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Molecular simulation of the impact of surface roughness on carbon dioxide adsorption in organic-rich shales
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Adsorption and diffusion behavior of CO2/H2 mixture in calcite slit pores: a molecular simulation study
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Adsorption behaviors of different components of shale oil in quartz slits studied by molecular simulation
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Oil adsorption in shale nanopores and its effect on recoverable oil-in-place
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Effect of cosolvents on CO2 displacement of shale oil and carbon storage
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COMPASS: an ab initio force-field optimized for condensed-phase applications overview with details on Alkane and Benzene compounds
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Molecular modeling of the volumetric and thermodynamic properties of kerogen: influence of organic type and maturity
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Molecular dynamics simulation study on the occurrence of shale oil in hybrid nanopores
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Hydrocarbon transportation in heterogeneous shale pores by molecular dynamic simulation
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Dynamics of impure CO2 and composite oil in mineral nanopores: implications for shale oil recovery and gas storage performance
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Molecular insights into CO2 huff-n-puff for enhancing hydrocarbon recovery and carbon sequestration in partially water-saturated nanopores
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Mechanisms of CO2 huff and puff enhanced oil recovery and storage within shale nanopores
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How gas recovery and carbon storage capacity response to dynamic deformation of kerogen upon CO2/CH4 competitive adsorption for CCUS? Evidence from molecular dynamics
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Molecular insights of excessive water cut during cyclic gas injection in liquid-rich shale reservoirs: contributions of hydrocarbon condensation and water trapping
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Mechanism of CO2 enhanced oil recovery in kerogen pores and CO2 sequestration in shale: a molecular dynamics simulation study
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Molecular dynamics simulation of sub- and supercritical water extraction shale oil in slit nanopores
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Molecular insight into minimum miscibility pressure estimation of shale oil/CO2 in organic nanopores using CO2 huff-n-puff
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Effects of shale pore size and connectivity on scCO2 enhanced oil recovery: a molecular dynamics simulation investigation
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Molecular dynamics simulations of the enhanced recovery of confined methane with carbon dioxide
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Shale oil occurrence and slit medium coupling based on a molecular dynamics simulation
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Pore structure and gas adsorption characteristics in stress-loaded shale on molecular simulation
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CO2 utilization and sequestration in organic-rich shale from the nanoscale perspective
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