The ionic states of cyclooctatetraene: Analysis of a new experimental photoelectron spectrum by ab initio and density functional methods.


Journal

The Journal of chemical physics
ISSN: 1089-7690
Titre abrégé: J Chem Phys
Pays: United States
ID NLM: 0375360

Informations de publication

Date de publication:
21 May 2019
Historique:
entrez: 24 5 2019
pubmed: 24 5 2019
medline: 24 5 2019
Statut: ppublish

Résumé

A synchrotron-based study of the photoelectron spectrum (PES) for cyclooctatetraene (COT) is reported, and this has been subjected to theoretical analysis in unprecedented detail. Weak vibrational structure was observed on the lowest ionization energy (IE

Identifiants

pubmed: 31117784
doi: 10.1063/1.5096254
doi:

Types de publication

Journal Article

Langues

eng

Pagination

194305

Auteurs

Michael H Palmer (MH)

School of Chemistry, University of Edinburgh, Joseph Black Building, David Brewster Road, Edinburgh, EH9 3FJ Scotland, United Kingdom.

Marcello Coreno (M)

ISM-CNR, Istituto di Struttura della Materia, LD2 Unit, 34149 Trieste, Italy.

Monica de Simone (M)

IOM-CNR Laboratorio TASC, Trieste, Italy.

Cesare Grazioli (C)

IOM-CNR Laboratorio TASC, Trieste, Italy.

Søren Vrønning Hoffmann (SV)

ISA, Department of Physics and Astronomy, Aarhus University, Ny Munkegade 120, DK-8000 Aarhus C, Denmark.

Nykola C Jones (NC)

ISA, Department of Physics and Astronomy, Aarhus University, Ny Munkegade 120, DK-8000 Aarhus C, Denmark.

Classifications MeSH