Molecular dynamics study of CO2 sorption and transport properties in coal
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文摘

CO2 sorption-induced coal swelling negatively correlates with CO2 self-diffusivity.

CO2 – coal interaction controls the behaviors of coal swelling/CO2 self-diffusivity.

Swelling/self-diffusivity are separated into two opposing stages at around 8 MPa.

Transport diffusivity exceeds self-diffusivity as thermodynamic factor >1.

CO2 permeability exponentially increases with decreasing reservoir gas pressure.

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