The steam barrier as a design constraint in carbon capture: pathways to low-temperature regeneration - Python code

The Python scripts accompannying the publication: The steam barrier as a design constraint in carbon capture: pathways to low-temperature regeneration, submitted to Chemical Engineering and Processing - Process Intensification is presented here.

The following scripts are included:

Davies.py - it calculates the chemical and gas-liquid equilibrium using the semi-empirical Davies activity coefficient model.
Debye_Hückel.py - it calculates the chemical and gas-liquid equilibrium using the Debye Hückel activity coefficient model.
Ideal.py - it calculates the chemical and gas-liquid equilibrium assuming an ideal liquid phase.
contour_creation.py - iterates accross different parameter values to create the contour plots of Figure 4 in the main article.
water_exergy_vs_T_vs_p.py - performs the exergy calculations.