Determination of diffusion coefficient of C2H6 and CO2 in hydrocarbon solvents by molecular dynamics simulation
Morteza Moradi, Hedayat Azizpour, Milad Mohammarehnezhad-Rabieh
Topics & Concepts
HexadecaneThermodynamicsHeptaneMolecular dynamicsChemistryDiffusionArrhenius equationHydrocarbonHydrocarbon mixturesHexaneDodecaneSolventMethylcyclohexanePhysical chemistryActivation energyComputational chemistryOrganic chemistryToluenePhysicsPhase Equilibria and ThermodynamicsAdsorption, diffusion, and thermodynamic properties of materialsThermodynamic properties of mixtures