Molecular simulation of adsorption and diffusion behavior of CO2 in pyrophyllite
Chunquan Li, Shanqi Liu, Huiquan Tian, Jiaxin Liang, Yongbing Li
Topics & Concepts
PyrophylliteAdsorptionDiffusionMolecular dynamicsChemistryChemical engineeringMoleculeChemical physicsMaterials scienceThermodynamicsMineralogyPhysical chemistryOrganic chemistryComputational chemistryEngineeringPhysicsCO2 Sequestration and Geologic InteractionsHydrocarbon exploration and reservoir analysisPhase Equilibria and Thermodynamics