Computational study of the electrostatic potential and charges of multivalent ionic liquid molecules
Xiaoyang Liu, C. Heath Turner
Topics & Concepts
Chemical physicsPolarizabilityElectrostaticsScalingMolecular dynamicsCharge (physics)MoleculeChemistryIonic liquidPartial chargeIntermolecular forceIonic potentialCluster (spacecraft)Ionic bondingAb initioIonComputational chemistryPhysical chemistryPhysicsComputer scienceBiochemistryQuantum mechanicsGeometryCatalysisProgramming languageOrganic chemistryMathematicsIonic liquids properties and applicationsElectrochemical Analysis and ApplicationsPhase Equilibria and Thermodynamics