Reference Energies for Valence Ionizations and Satellite Transitions
Antoine Marie, Pierre‐François Loos
Abstract
-matrix) for IPs are also analyzed. Their limitations in correctly modeling satellite transitions are discussed.
Topics & Concepts
IonizationExcited stateValence (chemistry)Atomic physicsConfiguration interactionCoupled clusterSpectral linePhysicsExcitationIonization energyValence electronChemistryElectronMoleculeIonQuantum mechanicsAdvanced Chemical Physics StudiesMass Spectrometry Techniques and ApplicationsPhotochemistry and Electron Transfer Studies