RES³T - Rossendorf Expert System for Surface and Sorption Thermodynamics

Show Detailed Site Query Results


Binding Site Data:


Mineral: Calcite
Reference: LS07b
SCM Type: NE - Non-electrostatic   (C1: 15.0 F/m2)
Ionic Strength: 0.0 mol/L of
Site Type: »CO3H
PZC:
pK1: pK1°I=0 (Conversion to I = 0):  
pK2: 5.1 pK2°I=0 (Conversion to I = 0): 5.10 pK22.31 nm−2 (normalized): 4.77
Site Density in nm-2: 4.9501
Original Site Density: 8.22 µmol / m² surface
Solid/Liquid Ratio in g/L:
pH Range:
Temperature in K: 298.15
Method for Site Density: Best Estimate
Method for Protolysis:Literature
Fit Method:FITEQL
Comment: Calcite SSD was estimated from the atomic spacing of the surface unit cell. On the {10-14} plane, which is the surface that is most commonly observed on commercially available calcite powder used in uptake experiments, the surface unit cell is 4.99Å wide and 8.10Å long. It includes two Ca and two CO3 groups per 40.42Ų. Thus, calcite has about 5E-18 sites/m² or 8.22 µmol sites/m² for a cation or an anion; Data were compiled from Zachara et al. (1991), Van Cappellen et al. (1993) and Pokrovsky et al. (1999)
 
Mineral: Calcite
Reference: LS07b
SCM Type: NE - Non-electrostatic   (C1: 15.0 F/m2)
Ionic Strength: 0.0 mol/L of
Site Type: »Ca-OH
PZC:
pK1: 11.5 pK1°I=0 (Conversion to I = 0): 11.50 pK12.31 nm−2 (normalized): 11.83
pK2: 12.0 pK2°I=0 (Conversion to I = 0): 12.00 pK22.31 nm−2 (normalized): 11.67
Site Density in nm-2: 4.9501
Original Site Density: 8.22 µmol / m² surface
Solid/Liquid Ratio in g/L:
pH Range:
Temperature in K: 298.15
Method for Site Density: Best Estimate
Method for Protolysis:Literature
Fit Method:FITEQL
Comment: Calcite SSD was estimated from the atomic spacing of the surface unit cell. On the {10-14} plane, which is the surface that is most commonly observed on commercially available calcite powder used in uptake experiments, the surface unit cell is 4.99Å wide and 8.10Å long. It includes two Ca and two CO3 groups per 40.42Ų. Thus, calcite has about 5E-18 sites/m² or 8.22 µmol sites/m² for a cation or an anion; Data were compiled from Zachara et al. (1991), Van Cappellen et al. (1993) and Pokrovsky et al. (1999)
 
2 data sets were retrieved