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