2026-04-27T08:50:12Zhttps://riubu.ubu.es/oai/requestoai:riubu.ubu.es:10259/55412024-07-24T11:47:30Zcom_10259_9476com_10259.4_106com_10259_2604col_10259_9477
Repositorio Institucional de la Universidad de Burgos
author
Gutiérrez Vega, Alberto
author
Garroni, Sebastiano
author
Souentie, Stamatios
author
Cuesta López, Santiago
author
Yakoumis, Iakovos
author
Aparicio Martínez, Santiago
2020-11-04T12:55:55Z
2020-11-04T12:55:55Z
2019-04
1932-7447
http://hdl.handle.net/10259/5541
10.1021/acs.jpcc.9b00855
1932-7455
The properties of single-walled carbon nanotubes and carbon fullerenes in molten alkali carbonates (MACs) were studied as a function of the considered nanomaterial and the ions into the molten salt using classical molecular dynamics simulations. The adsorption and confinement in carbon nanotubes is developed by efficient interaction of carbonate ions in the inner and outer walls of the nanotubes whereas alkali cations do not show a remarkable interaction with the nanomaterial. Analogous solvation mechanisms are inferred for carbon fullerenes with large disruption of the liquid structuring of MAC at high fullerene concentrations. The solvation ability of the studied lithium–sodium–potassium carbonate eutectic mixture for both types of nanomaterials is essential for considering this fluid in the development of composite materials for advanced technological applications.
eng
Layers
Solvation
Ions
Carbon nanotubes
Cations
Insights into carbon nanotubes and fullerenes in molten alkali carbonates
info:eu-repo/semantics/article
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URL
https://riubu.ubu.es/bitstream/10259/5541/1/Gutierrez-jpcc_2019.pdf
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https://riubu.ubu.es/bitstream/10259/5541/4/Gutierrez-jpcc_2019.pdf.txt
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Gutierrez-jpcc_2019.pdf.txt