
Hyperquad (version 6  0  1 )
Refinement Concluded at 08/09/2024 12:38:16
Data from: C:\...\HQD2013 - 4 tit\ZnEDTA.HQD ( modified)
Project title: Zn-EDTA simulations
Execution time 0.57 secs
26 iterations. Sigma = 2.119
Maximum number of iterations performed

                     Standard
Log beta   Value     Deviation Comment
H-1        -13.78              constant
EDTAH       10.19              constant
EDTAH2      16.32              constant
EDTAH3      19.01              constant
EDTAH4      21.01              constant
EDTAH5      22.51              constant
ZnH-1      -9.15               constant
ZnH-2      -17.1               constant
ZnH-3      -28.39              constant
ZnH-4      -40.71              constant
Zn2H-1     -8.89               constant
Zn2H-6     -57.53              constant
EDTAZnH    18.9862   0.0129
EDTAZn     15.9556   0.0337
EDTAZnH-1  4.5278    0.058

Dangerous parameters
           Standard
Value      Deviation change
2.551E-02  0.0       0.1% Initial concentration H curve 1 
2.551E-02  0.0       0.1% Initial concentration H curve 2 
2.551E-02  0.0       0.1% Initial concentration H curve 3 
2.550E-02  0.0       0.1% Initial concentration H curve 4 

Correlation coefficients
  2   0.799
  3   0.785   0.984
  4  -0.532  -0.64   -0.653
  5  -0.686  -0.845  -0.862   0.564
  6  -0.726  -0.911  -0.93    0.608   0.802
  7  -0.737  -0.938  -0.958   0.625   0.826   0.891
        1       2       3       4       5       6
Parameter numbers
 1 EDTAZnH
 2 EDTAZn
 3 EDTAZnH-1
 4 Total mmoles H curve  1 
 5 Total mmoles H curve  2 
 6 Total mmoles H curve  3 
 7 Total mmoles H curve  4 
