Molecular modelling of ionic liquids: Physical properties of species with extremely long aliphatic chains from a near-optimal regime
Zhaoxi Sun, Abhijit Kayal, Zhihao Gong, Lei Zheng, Qiaole He
Topics & Concepts
Ionic liquidSolvationIonic bondingChemistryChemical physicsThermodynamicsIonForce field (fiction)ScalingImplicit solvationComputational chemistryStatistical physicsPhysicsOrganic chemistryMathematicsCatalysisQuantum mechanicsGeometryIonic liquids properties and applicationsPhase Equilibria and ThermodynamicsChemical and Physical Properties in Aqueous Solutions