Hole- and Electron-Vibrational Couplings in Oligoacene Crystals: Intramolecular Contributions
Top Cited Papers
- 20 December 2002
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review Letters
- Vol. 89 (27) , 275503
- https://doi.org/10.1103/physrevlett.89.275503
Abstract
The hole-vibrational coupling is reported for anthracene, tetracene, and pentacene on the basis of a joint experimental and theoretical study of ionization spectra using high-resolution gas-phase photoelectron spectroscopy and first-principles correlated quantum-mechanical calculations. The hole-vibrational coupling is found to be significantly smaller than the electron-vibrational coupling in the case of these oligomers; however, both quantities are predicted to converge to the same value when increasing the chain length.This publication has 19 references indexed in Scilit:
- Studies of polaron motion: Part II. The “small” polaronPublished by Elsevier ,2004
- Joint Experimental and Theoretical Characterization of the Electronic Structure of 4,4‘-Bis(N-m-tolyl-N-phenylamino)biphenyl (TPD) and Substituted DerivativesThe Journal of Physical Chemistry A, 2001
- Density functional theory study of the geometric structure and energetics of triphenylamine-based hole-transporting moleculesChemical Physics Letters, 2000
- Electron-phonon coupling for aromatic molecular crystals: Possible consequences for their superconductivityPhysical Review B, 1998
- Molecular polaron states in polyacene crystals. Formation and transfer processesChemical Physics, 1995
- Unified theory of the mobilities of photoinjected electrons in naphthalenePhysical Review Letters, 1989
- Intramolecular Long-Distance Electron Transfer in Organic MoleculesScience, 1988
- Hot holes in naphthalene: High, electric-field-dependent mobilitiesPhysical Review B, 1985
- The π‐Orbital Energies of the AcenesHelvetica Chimica Acta, 1972
- Photoelectron spectra of polycyclic aromatic hydrocarbonsFaraday Discussions of the Chemical Society, 1972