张玉峰

Pore-Size- and Composition-Dependent Self-Diffusion of CO2 and n -Decane in Hydrophobic Slit Nanopores

Abstract Diffusion of CO2 and hydrocarbons in shale nanopores controls mass transfer during CO2-enhanced oil recovery. A finite-duration grand canonical Monte Carlo (GCMC)-assisted preparation protocol followed by canonical-ensemble molecular dynamics is used to investigate molec...