Geodesic
Capillary filling of carbon nanotubes by BiCl$_3$: TEM and MD insight
Nanosistemy: fizika, himiâ, matematika, Tome 9 (2018) no. 4, pp. 521-531

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Among numerous trichlorides, the melt of BiCl$_3$ is a distinctly molecular liquid with a relatively low melting point, yet, with a high surface tension. Therefore, the attractiveness of a simple capillary filling technique for fabrication of nanosized BiCl$_3$ by dispersion within a nanocapillary needs a special investigation. Here, we report the successful synthesis and the transmission electron microscopy characterization of the hybrids consisting of multi-walled carbon nanotubes and endohedral BiCl$_3$ crystallites. The main peculiarities of imbibition into carbon nanotubes and an intricate internal organization of molten BiCl$_3$ are established using the developed 4-site force-field model of BiCl$_3$ and consequent molecular dynamics simulations at nanosecond time scale.
Keywords: Bismuth trichloride, capillary, TEM characterization
Mots-clés : carbon nanotubes, MD simulations. 
@article{NANO_2018_9_4_a11,
     author = {E. A. Anumol and F. L. Deepak and A. N. Enyashin},
     title = {Capillary filling of carbon nanotubes by {BiCl}$_3$: {TEM} and {MD} insight},
     journal = {Nanosistemy: fizika, himi\^a, matematika},
     pages = {521--531},
     publisher = {mathdoc},
     volume = {9},
     number = {4},
     year = {2018},
     language = {en},
     url = {http://geodesic.mathdoc.fr/item/NANO_2018_9_4_a11/}
}
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E. A. Anumol; F. L. Deepak; A. N. Enyashin. Capillary filling of carbon nanotubes by BiCl$_3$: TEM and MD insight. Nanosistemy: fizika, himiâ, matematika, Tome 9 (2018) no. 4, pp. 521-531. http://geodesic.mathdoc.fr/item/NANO_2018_9_4_a11/