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dc.contributor.author
Mohammadzadeh, Leila
dc.contributor.author
Quaino, Paola Monica
dc.contributor.author
Schmickler, Wolfgang
dc.date.available
2020-08-07T13:52:00Z
dc.date.issued
2016-04
dc.identifier.citation
Mohammadzadeh, Leila; Quaino, Paola Monica; Schmickler, Wolfgang; Interactions of anions and cations in carbon nanotubes; Royal Society of Chemistry; Faraday Discussions; 193; 4-2016; 415-426
dc.identifier.issn
1364-5498
dc.identifier.uri
http://hdl.handle.net/11336/111113
dc.description.abstract
We consider the insertion of alkali-halide ion pairs into a narrow (5,5) car- bon nanotube. In all cases considered, the insertion of a dimer is only slightly exothermic. While the image charge induced on the surface of the tube favors insertion, it simultaneously weakens the Coulomb attraction between the two ions. In addition, the anion experiences a sizable Pauli repulsion. For a one dimensional chain of NaCl embedded in the tube the most favor- able position for the anion is at the center, and for the cation near the wall. The phonon spectrum of such chains shows both an acoustic and an optical branch.
dc.format
application/pdf
dc.language.iso
eng
dc.publisher
Royal Society of Chemistry
dc.rights
info:eu-repo/semantics/openAccess
dc.rights.uri
https://creativecommons.org/licenses/by-nc-sa/2.5/ar/
dc.subject
CARBON NANOTUBES
dc.subject
ANIONS
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CATIONS
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CHARGE STORAGE
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Físico-Química, Ciencia de los Polímeros, Electroquímica
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Ciencias Químicas
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CIENCIAS NATURALES Y EXACTAS
dc.title
Interactions of anions and cations in carbon nanotubes
dc.type
info:eu-repo/semantics/article
dc.type
info:ar-repo/semantics/artículo
dc.type
info:eu-repo/semantics/publishedVersion
dc.date.updated
2020-08-05T16:39:01Z
dc.journal.volume
193
dc.journal.pagination
415-426
dc.journal.pais
Reino Unido
dc.journal.ciudad
Cambridge
dc.description.fil
Fil: Mohammadzadeh, Leila. Universitat Ulm. Faculty Of Natural Sciences; Alemania. Universidad Nacional del Litoral; Argentina
dc.description.fil
Fil: Quaino, Paola Monica. Universidad Nacional del Litoral; Argentina. Consejo Nacional de Investigaciones Científicas y Técnicas; Argentina
dc.description.fil
Fil: Schmickler, Wolfgang. Universitat Ulm. Faculty Of Natural Sciences; Alemania
dc.journal.title
Faraday Discussions
dc.relation.alternativeid
info:eu-repo/semantics/altIdentifier/doi/http://dx.doi.org/10.1039/C6FD00076B
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