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Fusion reaction dynamics of fullerene molecules

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Fusion reaction dynamics of fullerene molecules

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Title: Fusion reaction dynamics of fullerene molecules
Author: Wang, Yang; Gatchell, Michael; Zettergren, Henning; Rousseau, Patrick; Chen, Tao; Stockett, Mark H.; Domaracka, Alicja; Adoui, Lamri; Huber, Bernd A.; Cederquist, Henrik; Alcamí, Manuel; Martín, Fernando
Entity: UAM. Departamento de Química
UAM Author: Alcami Pertejo, Manuel
Publisher: IOP Publishing Ltd.
Date: 2015-09-07
Citation: Journal of Physics: Conference Series 635.3 (2015): 032093
ISSN: 1742-6588 (Print); 1742-6596 (Online)
DOI: 10.1088/1742-6596/635/3/032093
Editor's Version: http://dx.doi.org/ 10.1088/1742-6596/635/3/032093
Subjects: Atoms; Charge density; Condensed matter physics; Fullerenes; Química
URI: http://hdl.handle.net/10486/672421
Rights: © Published under licence by IOP Publishing Ltd.

Licencia Creative Commons
Esta obra está bajo una Licencia Creative Commons Atribución 4.0 Internacional.

Abstract:

Systematic molecular dynamics simulations based on the self-consistent charge density functional tight-binding method have been performed for the molecular collisions inside clusters of fullerene molecules, after prompt atom knockouts by the keV ions. The thermodynamic and kinetic stabilities, as well as the bonding features, have been investigated for the most stable dumbbell dimers C+118, C+119 and C+120

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G o o g l e ™ Scholar: Wang, Yang - Gatchell, Michael - Zettergren, Henning - Rousseau, Patrick - Chen, Tao - Stockett, Mark H. - Domaracka, Alicja - Adoui, Lamri - Huber, Bernd A. - Cederquist, Henrik - Alcamí, Manuel - Martín, Fernando

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