Time:                   0
Chemistry cell:         0
Grid cell(s) (0-based): 0 
------------------------------------
Reading input data for simulation 1.
------------------------------------

	RUN_CELLS
	  -start_time 0
	  -time_step  0
	  -cells      0
	END
--------------------------
Beginning of run as cells.
--------------------------

-----------------------------------------
Beginning of batch-reaction calculations.
-----------------------------------------

Reaction step 1.

Using solution 0.	
Using pure phase assemblage 0.	

-------------------------------Phase assemblage--------------------------------

                                                      Moles in assemblage
Phase               SI  log IAP  log K(T, P)   Initial       Final       Delta

Calcite           0.00    -8.48     -8.48    8.000e-01   8.000e-01  -3.774e-05

-----------------------------Solution composition------------------------------

	Elements           Molality       Moles

	C                 1.894e-04   3.774e-05
	Ca                1.894e-04   3.774e-05
	Cl                4.358e-02   8.685e-03
	Na                4.358e-02   8.685e-03

----------------------------Description of solution----------------------------

                                       pH  =   9.942      Charge balance
                                       pe  =  -4.146      Adjusted to redox equilibrium
     Specific Conductance (µS/cm,  25°C)  = 4904
                         Density (g/cm³)  =   0.99887
                               Volume (L)  =   0.20000
                        Viscosity (mPa s)  =   0.89423
                        Activity of water  =   0.999
                 Ionic strength (mol/kgw)  =   4.421e-02
                       Mass of water (kg)  =   1.993e-01
                 Total alkalinity (eq/kg)  =   3.788e-04
                       Total CO2 (mol/kg)  =   1.894e-04
                        Temperature (°C)  =  25.00
                  Electrical balance (eq)  =   3.637e-17
 Percent error, 100*(Cat-|An|)/(Cat+|An|)  =   0.00
                               Iterations  =  16
                                  Total H  = 2.212048e+01
                                  Total O  = 1.106036e+01

----------------------------Distribution of species----------------------------

                                               Log       Log       Log    mole V
   Species          Molality    Activity  Molality  Activity     Gamma   cm³/mol

   OH-             1.079e-04   8.841e-05    -3.967    -4.054    -0.086     -3.89
   H+              1.331e-10   1.143e-10    -9.876    -9.942    -0.066      0.00
   H2O             5.551e+01   9.985e-01     1.744    -0.001     0.000     18.07
C(-4)         2.448e-30
   CH4             2.448e-30   2.473e-30   -29.611   -29.607     0.004     35.46
C(4)          1.894e-04
   HCO3-           1.078e-04   9.009e-05    -3.967    -4.045    -0.078     24.77
   CO3-2           7.589e-05   3.696e-05    -4.120    -4.432    -0.312     -3.29
   CaCO3           5.507e-06   5.563e-06    -5.259    -5.255     0.004    -14.60
   CaHCO3+         1.226e-07   1.030e-07    -6.911    -6.987    -0.076      9.79
   CO2             2.295e-08   2.319e-08    -7.639    -7.635     0.004     34.43
   (CO2)2          9.771e-18   9.871e-18   -17.010   -17.006     0.004     68.87
Ca            1.894e-04
   Ca+2            1.836e-04   8.960e-05    -3.736    -4.048    -0.312    -17.65
   CaCO3           5.507e-06   5.563e-06    -5.259    -5.255     0.004    -14.60
   CaOH+           1.568e-07   1.299e-07    -6.805    -6.886    -0.082     (0)  
   CaHCO3+         1.226e-07   1.030e-07    -6.911    -6.987    -0.076      9.79
Cl            4.358e-02
   Cl-             4.358e-02   3.584e-02    -1.361    -1.446    -0.085     18.24
   HCl             1.351e-12   1.411e-12   -11.869   -11.850     0.019     (0)  
H(0)          3.595e-15
   H2              1.797e-15   1.816e-15   -14.745   -14.741     0.004     28.61
Na            4.358e-02
   Na+             4.358e-02   3.625e-02    -1.361    -1.441    -0.080     -1.23
   NaOH            3.172e-16   3.205e-16   -15.499   -15.494     0.004     (0)  
O(0)          0.000e+00
   O2              0.000e+00   0.000e+00   -62.904   -62.899     0.004     30.40

------------------------------Saturation indices-------------------------------

  Phase               SI** log IAP   log K(298 K,   1 atm)

  Aragonite        -0.14     -8.48   -8.34  CaCO3
  Calcite           0.00     -8.48   -8.48  CaCO3
  CH4(g)          -26.80    -29.61   -2.80  CH4
  CO2(g)           -6.17     -7.63   -1.47  CO2
  H2(g)           -11.64    -14.74   -3.10  H2
  H2O(g)           -1.50     -0.00    1.50  H2O
  Halite           -4.46     -2.89    1.57  NaCl
  O2(g)           -60.01    -62.90   -2.89  O2

**For a gas, SI = log10(fugacity). Fugacity = pressure * phi / 1 atm.
  For ideal gases, phi = 1.

------------------
End of simulation.
------------------

------------------------------------
Reading input data for simulation 2.
------------------------------------

-------------------------------
End of Run after 0.694 Seconds.
-------------------------------

Time:                   0
Chemistry cell:         1
Grid cell(s) (0-based): 1 
------------------------------------
Reading input data for simulation 1.
------------------------------------

	RUN_CELLS
	  -start_time 0
	  -time_step  0
	  -cells      1
	END
--------------------------
Beginning of run as cells.
--------------------------

-----------------------------------------
Beginning of batch-reaction calculations.
-----------------------------------------

Reaction step 1.

Using solution 1.	

-----------------------------Solution composition------------------------------

	Elements           Molality       Moles

	Cl                1.062e+00   2.077e-01
	Na                1.062e+00   2.077e-01

----------------------------Description of solution----------------------------

                                       pH  =   6.962      Charge balance
                                       pe  =  -0.549      Adjusted to redox equilibrium
     Specific Conductance (µS/cm,  25°C)  = 87000
                         Density (g/cm³)  =   1.03837
                               Volume (L)  =   0.20000
                        Viscosity (mPa s)  =   0.97896
                        Activity of water  =   0.964
                 Ionic strength (mol/kgw)  =   1.062e+00
                       Mass of water (kg)  =   1.955e-01
                 Total alkalinity (eq/kg)  =   4.654e-17
                        Temperature (°C)  =  25.00
                  Electrical balance (eq)  =   1.549e-16
 Percent error, 100*(Cat-|An|)/(Cat+|An|)  =   0.00
                               Iterations  =   5
                                  Total H  = 2.170705e+01
                                  Total O  = 1.085353e+01

----------------------------Distribution of species----------------------------

                                               Log       Log       Log    mole V
   Species          Molality    Activity  Molality  Activity     Gamma   cm³/mol

   OH-             1.556e-07   8.944e-08    -6.808    -7.048    -0.241     -2.01
   H+              1.471e-07   1.091e-07    -6.832    -6.962    -0.130      0.00
   H2O             5.551e+01   9.639e-01     1.744    -0.016     0.000     18.07
Cl            1.062e+00
   Cl-             1.062e+00   6.433e-01     0.026    -0.192    -0.218     18.97
   HCl             8.536e-09   2.417e-08    -8.069    -7.617     0.452     (0)  
H(0)          1.652e-16
   H2              8.262e-17   1.055e-16   -16.083   -15.977     0.106     28.61
Na            1.062e+00
   Na+             1.062e+00   7.807e-01     0.026    -0.107    -0.134     -0.27
   NaOH            5.468e-18   6.983e-18   -17.262   -17.156     0.106     (0)  
O(0)          0.000e+00
   O2              0.000e+00   0.000e+00   -60.565   -60.459     0.106     30.40

------------------------------Saturation indices-------------------------------

  Phase               SI** log IAP   log K(298 K,   1 atm)

  H2(g)           -12.88    -15.98   -3.10  H2
  H2O(g)           -1.52     -0.02    1.50  H2O
  Halite           -1.87     -0.30    1.57  NaCl
  O2(g)           -57.57    -60.46   -2.89  O2

**For a gas, SI = log10(fugacity). Fugacity = pressure * phi / 1 atm.
  For ideal gases, phi = 1.

------------------
End of simulation.
------------------

------------------------------------
Reading input data for simulation 2.
------------------------------------

-------------------------------
End of Run after 0.691 Seconds.
-------------------------------

Time:                   0
Chemistry cell:         2
Grid cell(s) (0-based): 2 
------------------------------------
Reading input data for simulation 1.
------------------------------------

	RUN_CELLS
	  -start_time 0
	  -time_step  0
	  -cells      2
	END
--------------------------
Beginning of run as cells.
--------------------------

-----------------------------------------
Beginning of batch-reaction calculations.
-----------------------------------------

Reaction step 1.

Using solution 2.	

-----------------------------Solution composition------------------------------

	Elements           Molality       Moles

	Cl                2.826e-02   5.634e-03
	Na                4.358e-02   8.688e-03

----------------------------Description of solution----------------------------

                                       pH  =  12.095      Charge balance
                                       pe  =   4.000      Adjusted to redox equilibrium
     Specific Conductance (µS/cm,  25°C)  = 6691
                         Density (g/cm³)  =   0.99890
                               Volume (L)  =   0.20000
                        Viscosity (mPa s)  =   0.89531
                        Activity of water  =   0.999
                 Ionic strength (mol/kgw)  =   4.358e-02
                       Mass of water (kg)  =   1.993e-01
                 Total alkalinity (eq/kg)  =   1.532e-02
                        Temperature (°C)  =  25.00
                  Electrical balance (eq)  =  -6.418e-17
 Percent error, 100*(Cat-|An|)/(Cat+|An|)  =  -0.00
                               Iterations  =   0
                                  Total H  = 2.213101e+01
                                  Total O  = 1.106703e+01

----------------------------Distribution of species----------------------------

                                               Log       Log       Log    mole V
   Species          Molality    Activity  Molality  Activity     Gamma   cm³/mol

   OH-             1.532e-02   1.257e-02    -1.815    -1.901    -0.086     -3.89
   H+              9.354e-13   8.038e-13   -12.029   -12.095    -0.066      0.00
   H2O             5.551e+01   9.985e-01     1.744    -0.001     0.000     18.07
Cl            2.826e-02
   Cl-             2.826e-02   2.327e-02    -1.549    -1.633    -0.085     18.24
   HCl             6.173e-15   6.442e-15   -14.210   -14.191     0.019     (0)  
H(0)          9.057e-36
   H2              4.529e-36   4.574e-36   -35.344   -35.340     0.004     28.61
Na            4.358e-02
   Na+             4.358e-02   3.628e-02    -1.361    -1.440    -0.080     -1.23
   NaOH            4.516e-14   4.562e-14   -13.345   -13.341     0.004     (0)  
O(0)          3.933e-22
   O2              1.967e-22   1.986e-22   -21.706   -21.702     0.004     30.40

------------------------------Saturation indices-------------------------------

  Phase               SI** log IAP   log K(298 K,   1 atm)

  H2(g)           -32.24    -35.34   -3.10  H2
  H2O(g)           -1.50     -0.00    1.50  H2O
  Halite           -4.64     -3.07    1.57  NaCl
  O2(g)           -18.81    -21.70   -2.89  O2

**For a gas, SI = log10(fugacity). Fugacity = pressure * phi / 1 atm.
  For ideal gases, phi = 1.

------------------
End of simulation.
------------------

------------------------------------
Reading input data for simulation 2.
------------------------------------

------------------------------
End of Run after 0.69 Seconds.
------------------------------

