نتایج جستجو برای: fullerene graph

تعداد نتایج: 202582  

Journal: :Nature chemistry 2010
Andrey Chuvilin Ute Kaiser Elena Bichoutskaia Nicholas A Besley Andrei N Khlobystov

Although fullerenes can be efficiently generated from graphite in high yield, the route to the formation of these symmetrical and aesthetically pleasing carbon cages from a flat graphene sheet remains a mystery. The most widely accepted mechanisms postulate that the graphene structure dissociates to very small clusters of carbon atoms such as C(2), which subsequently coalesce to form fullerene ...

Journal: :Nanoscale 2014
Luogang Xie Yin Luo Dongdong Lin Wenhui Xi Xinju Yang Guanghong Wei

Amyloid deposits are implicated in the pathogenesis of many neurodegenerative diseases such as Alzheimer's disease (AD). The inhibition of β-sheet formation has been considered as the primary therapeutic strategy for AD. Increasing data show that nanoparticles can retard or promote the fibrillation of amyloid-β (Aβ) peptides depending on the physicochemical properties of nanoparticles, however,...

Journal: :iranian journal of mathematical chemistry 2011
a. graovac o. ori m. faghani a. r. ashrafi

fullerenes are closed−cage carbon molecules formed by 12 pentagonal and n/2 – 10hexagonal faces, where n is the number of carbon atoms. patrick fowler in his lecture inmcc 2009 asked about the wiener index of fullerenes in general. in this paper werespond partially to this question for an infinite class of fullerenes with exactly 10ncarbon atoms. our method is general and can be applied to full...

Journal: :Chemistry 2011
Thomas W Chamberlain Neil R Champness Martin Schröder Andrei N Khlobystov

We have developed a method that enables the efficient insertion of transition-metal atoms and their small clusters into carbon nanotubes. As a model system, Os complexes attached to the exterior of fullerene C60 (exohedral metallofullerenes) were shown to be dragged into the nanotube spontaneously and irreversibly due to strong van der Waals interactions, specific to fullerenes and carbon nanot...

2001
R. O. Loutfy

The results of recent investigation of fullerene–fullerene hydride system as a potential high capacity hydrogen storage option are presented. Theoretically, C60 fullerenes can reversibly store up to 7.7 wt.% hydrogen by forming fullerene hydride C60Hx. However, high temperature and pressure are currently required to enable hydrogen exchange in this system. For example, direct hydrogenation of f...

Journal: :Physical chemistry chemical physics : PCCP 2011
Pirmin A Ulmann Hideyuki Tanaka Yutaka Matsuo Zuo Xiao Iwao Soga Eiichi Nakamura

A [70]fullerene-benzodifuranone acceptor dyad synthesized by a Ag⁺-mediated coupling reaction was used to construct a thin-film organic solar cell. The fullerene and the benzodifuranone dye in the dyad have close-lying LUMO levels in the range of 3.7-3.9 eV, so that energy transfer from the dye to the fullerene can take place. A p-n heterojunction photovoltaic device consisting of a tetrabenzop...

2003
Shigeo Maruyama Yuhei Miyauchi Tadao Edamura Yasuhiro Igarashi Shohei Chiashi Yoichi Murakami

Received 15 April 2003; in final form 25 April 2003 Abstract Single-walled carbon nanotubes with narrow diameter-distributions were synthesized by the catalytic CVD technique using fullerene, C60 or C70, as the carbon source. Fe/Co bimetal particles supported with zeolite powder were exposed to fullerene vapor in a heated quartz tube furnace. With a precise control of fullerene vapor pressure, ...

2015
Huilong Dong Tingjun Hou Shuit-Tong Lee Youyong Li

The newly found B40 is the first experimentally observed all-boron fullerene and has potential applications in hydrogen storage. Here we investigate the binding ability and hydrogen storage capacity of Ti-decorated B40 fullerene based on DFT calculations. Our results indicate that Ti shows excellent binding capability to B40 compared with other transition metals. The B40 fullerene coated by 6 T...

Journal: :Physical chemistry chemical physics : PCCP 2007
M Carravetta A Danquigny S Mamone F Cuda O G Johannessen I Heinmaa K Panesar R Stern M C Grossel A J Horsewill A Samoson M Murata Y Murata K Komatsu M H Levitt

We present an overview of solid-state NMR studies of endohedral H(2)-fullerene complexes, including (1)H and (13)C NMR spectra, (1)H and (13)C spin relaxation studies, and the results of (1)H dipole-dipole recoupling experiments. The available data involves three different endohedral H(2)-fullerene complexes, studied over a wide range of temperatures and applied magnetic fields. The symmetry of...

1998
Yasutaka Yamaguchi Shigeo Maruyama

By using the molecular dynamics method, a clustering process of randomly distributed carbon atoms was simulated. A C60 imperfect fullerene obtained in the simulation was kept at 2500 K in order to evaluate the effect of the collision-free annealing process which was almost ignored in the clustering simulation. Through successive pentagon-migration transformations, the perfect fullerene structur...

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