Electron impact electronic excitation of benzene: Theory and experiment.


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 Nov 2023
Historique:
received: 19 08 2023
accepted: 03 10 2023
medline: 15 11 2023
pubmed: 15 11 2023
entrez: 15 11 2023
Statut: ppublish

Résumé

We report experimental differential cross sections (DCSs) for electron impact excitation of bands I to V of benzene at incident energies of 10, 12.5, 15, and 20 eV. They are compared to calculations using the Schwinger multichannel method while accounting for up to 437 open channels. For intermediate scattering angles, the calculations reveal that the most intense band (V) emerges from surprisingly similar contributions from all its underlying states (despite some preference for the dipole-allowed transitions). They further shed light on intricate multichannel couplings between the states of bands I to V and higher-lying Rydberg states. In turn, the measurements support a vibronic coupling mechanism for excitation of bands II and IV and also show an unexpected forward peak in the spin-forbidden transition accounting for band III. Overall, there is decent agreement between theory and experiment at intermediate angles and at lower energies and in terms of the relative DCSs of the five bands. Discrepancies between the present and previous experiment regarding bands IV and V draw attention to the need of additional experimental investigations. We also report measured DCSs for vibrational excitation of combined C-H stretching modes.

Identifiants

pubmed: 37966005
pii: 2921431
doi: 10.1063/5.0173024
pii:
doi:

Types de publication

Journal Article

Langues

eng

Sous-ensembles de citation

IM

Informations de copyright

© 2023 Author(s). Published under an exclusive license by AIP Publishing.

Auteurs

Alan G Falkowski (AG)

Instituto de Física "Gleb Wataghin," Universidade Estadual de Campinas, Campinas, Brazil.

Romarly F da Costa (RF)

Centro de Ciências Naturais e Humanas, Universidade Federal do ABC, 09210-580 Santo André, São Paulo, Brazil.

Marco A P Lima (MAP)

Instituto de Física "Gleb Wataghin," Universidade Estadual de Campinas, Campinas, Brazil.

Alexi de A Cadena (A)

Physics Department, California State University, Fullerton, California 92831, USA.

Ronald Pocoroba (R)

Physics Department, California State University, Fullerton, California 92831, USA.

Regan Jones (R)

Physics Department, California State University, Fullerton, California 92831, USA.

Mahak Mathur (M)

Troy High School, 2200 Dorothy Lane, Fullerton, California 92831, USA.

J G Childers (JG)

Physics Department, California State University, Fullerton, California 92831, USA.

Murtadha A Khakoo (MA)

Physics Department, California State University, Fullerton, California 92831, USA.

Fábris Kossoski (F)

Laboratoire de Chimie et Physique Quantiques (UMR 5626), Université de Toulouse, CNRS, UPS, 31062 Toulouse, France.

Classifications MeSH