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Fragmentation channels of non-fullerene cationic carbon clusters.
Ferrari, Piero; Hansen, Klavs; Lacinbala, Ozan; Janssens, Ewald; Lievens, Peter.
Afiliação
  • Ferrari P; Quantum Solid-State Physics, Department of Physics and Astronomy, KU Leuven, 3001 Leuven, Belgium.
  • Hansen K; Center for Joint Quantum Studies and Department of Physics, School of Science, Tianjin University, 92 Weijin Road, Tianjin 300072, China. klavshansen@tju.edu.cn.
  • Lacinbala O; Lanzhou Center for Theoretical Physics, Key Laboratory of Theoretical Physics of Gansu Province, Lanzhou University, Lanzhou, Gansu 730000, China.
  • Janssens E; Quantum Solid-State Physics, Department of Physics and Astronomy, KU Leuven, 3001 Leuven, Belgium.
  • Lievens P; Quantum Solid-State Physics, Department of Physics and Astronomy, KU Leuven, 3001 Leuven, Belgium.
Phys Chem Chem Phys ; 25(45): 31118-31124, 2023 Nov 22.
Article em En | MEDLINE | ID: mdl-37947317
ABSTRACT
The unimolecular fragmentation channels of highly excited small cationic carbon clusters have been measured with a time-of-flight mass spectrometer after photofragmentation. The dominant channel is loss of the neutral trimer, for all CN+N = 10-27 clusters except for N = 11, 12 which decay by monomer emission, and C25+ which shows competing loss of C2 and C3. The results permit to quantify the role of the rotational entropy in the competition between monomer and trimer decays with the help of energies calculated with density functional theory.

Texto completo: 1 Base de dados: MEDLINE Idioma: En Ano de publicação: 2023 Tipo de documento: Article

Texto completo: 1 Base de dados: MEDLINE Idioma: En Ano de publicação: 2023 Tipo de documento: Article