RES³T - Rossendorf Expert System for Surface and Sorption Thermodynamics

Show Detailed Complexation Query Results


Surface Complex Formation Data:

Mineral: Calcite
Reference: ZRHSK05
SCM Type: CC - Constant Capacitance
Ligand: Pu<4+> - plutonium(IV)
Site Type: »Ca-OH
Equation: »Ca-OH + Pu<4+> + 2 CO3<2-> + 4 H2O  ⇔  »Ca-O-Pu(CO3)2(OH)4 + 5 H<1+>
LogK: 31.71        LogK°I=0 (Conversion to I = 0):   31.71         LogK2.31 nm−2 (SSD-normalized):   27.19
Experiment: Batch Sorption Experiments
Ionic Strength: 0.0 mol/L
Temperature: 298.15 K
Solid/Liquid Ratio: 5.0 g/L
pH Range: 7.5-9.75
Ligand Concentration Range: 5E-9 mol/L
Fit Method: FITEQL
Comment: background electrolyte calcite equilibrated solution; 48h, 0.03% CO2; ATTENTION: error in fitting code produced incorrect values. All values need to be increase by +8 log units. (correct -0.80 instead of -8.80 in table 3); original reaction equation in the article: »Ca<+> + Pu<4+> + 2 HCO3<1-> + 4 H2O = »Ca-CO3Pu(OH)4CO3<1-> + 6 H<1+> with logK = -0.8, conversion done with the reaction HCO3<1-> = CO3<2-> + H<1+> and logK = -10,33 [JL97] and converted to »CaOH surface species with data taken from Table 2.
 
1 data sets were retrieved