Thermodynamics Research Center / ThermoML | Fluid Phase Equilibria

Thermodynamic properties of binary aqueous solutions of orthophosphate salts, sodium, potassium and ammonium at T= 298.15 K

Guendouzi, M. E.[Mohamed El], Benbiyi, A.[Asmaa]
Fluid Phase Equilib. 2014, 369, 68-85
ABSTRACT
In this investigation, the thermodynamic properties of the aqueous solutions of orthophosphate salts M3-nHnPO4H2O with n = 0, 1, or 2 and M = Na+, K+ or NH4+ at 98.15 K are determined. The water activity measurements for NaH2PO4(aq), Na2HPO4(aq), Na3PO4(aq); KH2PO4(aq), K2HPO4(aq), K3PO4(aq), (NH4)H2PO4(aq), (NH4)2HPO4(aq) and (NH4)3PO4(aq) are effectuated from dilution to saturated solution using the hygrometric method. The activity coefficients are evaluated using ionic-interaction model. The mineral solubility of these phosphate salts is investigated at T = 298.15 K. The prediction of solubility is made for minerals and other solid phases in aqueous solutions of phosphates. Correlating and predicting the phase behavior in such systems is a difficult task, partially caused by chemical reactions in the liquid phase but also due to the possible formation of one or more solid phases. Solid phases, molality of saturated binary solutions ms(exp) and logarithm of solubility product K?sp are also determined at 298.15 K. The standard molar Gibbs energies of dissolution Gdiss, formation GfCalc and the literature GfRef, of solid phases crystallizing from saturated phosphate salts solutions are evaluated. This investigation allows understanding physicochemical nature and structure of phosphate solutions, in particular, questions of anion or cation hydration, especially at higher concentrations, ion-pairing formation, and the possibility of phosphate complex formation.
Compounds
# Formula Name
1 H2NaO4P sodium dihydrogen phosphate
2 H2KO4P monopotassium phosphate
3 H6NO4P ammonium dihydrogen phosphate
4 HNa2O4P disodium hydrogen phosphate
5 HK2O4P dipotassium hydrogen phosphate
6 Na3O4P trisodium phosphate
7 K3O4P tripotassium phosphate
8 H12N3O4P ammonium phosphate
9 H9N2O4P diammonium hydrogen phosphate
10 H2O water
Datasets
The table above is generated from the ThermoML associated json file (link above). POMD and RXND refer to PureOrMixture and Reaction Datasets. The compound numbers are included in properties, variables, and phases, if specificied; the numbers refer to the table of compounds on the left.
Type Compound-# Property Variable Constraint Phase Method #Points
  • POMD
  • 1
  • 10
  • (Relative) activity - 10 ; Liquid
  • Molality, mol/kg - 1; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • isopiestic method
  • 20
  • POMD
  • 1
  • 10
  • Molality, mol/kg - 1 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal of intercomponent compound 1
  • gravimetric
  • 1
  • POMD
  • 10
  • 2
  • (Relative) activity - 10 ; Liquid
  • Molality, mol/kg - 2; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • isopiestic method
  • 20
  • POMD
  • 10
  • 2
  • Molality, mol/kg - 2 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal - 2
  • gravimetric
  • 1
  • POMD
  • 3
  • 10
  • (Relative) activity - 10 ; Liquid
  • Molality, mol/kg - 3; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • isopiestic method
  • 19
  • POMD
  • 3
  • 10
  • Molality, mol/kg - 3 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal - 3
  • gravimetric
  • 1
  • POMD
  • 4
  • 10
  • (Relative) activity - 10 ; Liquid
  • Molality, mol/kg - 4; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • isopiestic method
  • 16
  • POMD
  • 4
  • 10
  • Molality, mol/kg - 4 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal of intercomponent compound 1
  • gravimetric
  • 1
  • POMD
  • 10
  • 5
  • (Relative) activity - 10 ; Liquid
  • Molality, mol/kg - 5; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • isopiestic method
  • 20
  • POMD
  • 10
  • 5
  • Molality, mol/kg - 5 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal of intercomponent compound 1
  • gravimetric
  • 1
  • POMD
  • 6
  • 10
  • (Relative) activity - 10 ; Liquid
  • Molality, mol/kg - 6; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • isopiestic method
  • 13
  • POMD
  • 6
  • 10
  • Molality, mol/kg - 6 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal of intercomponent compound 1
  • gravimetric
  • 1
  • POMD
  • 10
  • 7
  • (Relative) activity - 10 ; Liquid
  • Molality, mol/kg - 7; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • isopiestic method
  • 17
  • POMD
  • 10
  • 7
  • Molality, mol/kg - 7 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal of intercomponent compound 1
  • gravimetric
  • 1
  • POMD
  • 10
  • 8
  • (Relative) activity - 10 ; Liquid
  • Molality, mol/kg - 8; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • isopiestic method
  • 18
  • POMD
  • 10
  • 8
  • Molality, mol/kg - 8 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal of intercomponent compound 1
  • gravimetric
  • 1
  • POMD
  • 10
  • 9
  • (Relative) activity - 10 ; Liquid
  • Molality, mol/kg - 9; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • isopiestic method
  • 20
  • POMD
  • 10
  • 9
  • Molality, mol/kg - 9 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal - 9
  • gravimetric
  • 1