Thermal disintegration of carbon fullerenes
نویسندگان
چکیده
منابع مشابه
Thermal contraction of carbon fullerenes and nanotubes.
We perform molecular dynamics simulations to study shape changes of carbon fullerenes and nanotubes with increasing temperature. At moderate temperatures, these systems gain structural and vibrational entropy by exploring the configurational space at little energy cost. We find that the soft phonon modes, which couple most strongly to the shape, maintain the surface area of these hollow nanostr...
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We report on the fundamental electrochemical properties of inherently hydrophobic Multiwalled Carbon Nanotubes MWNT electrodes and acid treated MWNTs. The electrochemical response of the electrodes was investigated by cyclic voltammetry and ac impedance spectroscopy using the redox probe of (Fe(CN)6 /Fe(CN)6 , which has well-known kinetic behaviour on carbon surfaces. Comparisons were made betw...
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A multi-scale investigation of nanostructured carbon films has been performed by means of inelastic light scattering (Raman and Brillouin scattering). Carbon films with different nanoand mesostructure have been deposited from supersonic cluster beams in a low energy deposition regime by exploiting aerodynamic focusing effects. Acoustic phonon propagation in the porous amorphous structure, where...
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A fullerene is any molecule composed entirely of carbon, in the form of a hollow sphere, ellipsoid, or tube. Spherical fullerenes are also called buckyballs, and they resemble the balls used in Association Football. Cylindrical ones are called carbon nanotubes or buckytubes. Fullerenes are similar in structure to graphite, which is composed of stacked graphene sheets of linked hexagonal rings; ...
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In this contribution, we report on a study of the growth of fullerens and carbon nanotubes from small clusters. A key factor in molecular dynamics modeling is the choice of interatomic potential. Ab initio molecular dynamics requires extensive computer resources, so that is outside the scope of most complex systems. We have developed simpler molecular dynamics model of charges at bonds which ta...
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ژورنال
عنوان ژورنال: Physical Review B
سال: 1993
ISSN: 0163-1829,1095-3795
DOI: 10.1103/physrevb.48.11381