Experimental measurement and prediction of ionic liquid ionisation energies
Jake M. Seymour, Ekaterina Gousseva, Alexander I. Large, Coby J. Clarke, Peter Licence, Richard M. Fogarty, David A. Duncan, Pilar Ferrer, Federica Venturini, Roger A. Bennett, Robert G. Palgrave, Kevin R. J. Lovelock
Abstract
Non-resonant and resonant photoelectron spectroscopy was used to measure electronic structure descriptors for 60 ionic liquids, allowing the development of design rules to predict the electronic structure descriptors for a further 516 ionic liquids.
Topics & Concepts
Ionic liquidX-ray photoelectron spectroscopyMeasure (data warehouse)Ionic bondingElectronic structureChemical physicsIonizationSpectroscopyMaterials scienceChemistryComputational chemistryAnalytical Chemistry (journal)Atomic physicsNuclear magnetic resonanceIonPhysicsComputer scienceData miningOrganic chemistryCatalysisQuantum mechanicsIonic liquids properties and applicationsElectrochemical Analysis and ApplicationsCatalysis and Oxidation Reactions