Capturing Correlation Effects on Photoionization Dynamics
Torsha Moitra, Sonia Coriani, Piero Decleva
Abstract
molecule, where giant correlation effects completely destroy the Koopmans picture.
Topics & Concepts
PhotoionizationTime-dependent density functional theoryAsymmetryDensity functional theoryAtomic orbitalPhysicsObservableMolecular orbitalCorrelationMolecular dynamicsIonizationCoulombMolecular physicsAtomic physicsStatistical physicsMoleculeQuantum mechanicsElectronMathematicsIonGeometryAdvanced Chemical Physics StudiesSpectroscopy and Quantum Chemical StudiesPhotochemistry and Electron Transfer Studies