A molecular dynamics simulation on dissolution of subcritical water in heavy oil: (I) Effect of polycyclic aromatic hydrocarbons
Dong-Hao Yuan, Xuefeng Chen, Lei Ding, Jingyi Yang, Zibin Huang, Pei‐Qing Yuan
Topics & Concepts
DissolutionSolubilitySolvationvan der Waals forceChemistryMolecular dynamicsDispersion (optics)Gibbs free energyHydrogen bondIntermolecular forcePhase (matter)Chemical physicsThermodynamicsPhysical chemistrySolventOrganic chemistryMoleculeComputational chemistryPhysicsOpticsPhase Equilibria and ThermodynamicsPetroleum Processing and AnalysisSubcritical and Supercritical Water Processes