fullerene

From 0D to 1D

Carbon nanotubes are often demonstrated as rolled-up graphene. However one can get to the concept of carbon nanotubes starting out of fullerenes too. The animation below shows that taking longer and longer fullerenes can result — at least theoretically — in a capped (5,5) armchair nanotube.

Fullerene-cubane co-crystals

The solid C60 crystallizes in the fcc structure. In this respect, the fullerene molecules behave more or less like perfect spheres. In fact, at room temperature the buckyballs are not at rest: they rotate continuously and randomly. The fcc structure is well known from metallurgy: this is the most densely packed structure. However, there is a major structural difference between ordinary metals and the solid fullerene: with the C60 as a building block, there is plenty of empty space between the balls, even if the packing is as close as possible.

Tags: 

Dimers & oligomers of fullerenes

The discovery of materials where covalently bound C60 molecules exist has attracted great interest both theoretically and experimentally around 1995. Jenő Kürti and Károly Németh performed calculations on negatively charged C60 dimers and reported the optimized geometry and energetics of such materials for the first time. Meanwhile a group of experimentalists lead by László Forró have drawn similar conclusion by analizing the X-ray diffraction spectra of quenched A1C60 -- the structure of such dimers shows S_C2h symmetry in agreement with Kürti's theoretical prediction.

Tags: 

Fullerene

Fullerenes are cage-like, extremely stable formations of carbon. The most well known member of this molecule family is the C60 molecule. Our results on fullerenes can be organized into three groups of interest: Dimers & oligomers of fullerenes, Fullerene-cubane co-crystals, Peapods & DWCNTs.

Tags: