Thermodynamics Research Center / ThermoML | Fluid Phase Equilibria

High pressure (solid + liquid) equilibria of n-alkane mixtures: experimental results, correlation and prediction

Morawski, P.[Piotr], Coutinho, J. A. P.[Joao A. P.], Domanska, U.[Urszula]
Fluid Phase Equilib. 2005, 230, 1-2, 72-80
ABSTRACT
(Solid + liquid) equilibria (SLE) of {n-alkanes (n-tridecane, n-hexadecane, n-octadecane) + n-hexane} at very high pressures up to about 1.0 GPa have been investigated in the temperature range from 293 to 363K using a thermostated apparatus for the measurements of transition pressures from the liquid to the solid state in two component isothermal solutions. The polynomial based on the general solubility equation at atmospheric pressure was satisfactorily used to the description of the pressuretemperature- composition relation of the high pressure (solid + liquid) equilibria. Additionally, the SLE of the binary system (n-tridecane + nhexane) at normal pressure was measured by the dynamic method. The results at higher pressures for every system were compared to those at normal pressure. The main aim of this work was to predict the SLE of the mixtures using only pure components data in a wide pressure range, far above the pressure range in which cubic equations of state are normally applied. The fluid phase is described by the corrected SRK-EOS using van der Waals one fluid mixing rules. The results of the predictions are compared with the experimental data presented in this paper {nalkanes (n-tridecane, n-hexadecane, n-octadecane) + n-hexane} and with experimental results presented previously {n-alkanes (n-tridecane, n-hexadecane, n-octadecane and n-eicosane) + cyclohexane}.
Compounds
# Formula Name
1 C13H28 tridecane
2 C16H34 hexadecane
3 C18H38 octadecane
4 C6H14 hexane
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
  • Solid-liquid equilibrium temperature, K ; Crystal 1
  • Pressure, kPa; Crystal 1
  • Crystal 1
  • Liquid
  • closed cylinder with variable piston
  • 7
  • POMD
  • 2
  • Solid-liquid equilibrium temperature, K ; Crystal
  • Pressure, kPa; Crystal
  • Crystal
  • Liquid
  • closed cylinder with variable piston
  • 6
  • POMD
  • 3
  • Solid-liquid equilibrium temperature, K ; Crystal
  • Pressure, kPa; Crystal
  • Crystal
  • Liquid
  • closed cylinder with variable piston
  • 6
  • POMD
  • 4
  • 1
  • Solid-liquid equilibrium temperature, K ; Liquid
  • Mole fraction - 1; Liquid
  • Pressure, kPa; Crystal 1 - 1
  • Liquid
  • Crystal 1 - 1
  • VISOBS:UFactor:8
  • 24
  • POMD
  • 4
  • 1
  • Solid-liquid equilibrium temperature, K ; Liquid
  • Mole fraction - 1; Liquid
  • Pressure, kPa; Crystal 2 - 1
  • Liquid
  • Crystal 2 - 1
  • VISOBS:UFactor:8
  • 15
  • POMD
  • 4
  • 1
  • Vapor or sublimation pressure, kPa ; Liquid
  • Mole fraction - 1; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal - 1
  • closed cylinder with variable piston
  • 90
  • POMD
  • 4
  • 2
  • Vapor or sublimation pressure, kPa ; Liquid
  • Mole fraction - 2; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal - 2
  • closed cylinder with variable piston
  • 78
  • POMD
  • 4
  • 3
  • Vapor or sublimation pressure, kPa ; Liquid
  • Mole fraction - 3; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal - 3
  • closed cylinder with variable piston
  • 90