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chenxinger

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  1. When I open the thermo.dat file, I saw there are some parameters for pressure after those for the principle temperatures. How are the pressure effect considered in GWB? I am using GWB to calculate the solution under a constant CO2 pressure of 102 atm, and at temperature of 95 deg C. Under this condition, CO2 is at supercritical phase. I am wondering how could I calculate the fugacity coefficient under this pressure? Also, the equilibrium constant for other aqueous species will change under high pressure also, how would GWB consider this effect? thank you.
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