Molecular Dynamics of Hydration Shells of Adsorbates in Entropy-Driven Adsorption (Hydrophobic Bonding) to Activated Carbon Surfaces
Zaid Assaf, Dale Eric Wurster
Topics & Concepts
Solvation shellSolvationHydrophobic effectEnthalpyChemistryHydrogen bondAdsorptionMoleculeAqueous solutionMolecular dynamicsSolventExothermic reactionThermodynamicsChemical physicsPhysical chemistryComputational chemistryOrganic chemistryPhysicsSpectroscopy and Quantum Chemical StudiesAdvanced Thermodynamics and Statistical MechanicsAdvanced Physical and Chemical Molecular Interactions