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Volume 13, Issue 5
Morphological Similarities Between Single-Walled Nanotubes and Tubelike Structures of Polymers with Strong Adsorption Affinity to Nanowires

Thomas Vogel, Tali Mutat, Joan Adler & Michael Bachmann

DOI: 10.4208/cicp.131211.230412a

Commun. Comput. Phys., 13 (2013), pp. 1245-1264.

Published online: 2013-05

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  • Abstract

In their tubelike phase, nanowire-adsorbed polymers exhibit strong structural similarities to morphologies known from single-walled carbon (hexagonal) and boron (triangular) nanotubes. Since boron/boron nitride tubes require some disorder for stability the triangular polymer tubes provide a closer analog to the carbon tubes. By means of computer simulations of both two and three dimensional versions of a coarse-grained bead-spring model for the polymers, we investigate their structural properties and make a detailed comparison with structures of carbon nanotubes.


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@Article{CiCP-13-1245, author = {Thomas Vogel, Tali Mutat, Joan Adler and Michael Bachmann}, title = {Morphological Similarities Between Single-Walled Nanotubes and Tubelike Structures of Polymers with Strong Adsorption Affinity to Nanowires}, journal = {Communications in Computational Physics}, year = {2013}, volume = {13}, number = {5}, pages = {1245--1264}, abstract = {

In their tubelike phase, nanowire-adsorbed polymers exhibit strong structural similarities to morphologies known from single-walled carbon (hexagonal) and boron (triangular) nanotubes. Since boron/boron nitride tubes require some disorder for stability the triangular polymer tubes provide a closer analog to the carbon tubes. By means of computer simulations of both two and three dimensional versions of a coarse-grained bead-spring model for the polymers, we investigate their structural properties and make a detailed comparison with structures of carbon nanotubes.


}, issn = {1991-7120}, doi = {https://doi.org/10.4208/cicp.131211.230412a}, url = {http://global-sci.org/intro/article_detail/cicp/7273.html} }
TY - JOUR T1 - Morphological Similarities Between Single-Walled Nanotubes and Tubelike Structures of Polymers with Strong Adsorption Affinity to Nanowires AU - Thomas Vogel, Tali Mutat, Joan Adler & Michael Bachmann JO - Communications in Computational Physics VL - 5 SP - 1245 EP - 1264 PY - 2013 DA - 2013/05 SN - 13 DO - http://doi.org/10.4208/cicp.131211.230412a UR - https://global-sci.org/intro/article_detail/cicp/7273.html KW - AB -

In their tubelike phase, nanowire-adsorbed polymers exhibit strong structural similarities to morphologies known from single-walled carbon (hexagonal) and boron (triangular) nanotubes. Since boron/boron nitride tubes require some disorder for stability the triangular polymer tubes provide a closer analog to the carbon tubes. By means of computer simulations of both two and three dimensional versions of a coarse-grained bead-spring model for the polymers, we investigate their structural properties and make a detailed comparison with structures of carbon nanotubes.


Thomas Vogel, Tali Mutat, Joan Adler and Michael Bachmann. (2013). Morphological Similarities Between Single-Walled Nanotubes and Tubelike Structures of Polymers with Strong Adsorption Affinity to Nanowires. Communications in Computational Physics. 13 (5). 1245-1264. doi:10.4208/cicp.131211.230412a
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