RES³T - Rossendorf Expert System for Surface and Sorption Thermodynamics

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Binding Site Data:


Mineral: Zirconium oxophosphate
Reference: ADMCD08
SCM Type: CC - Constant Capacitance   (C1: 3.1 F/m2)
Ionic Strength: KNO3
Site Type: »POH
PZC: 4.8
pK1: 3.6   pK12.31 nm−2 (normalized): 4.08
pK2: -5.8   pK22.31 nm−2 (normalized): -6.28
Site Density in nm-2: 7.0000
Original Site Density: 7.0 sites / nm² surface
Solid/Liquid Ratio in g/L: 100.0
pH Range:
Temperature in K: 348.15
Method for Site Density: Potentiometric Titration
Method for Protolysis:Potentiometric Titration
Fit Method:FITEQL
Comment: calculated surface acidity constants for the protonation (+) and deprotonation (-) reactions of the zirconium and phosphate suface sites modelled between 25 °C and 90°C; POH: 25°C logK+ = 3.6, logK- = -6.7; 50 °C logK+ = 3.6, logK- = -6.1; 75 °C logK+ = 3.6, logK- = -5.8; 90 °C logK+ = 3.6, logK- = -5.6; ZrOH: 25 °C logK+ = 3.2, logK- = -5.6; 50 °C logK+ = 3.2, logK- = -5.0; 75 °C logK+ = 3.2, logK- = -4.8; 90°C logK+ = 3.2, logK- = -4.7
 
Mineral: Zirconium oxophosphate
Reference: ADMCD08
SCM Type: CC - Constant Capacitance   (C1: 3.1 F/m2)
Ionic Strength: KNO3
Site Type: »Zr-OH
PZC: 4.8
pK1: 3.2   pK12.31 nm−2 (normalized): 3.68
pK2: -4.8   pK22.31 nm−2 (normalized): -5.28
Site Density in nm-2: 7.0000
Original Site Density: 7.0 sites / nm² surface
Solid/Liquid Ratio in g/L: 100.0
pH Range:
Temperature in K: 348.15
Method for Site Density: Potentiometric Titration
Method for Protolysis:Potentiometric Titration
Fit Method:FITEQL
Comment: calculated surface acidity constants for the protonation (+) and deprotonation (-) reactions of the zirconium and phosphate suface sites modelled between 25 °C and 90°C; POH: 25°C logK+ = 3.6, logK- = -6.7; 50 °C logK+ = 3.6, logK- = -6.1; 75 °C logK+ = 3.6, logK- = -5.8; 90 °C logK+ = 3.6, logK- = -5.6; ZrOH: 25 °C logK+ = 3.2, logK- = -5.6; 50 °C logK+ = 3.2, logK- = -5.0; 75 °C logK+ = 3.2, logK- = -4.8; 90°C logK+ = 3.2, logK- = -4.7
 
2 data sets were retrieved