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- W4239309917 abstract "This chapter contains sections titled: Introduction Photoelectron (PE) Spectroscopy PE Spectrum and Ionization Energies PE Spectra of Dienes and Polyenes Interpretation of PE Spectra Planar Conjugated Polyenes Introductory Remarks Linear Combination of Two-centre π-orbitals The Standard Hückel Treatment Alkyl-substituted Planar Dienes and Polyenes Special Cases Deviations from Planarity Cumulenes π-systems Exhibiting Second-order Bond Fixation Some Cautionary Remarks Interaction between Non-conjugated π-orbitals A Naive, Independent Electron Model A More Detailed Analysis of through-space and through-bond Interactions Some Special Cases of Interaction between Non-conjugated π-orbitals The Interplay of through-bond and through-space Interactions in Norbornadiene Homologues Brief Comment on Symmetry Assignments Using a Correlation Technique Homoconjugation Spiroconjugation Excited States of Polyene Radical Cations by Other Methods Introduction Experimental Methods Gas-phase Experiments Photodissociation Spectroscopy Ion Emission Spectroscopy Condensed-phase Experiments Solution Studies Frozen Glasses Matrix Isolation Experiments Theoretical Methods Koopmans and Non-Koopmans States Limitations and Extension of Single-determinant Models Semiempirical CI Methods Many-body Perturbation Methods Linear Conjugated Polyenes The Minimal CI Model Long Polyenes: Towards the Polaron Geometry Dependence of Excited-state Energies Conformational Isomerism in Linear Conjugated Polyene Radical Cations Alkylated and Cyclic Conjugated Dienes and Trienes Cross-conjugated Polyenes Interaction between Non-conjugated π-orbitals Acknowledgements References" @default.
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- W4239309917 date "1997-03-15" @default.
- W4239309917 modified "2023-09-25" @default.
- W4239309917 title "Electronic Structure of Diene and Polyene Radical Cations" @default.
- W4239309917 doi "https://doi.org/10.1002/0470857218.ch6" @default.
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