: LINE
|
|
* END SUBROUTINE GetSelectedOutputStringLine
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*
|
|
* \anchor GetSelectedOutputStringLine_f90
|
|
* @par Fortran90 Example:
|
|
* \include F90GetSelectedOutputStringLine.f90
|
|
*/
|
|
IPQ_DLL_EXPORT const char* GetSelectedOutputStringLine(int id, int n);
|
|
|
|
|
|
/**
|
|
* Retrieves the number of lines in the current selected output string buffer.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @return The number of lines.
|
|
* @pre \ref SetSelectedOutputStringOn must have been set to true (non-zero).
|
|
* @see GetSelectedOutputFileOn, GetSelectedOutputString, GetSelectedOutputStringLine, GetSelectedOutputStringOn, SetSelectedOutputFileOn, SetSelectedOutputStringOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION GetSelectedOutputStringLineCount(ID)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* INTEGER(KIND=4) :: GetSelectedOutputStringLineCount
|
|
* END FUNCTION GetSelectedOutputStringLineCount
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*
|
|
* @par Fortran90 Example:
|
|
* see \ref GetSelectedOutputStringLine_f90 "GetSelectedOutputStringLine"
|
|
*/
|
|
IPQ_DLL_EXPORT int GetSelectedOutputStringLineCount(int id);
|
|
|
|
|
|
/**
|
|
* Retrieves the current value of the selected output string switch.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @return Non-zero if output defined by the <B>SELECTED_OUTPUT</B> keyword is stored, 0 (zero) otherwise.
|
|
* @see GetSelectedOutputFileOn, GetSelectedOutputString, GetSelectedOutputStringLine, GetSelectedOutputStringLineCount, SetSelectedOutputFileOn, SetSelectedOutputStringOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION GetSelectedOutputStringOn(ID)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* LOGICAL(KIND=4) :: GetSelectedOutputStringOn
|
|
* END FUNCTION GetSelectedOutputStringOn
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT int GetSelectedOutputStringOn(int id);
|
|
|
|
|
|
/**
|
|
* Retrieves the number of rows in the selected-output buffer.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @return The number of rows.
|
|
* @see GetSelectedOutputFileOn, GetSelectedOutputColumnCount, GetSelectedOutputValue, SetSelectedOutputFileOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION GetSelectedOutputRowCount(ID)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* INTEGER(KIND=4) :: GetSelectedOutputRowCount
|
|
* END FUNCTION GetSelectedOutputRowCount
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT int GetSelectedOutputRowCount(int id);
|
|
|
|
|
|
/**
|
|
* Returns the \c VAR associated with the specified row and column.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @param row The row index.
|
|
* @param col The column index.
|
|
* @param pVAR Pointer to the \c VAR to receive the requested data.
|
|
* @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, GetSelectedOutputValue2, 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
|
|
* @par Fortran90 Interface:
|
|
* ROW is 1-based for the Fortran interface except that the column headings are stored in ROW=0.
|
|
* COL is 1-based for the Fortran interface.
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION GetSelectedOutputValue(ID,ROW,COL,VTYPE,DVALUE,SVALUE)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* INTEGER(KIND=4), INTENT(IN) :: ROW
|
|
* INTEGER(KIND=4), INTENT(IN) :: COL
|
|
* INTEGER(KIND=4), INTENT(OUT) :: VTYPE
|
|
* REAL(KIND=8), INTENT(OUT) :: DVALUE
|
|
* CHARACTER(LEN=*), INTENT(OUT) :: SVALUE
|
|
* INTEGER(KIND=4) :: GetSelectedOutputValue
|
|
* END FUNCTION GetSelectedOutputValue
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
* @param ID The instance id returned from \ref CreateIPhreeqc.
|
|
* @param ROW The row index.
|
|
* @param COL The column index.
|
|
* @param VTYPE Returns the variable type. See \ref VAR_TYPE.
|
|
* @param DVALUE Returns the numeric value when (VTYPE=\ref TT_DOUBLE) or (VTYPE=\ref TT_LONG).
|
|
* @param SVALUE Returns 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.
|
|
* \anchor GetSelectedOutputValue_c
|
|
* @par C Example:
|
|
* \include GetSelectedOutputValue.c
|
|
*
|
|
* \anchor F90GetSelectedOutputValue_f90
|
|
* @par Fortran90 Example:
|
|
* \include F90GetSelectedOutputValue.f90
|
|
*/
|
|
IPQ_DLL_EXPORT IPQ_RESULT GetSelectedOutputValue(int id, int row, int col, VAR* pVAR);
|
|
|
|
|
|
/**
|
|
* Returns the associated data with the specified row and column.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @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, 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
|
|
* \anchor GetSelectedOutputValue2_c
|
|
* @par C Example:
|
|
* \include GetSelectedOutputValue2.c
|
|
*/
|
|
IPQ_DLL_EXPORT IPQ_RESULT GetSelectedOutputValue2(int id, int row, int col, int *vtype, double* dvalue, char* svalue, unsigned int svalue_length);
|
|
|
|
|
|
|
|
/**
|
|
* Retrieves the warning messages from the last call to \ref RunAccumulated, \ref RunFile, \ref RunString, \ref LoadDatabase, or \ref LoadDatabaseString.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @return A null terminated string containing warning messages.
|
|
* @see GetWarningStringLine, GetWarningStringLineCount, OutputWarningString
|
|
* @par Fortran90 Interface:
|
|
* Not implemented. (see \ref GetWarningStringLineCount, \ref GetWarningStringLine, \ref OutputWarningString)
|
|
*/
|
|
IPQ_DLL_EXPORT const char* GetWarningString(int id);
|
|
|
|
|
|
/**
|
|
* Retrieves the given warning line.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @param n The zero-based index of the line to retrieve.
|
|
* @return A null terminated string containing the given warning line message.
|
|
* @see GetWarningString, GetWarningStringLineCount, OutputWarningString
|
|
* @par Fortran90 Interface:
|
|
* (Note: N is one-based for the Fortran interface.)
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* SUBROUTINE GetWarningStringLine(ID,N,LINE)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* LOGICAL(KIND=4), INTENT(IN) :: N
|
|
* CHARACTER(LEN=*), INTENT(OUT) :: LINE
|
|
* END SUBROUTINE GetWarningStringLine
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT const char* GetWarningStringLine(int id, int n);
|
|
|
|
|
|
/**
|
|
* Retrieves the number of lines in the current warning string buffer.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @return The number of lines.
|
|
* @see GetWarningString, GetWarningStringLine, OutputWarningString
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION GetWarningStringLineCount(ID)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* INTEGER(KIND=4) :: GetWarningStringLineCount
|
|
* END FUNCTION GetWarningStringLineCount
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT int GetWarningStringLineCount(int id);
|
|
|
|
|
|
/**
|
|
* Load the specified database file into phreeqc.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @param filename The name of the phreeqc database to load.
|
|
* The full path (or relative path with respect to the working directory)
|
|
* must be given if the file is not in the current working directory.
|
|
* @return The number of errors encountered.
|
|
* @see LoadDatabaseString
|
|
* @remarks
|
|
* All previous definitions are cleared.
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION LoadDatabase(ID,FILENAME)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* CHARACTER(LEN=*), INTENT(IN) :: FILENAME
|
|
* INTEGER(KIND=4) :: LoadDatabase
|
|
* END FUNCTION LoadDatabase
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*
|
|
* @par C Example:
|
|
* see \ref CreateIPhreeqc_c "CreateIPhreeqc"
|
|
*
|
|
* @par Fortran90 Example:
|
|
* see \ref CreateIPhreeqc_f90 "CreateIPhreeqc"
|
|
*/
|
|
IPQ_DLL_EXPORT int LoadDatabase(int id, const char* filename);
|
|
|
|
|
|
/**
|
|
* Load the specified string as a database into phreeqc.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @param input String containing data to be used as the phreeqc database.
|
|
* @return The number of errors encountered.
|
|
* @see LoadDatabase
|
|
* @remarks
|
|
* All previous definitions are cleared.
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION LoadDatabaseString(ID,INPUT)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* CHARACTER(LEN=*), INTENT(IN) :: INPUT
|
|
* INTEGER(KIND=4) :: LoadDatabaseString
|
|
* END FUNCTION LoadDatabaseString
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT int LoadDatabaseString(int id, const char* input);
|
|
|
|
|
|
/**
|
|
* Output the accumulated input buffer to stdout. This input buffer can be run with a call to \ref RunAccumulated.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @see AccumulateLine, ClearAccumulatedLines, RunAccumulated
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* SUBROUTINE OutputAccumulatedLines(ID)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* END SUBROUTINE OutputAccumulatedLines
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*
|
|
* @par Fortran90 Example:
|
|
* see \ref GetDumpStringLine_f90 "GetDumpStringLine"
|
|
*/
|
|
IPQ_DLL_EXPORT void OutputAccumulatedLines(int id);
|
|
|
|
|
|
/**
|
|
* Output the error messages normally stored in the <B><I>phreeqc.id.err</I></B> file to stdout.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @see GetErrorFileOn, GetErrorStringLine, GetErrorStringLineCount, SetErrorFileOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* SUBROUTINE OutputErrorString(ID)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* END SUBROUTINE OutputErrorString
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*
|
|
* @par C Example:
|
|
* see \ref GetComponent_c "GetComponent"
|
|
*
|
|
* @par Fortran90 Example:
|
|
* see \ref GetDumpStringLine_f90 "GetDumpStringLine"
|
|
*/
|
|
IPQ_DLL_EXPORT void OutputErrorString(int id);
|
|
|
|
|
|
/**
|
|
* Output the warning messages to stdout.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @see GetWarningString, GetWarningStringLine, GetWarningStringLineCount
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* SUBROUTINE OutputWarningString(ID)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* END SUBROUTINE OutputWarningString
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT void OutputWarningString(int id);
|
|
|
|
|
|
/**
|
|
* Runs the input buffer as defined by calls to \ref AccumulateLine.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @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.
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION RunAccumulated(ID)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* INTEGER(KIND=4) :: RunAccumulated
|
|
* END FUNCTION RunAccumulated
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*
|
|
* @par Fortran90 Example:
|
|
* see \ref GetDumpStringLine_f90 "GetDumpStringLine"
|
|
*/
|
|
IPQ_DLL_EXPORT int RunAccumulated(int id);
|
|
|
|
|
|
/**
|
|
* Runs the specified phreeqc input file.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @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.
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION RunFile(ID,FNAME)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* CHARACTER(LEN=*), INTENT(IN) :: FNAME
|
|
* INTEGER(KIND=4) :: RunFile
|
|
* END FUNCTION RunFile
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*
|
|
* @par C Example:
|
|
* see \ref CreateIPhreeqc_c "CreateIPhreeqc"
|
|
*
|
|
* @par Fortran90 Example:
|
|
* see \ref CreateIPhreeqc_f90 "CreateIPhreeqc"
|
|
*/
|
|
IPQ_DLL_EXPORT int RunFile(int id, const char* filename);
|
|
|
|
|
|
/**
|
|
* Runs the specified string as input to phreeqc.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @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.
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION RunString(ID,INPUT)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* CHARACTER(LEN=*), INTENT(IN) :: INPUT
|
|
* INTEGER(KIND=4) :: RunString
|
|
* END FUNCTION RunString
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*
|
|
* @par C Example:
|
|
* see \ref GetDumpString_c "GetDumpString"
|
|
*
|
|
*/
|
|
IPQ_DLL_EXPORT int RunString(int id, const char* input);
|
|
|
|
/**
|
|
* Sets a C callback function for Basic programs. The syntax for the Basic command is
|
|
* 10 result = CALLBACK(x1, x2, string$)
|
|
* The syntax for the C function is
|
|
* double my_callback(double x1, double x2, const char * string)
|
|
* @param id The instance id returned from @ref CreateIPhreeqc.
|
|
* @param fcn The name of a user-defined function.
|
|
* @param cookie1 A user defined value to be passed to the callback function.
|
|
* @retval IPQ_OK Success.
|
|
* @retval IPQ_BADINSTANCE The given id is invalid.
|
|
* @par Fortran90 Interface:
|
|
* see @ref SetBasicFortranCallback
|
|
* @par C Example:
|
|
* @include SetBasicCallback.c
|
|
*/
|
|
IPQ_DLL_EXPORT IPQ_RESULT SetBasicCallback(int id, double (*fcn)(double x1, double x2, const char *str, void *cookie), void *cookie1);
|
|
|
|
/**
|
|
* Sets a Fortran callback function for Basic programs. The syntax for the Basic command is
|
|
* 10 result = CALLBACK(x1, x2, string$)
|
|
* The syntax for the Fortran function is
|
|
* double precision my_callback(x1, x2, string), where x1 and x2 are double precision and string is a character variable.
|
|
* @param id The instance id returned from @ref CreateIPhreeqc.
|
|
* @param fcn The name of a double precision Fortran function with three arguments (two double precision, and one character).
|
|
* @retval IPQ_OK Success.
|
|
* @retval IPQ_BADINSTANCE The given id is invalid.
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION SetBasicFortranCallback(ID,FCN)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* INTERFACE
|
|
* DOUBLE PRECISION FUNCTION FCN(x1, x2, str)
|
|
* DOUBLE PRECISION, INTENT(in) :: x1
|
|
* DOUBLE PRECISION, INTENT(in) :: x2
|
|
* CHARACTER(*), INTENT(in) :: str
|
|
* END FUNCTION
|
|
* END INTERFACE
|
|
* INTEGER(KIND=4) :: SetBasicFortranCallback
|
|
* END FUNCTION SetBasicFortranCallback
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
* @par Fortran90 Example:
|
|
* @include F90SetBasicFortranCallback.f90
|
|
* @par File ic :
|
|
* @include ic
|
|
*/
|
|
IPQ_DLL_EXPORT IPQ_RESULT SetBasicFortranCallback(int id, double (*fcn)(double *x1, double *x2, char *str, int l));
|
|
|
|
|
|
/**
|
|
* Sets the currently active SELECTED_OUTPUT user number for use in subsequent calls to GetSelectedOutputXXX routines.
|
|
* The initial setting after calling \ref CreateIPhreeqc is 1.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @param n The user number as specified in the <B>SELECTED_OUTPUT</B> block.
|
|
* @retval IPQ_OK Success.
|
|
* @retval IPQ_BADINSTANCE The given id is invalid.
|
|
* @retval IPQ_INVALIDARG The given user number is invalid.
|
|
* @see GetSelectedOutputColumnCount, GetSelectedOutputFileName, GetSelectedOutputRowCount, GetSelectedOutputString, GetSelectedOutputStringLine, GetSelectedOutputStringLineCount, GetSelectedOutputValue
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION SetCurrentSelectedOutputUserNumber(ID,N)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* INTEGER(KIND=4), INTENT(IN) :: N
|
|
* INTEGER(KIND=4) :: SetCurrentSelectedOutputUserNumber
|
|
* END FUNCTION SetCurrentSelectedOutputUserNumber
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT IPQ_RESULT SetCurrentSelectedOutputUserNumber(int id, 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>.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @param filename The name of the file to write <B>DUMP</B> output to.
|
|
* @retval IPQ_OK Success.
|
|
* @retval IPQ_BADINSTANCE The given id is invalid.
|
|
* @see GetDumpFileName, GetDumpFileOn, GetDumpString, GetDumpStringOn, GetDumpStringLine, GetDumpStringLineCount, SetDumpFileOn, SetDumpStringOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION SetDumpFileName(ID,FILENAME)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* CHARACTER(LEN=*), INTENT(OUT) :: FILENAME
|
|
* INTEGER(KIND=4) :: SetDumpFileName
|
|
* END FUNCTION SetDumpFileName
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT IPQ_RESULT SetDumpFileName(int id, const char* filename);
|
|
|
|
|
|
/**
|
|
* Sets the dump file switch on or off. This switch controls whether or not phreeqc writes to the dump file.
|
|
* The initial setting after calling \ref CreateIPhreeqc is off.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @param dump_on If non-zero, turns on output to the <B>DUMP</B> (<B><I>dump.id.out</I></B> if unspecified) file;
|
|
* if zero, turns off output to the <B>DUMP</B> file.
|
|
* @retval IPQ_OK Success.
|
|
* @retval IPQ_BADINSTANCE The given id is invalid.
|
|
* @see GetDumpFileOn, GetDumpString, GetDumpStringLine, GetDumpStringOn, GetDumpStringLineCount, SetDumpStringOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION SetDumpFileOn(ID,DUMP_ON)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* LOGICAL(KIND=4), INTENT(IN) :: DUMP_ON
|
|
* INTEGER(KIND=4) :: SetDumpFileOn
|
|
* END FUNCTION SetDumpFileOn
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT IPQ_RESULT SetDumpFileOn(int id, int dump_on);
|
|
|
|
|
|
/**
|
|
* 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 after calling
|
|
* \ref CreateIPhreeqc is off.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @param dump_string_on If non-zero, captures the output defined by the <B>DUMP</B> keyword into a string buffer;
|
|
* if zero, output defined by the <B>DUMP</B> keyword is not captured to a string buffer.
|
|
* @retval IPQ_OK Success.
|
|
* @retval IPQ_BADINSTANCE The given id is invalid.
|
|
* @see GetDumpFileOn, GetDumpStringOn, GetDumpString, GetDumpStringLine, GetDumpStringLineCount, SetDumpFileOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION SetDumpStringOn(ID,DUMP_STRING_ON)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* LOGICAL(KIND=4), INTENT(IN) :: DUMP_STRING_ON
|
|
* INTEGER(KIND=4) :: SetDumpStringOn
|
|
* END FUNCTION SetDumpStringOn
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*
|
|
* @par C Example:
|
|
* see \ref GetDumpString_c "GetDumpString"
|
|
*
|
|
* @par Fortran90 Example:
|
|
* see \ref GetDumpStringLine_f90 "GetDumpStringLine"
|
|
*/
|
|
IPQ_DLL_EXPORT IPQ_RESULT SetDumpStringOn(int id, int dump_string_on);
|
|
|
|
/**
|
|
* Sets the name of the error file. The default value is <B><I>phreeqc.id.err</I></B>.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @param filename The name of the error file.
|
|
* @retval IPQ_OK Success.
|
|
* @retval IPQ_BADINSTANCE The given id is invalid.
|
|
* @see GetErrorFileName, GetErrorFileOn, GetErrorString, GetErrorStringOn, GetErrorStringLine, GetErrorStringLineCount, SetErrorFileOn, SetErrorStringOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION SetErrorFileName(ID,FILENAME)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* CHARACTER(LEN=*), INTENT(OUT) :: FILENAME
|
|
* INTEGER(KIND=4) :: SetErrorFileName
|
|
* END FUNCTION SetErrorFileName
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT IPQ_RESULT SetErrorFileName(int id, 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> file. The initial setting after calling
|
|
* \ref CreateIPhreeqc is off.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @param error_on If non-zero, writes errors to the error file; if zero, no errors are written to the error file.
|
|
* @retval IPQ_OK Success.
|
|
* @retval IPQ_BADINSTANCE The given id is invalid.
|
|
* @see GetErrorFileOn, GetErrorStringLine, GetErrorStringLineCount, OutputErrorString
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION SetErrorFileOn(ID,ERR_ON)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* LOGICAL(KIND=4), INTENT(IN) :: ERR_ON
|
|
* INTEGER(KIND=4) :: SetErrorFileOn
|
|
* END FUNCTION SetErrorFileOn
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT IPQ_RESULT SetErrorFileOn(int id, int error_on);
|
|
|
|
/**
|
|
* 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 after calling
|
|
* \ref CreateIPhreeqc is on.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @param error_string_on If non-zero, captures the error output into a string buffer;
|
|
* if zero, error output is not captured to a string buffer.
|
|
* @retval IPQ_OK Success.
|
|
* @retval IPQ_BADINSTANCE The given id is invalid.
|
|
* @see GetErrorFileOn, GetErrorStringOn, GetErrorString, GetErrorStringLine, GetErrorStringLineCount, SetErrorFileOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION SetErrorStringOn(ID,ERR_STRING_ON)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* LOGICAL(KIND=4), INTENT(IN) :: ERR_STRING_ON
|
|
* INTEGER(KIND=4) :: SetErrorStringOn
|
|
* END FUNCTION SetErrorStringOn
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*
|
|
* @par C Example:
|
|
* see \ref GetErrorString_c "GetErrorString"
|
|
*
|
|
* @par Fortran90 Example:
|
|
* see \ref GetErrorStringLine_f90 "GetErrorStringLine"
|
|
*/
|
|
IPQ_DLL_EXPORT IPQ_RESULT SetErrorStringOn(int id, int error_string_on);
|
|
|
|
/**
|
|
* Sets the name of the log file. The default value is <B><I>phreeqc.id.log</I></B>.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @param filename The name of the log file.
|
|
* @retval IPQ_OK Success.
|
|
* @retval IPQ_BADINSTANCE The given id is invalid.
|
|
* @see GetLogFileName, GetLogFileOn, GetLogString, GetLogStringOn, GetLogStringLine, GetLogStringLineCount, SetLogFileOn, SetLogStringOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION SetLogFileName(ID,FILENAME)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* CHARACTER(LEN=*), INTENT(OUT) :: FILENAME
|
|
* INTEGER(KIND=4) :: SetLogFileName
|
|
* END FUNCTION SetLogFileName
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT IPQ_RESULT SetLogFileName(int id, 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> file. The initial setting after calling
|
|
* \ref CreateIPhreeqc is off.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @param log_on If non-zero, log messages are written to the log file; if zero, no log messages are written to the log file.
|
|
* @retval IPQ_OK Success.
|
|
* @retval IPQ_BADINSTANCE The given id is invalid.
|
|
* @remarks
|
|
* Logging must be enabled through the use of the KNOBS -logfile option in order to receive any log messages.
|
|
* @see GetLogFileOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION SetLogFileOn(ID,LOG_ON)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* LOGICAL(KIND=4), INTENT(IN) :: LOG_ON
|
|
* INTEGER(KIND=4) :: SetLogFileOn
|
|
* END FUNCTION SetLogFileOn
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT IPQ_RESULT SetLogFileOn(int id, int log_on);
|
|
|
|
/**
|
|
* 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 after calling
|
|
* \ref CreateIPhreeqc is off.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @param log_string_on If non-zero, captures the log output into a string buffer;
|
|
* if zero, log output is not captured to a string buffer.
|
|
* @retval IPQ_OK Success.
|
|
* @retval IPQ_BADINSTANCE The given id is invalid.
|
|
* @see GetLogFileOn, GetLogStringOn, GetLogString, GetLogStringLine, GetLogStringLineCount, SetLogFileOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION SetLogStringOn(ID,LOG_STRING_ON)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* LOGICAL(KIND=4), INTENT(IN) :: LOG_STRING_ON
|
|
* INTEGER(KIND=4) :: SetLogStringOn
|
|
* END FUNCTION SetLogStringOn
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*
|
|
* @par C Example:
|
|
* see \ref GetLogString_c "GetLogString"
|
|
*
|
|
* @par Fortran90 Example:
|
|
* see \ref GetLogStringLine_f90 "GetLogStringLine"
|
|
*/
|
|
IPQ_DLL_EXPORT IPQ_RESULT SetLogStringOn(int id, int log_string_on);
|
|
|
|
|
|
/**
|
|
* Sets the name of the output file. This file name is used if not specified within <B>DUMP</B> input.
|
|
* The default value is <B><I>phreeqc.id.out</I></B>.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @param filename The name of the phreeqc output file.
|
|
* @retval IPQ_OK Success.
|
|
* @retval IPQ_BADINSTANCE The given id is invalid.
|
|
* @see GetOutputFileName, GetOutputFileOn, GetOutputString, GetOutputStringOn, GetOutputStringLine, GetOutputStringLineCount, SetOutputFileOn, SetOutputStringOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION SetOutputFileName(ID,FILENAME)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* CHARACTER(LEN=*), INTENT(OUT) :: FILENAME
|
|
* INTEGER(KIND=4) :: SetOutputFileName
|
|
* END FUNCTION SetOutputFileName
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT IPQ_RESULT SetOutputFileName(int id, 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. This is the output normally generated
|
|
* when phreeqc is run. The initial setting after calling \ref CreateIPhreeqc is off.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @param output_on If non-zero, writes output to the output file; if zero, no output is written to the output file.
|
|
* @retval IPQ_OK Success.
|
|
* @retval IPQ_BADINSTANCE The given id is invalid.
|
|
* @see GetOutputFileOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION SetOutputFileOn(ID,OUT_ON)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* LOGICAL(KIND=4), INTENT(IN) :: OUT_ON
|
|
* INTEGER(KIND=4) :: SetOutputFileOn
|
|
* END FUNCTION SetOutputFileOn
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT IPQ_RESULT SetOutputFileOn(int id, int output_on);
|
|
|
|
/**
|
|
* 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 after calling
|
|
* \ref CreateIPhreeqc is off.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @param output_string_on If non-zero, captures the phreeqc output into a string buffer;
|
|
* if zero, phreeqc output is not captured to a string buffer.
|
|
* @retval IPQ_OK Success.
|
|
* @retval IPQ_BADINSTANCE The given id is invalid.
|
|
* @see GetOutputFileOn, GetOutputStringOn, GetOutputString, GetOutputStringLine, GetOutputStringLineCount, SetOutputFileOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION SetOutputStringOn(ID,OUTPUT_STRING_ON)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* LOGICAL(KIND=4), INTENT(IN) :: OUTPUT_STRING_ON
|
|
* INTEGER(KIND=4) :: SetOutputStringOn
|
|
* END FUNCTION SetOutputStringOn
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*
|
|
* @par C Example:
|
|
* see \ref GetOutputString_c "GetOutputString"
|
|
*
|
|
* @par Fortran90 Example:
|
|
* see \ref GetOutputStringLine_f90 "GetOutputStringLine"
|
|
*/
|
|
IPQ_DLL_EXPORT IPQ_RESULT SetOutputStringOn(int id, int output_string_on);
|
|
|
|
|
|
/**
|
|
* Sets the name of the selected output file. This file name is used if not specified within <B>SELECTED_OUTPUT</B> input.
|
|
* The default value is <B><I>selected.id.out</I></B>.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @param filename The name of the file to write <B>SELECTED_OUTPUT</B> output to.
|
|
* @retval IPQ_OK Success.
|
|
* @retval IPQ_BADINSTANCE The given id is invalid.
|
|
* @see GetSelectedOutputFileName, GetSelectedOutputFileOn, GetSelectedOutputString, GetSelectedOutputStringOn, GetSelectedOutputStringLine, GetSelectedOutputStringLineCount, SetSelectedOutputFileOn, SetSelectedOutputStringOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION SetSelectedOutputFileName(ID,FILENAME)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* CHARACTER(LEN=*), INTENT(OUT) :: FILENAME
|
|
* INTEGER(KIND=4) :: SetSelectedOutputFileName
|
|
* END FUNCTION SetSelectedOutputFileName
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT IPQ_RESULT SetSelectedOutputFileName(int id, const char* filename);
|
|
|
|
|
|
/**
|
|
* Sets the selected-output file switch on or off. This switch controls whether or not phreeqc writes output to
|
|
* the <B>SELECTED_OUTPUT</B> (<B><I>selected.id.out</I></B> if unspecified) file. The initial setting after calling \ref CreateIPhreeqc is off.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @param sel_on If non-zero, writes output to the selected-output file; if zero, no output is written to the selected-output file.
|
|
* @retval IPQ_OK Success.
|
|
* @retval IPQ_BADINSTANCE The given id is invalid.
|
|
* @see GetSelectedOutputFileOn, GetSelectedOutputColumnCount, GetSelectedOutputRowCount, GetSelectedOutputValue
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION SetSelectedOutputFileOn(ID,SEL_ON)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* LOGICAL(KIND=4), INTENT(IN) :: SEL_ON
|
|
* INTEGER(KIND=4) :: SetSelectedOutputFileOn
|
|
* END FUNCTION SetSelectedOutputFileOn
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*/
|
|
IPQ_DLL_EXPORT IPQ_RESULT SetSelectedOutputFileOn(int id, int sel_on);
|
|
|
|
/**
|
|
* Sets the selected output string switch on or off. This switch controls whether or not the data normally sent
|
|
* to the selected output file are stored in a buffer for retrieval. The initial setting after calling
|
|
* \ref CreateIPhreeqc is off.
|
|
* @param id The instance id returned from \ref CreateIPhreeqc.
|
|
* @param dump_string_on If non-zero, captures the output defined by the <B>SELECTED_OUTPUT</B> keyword into a string buffer;
|
|
* if zero, output defined by the <B>SELECTED_OUTPUT</B> keyword is not captured to a string buffer.
|
|
* @retval IPQ_OK Success.
|
|
* @retval IPQ_BADINSTANCE The given id is invalid.
|
|
* @see GetSelectedOutputFileOn, GetSelectedOutputStringOn, GetSelectedOutputString, GetSelectedOutputStringLine, GetSelectedOutputStringLineCount, SetSelectedOutputFileOn
|
|
* @par Fortran90 Interface:
|
|
* @htmlonly
|
|
* <CODE>
|
|
* <PRE>
|
|
* FUNCTION SetSelectedOutputStringOn(ID,SELECTED_OUTPUT_STRING_ON)
|
|
* INTEGER(KIND=4), INTENT(IN) :: ID
|
|
* LOGICAL(KIND=4), INTENT(IN) :: SELECTED_OUTPUT_STRING_ON
|
|
* INTEGER(KIND=4) :: SetSelectedOutputStringOn
|
|
* END FUNCTION SetSelectedOutputStringOn
|
|
* </PRE>
|
|
* </CODE>
|
|
* @endhtmlonly
|
|
*
|
|
* @par C Example:
|
|
* see \ref GetSelectedOutputString_c "GetSelectedOutputString"
|
|
*
|
|
* @par Fortran90 Example:
|
|
* see \ref GetSelectedOutputStringLine_f90 "GetSelectedOutputStringLine"
|
|
*/
|
|
IPQ_DLL_EXPORT IPQ_RESULT SetSelectedOutputStringOn(int id, int dump_string_on);
|
|
|
|
// TODO int RunWithCallback(PFN_PRERUN_CALLBACK pfn_pre, PFN_POSTRUN_CALLBACK pfn_post, void *cookie, int output_on, int error_on, int log_on, int selected_output_on);
|
|
|
|
|
|
// TODO int CatchErrors(PFN_CATCH_CALLBACK pfn, void *cookie);
|
|
|
|
|
|
#if defined(__cplusplus)
|
|
}
|
|
#endif
|
|
|
|
#endif // INC_IPHREEQC_H
|