نتایج جستجو برای: c20 fullerene

تعداد نتایج: 6119  

2012
Guang HU Wen-Yuan QIU

In this paper, we introduce two combinatorial operations and a knot-theoretical approach for generation and description of fullerene architectures. The ‘Spherical rotating–vertex bifurcation’ operation applied to original fullerene polyhedra can lead to leapfrog fullerenes. However, the ‘Spherical stretching–vertex bifurcation’ operation applied to fullerene generates a family of related polyhe...

2015
Xiaofeng Lu Jibin Sun Shangxi Zhang Longfei Ma Lei Liu Hui Qi Yongliang Shao Xiangfeng Shao

A series of donor-acceptor type co-crystals of fullerene (as the acceptor) and arylthio-substituted tetrathiafulvalene derivatives (Ar-S-TTF, as the donor) were prepared and their structural features were thoroughly investigated. The formation of co-crystals relies on the flexibility of Ar-S-TTF and the size matches between Ar-S-TTF and fullerene. Regarding their compositions, the studied co-cr...

Journal: :The Journal of chemical physics 2005
Wei An Yi Gao Satya Bulusu X C Zeng

High-level ab initio calculations have been carried out to reexamine relative stability of bowl, cage, and ring isomers of C(20) and C(20)(-). The total electronic energies of the three isomers show different energy orderings, strongly depending on the hybrid functionals selected. It is found that among three popular hybrid density-functional (DF) methods B3LYP, B3PW91, PBE1PBE, and a new hybri...

2009
Yue Chan

In this paper, we examine the possibility of utilizing non-concentric nested fullerenes C60@CN , where N = 240, 540, 960 and 1500 as nano-oscillators for future nanoelectromechanical applications, such as vibration sensing and energy harvesting devices. We assume that the interactions between a fullerene C60 and a larger fullerene CN are dominated by the van der Waals forces which can be modele...

2012
Uwe Hahn Jean-François Nierengarten

Abstract: The sphere-shaped fullerene has attracted considerable interest not least due to the peculiar electronic properties of this carbon allotrope and the fascinating materials emanating from fullerene-derived structures. The rapid development and tremendous advances in organic chemistry allow nowadays the modification of C60 to a great extent by pure chemical means. It is therefore not sur...

2015
Yu Zhong M. Tuan Trinh Rongsheng Chen Geoffrey E. Purdum Petr P. Khlyabich Melda Sezen Seokjoon Oh Haiming Zhu Brandon Fowler Boyuan Zhang Wei Wang Chang-Yong Nam Matthew Y. Sfeir Charles T. Black Michael L. Steigerwald Yueh-Lin Loo Fay Ng X.-Y. Zhu Colin Nuckolls

Despite numerous organic semiconducting materials synthesized for organic photovoltaics in the past decade, fullerenes are widely used as electron acceptors in highly efficient bulk-heterojunction solar cells. None of the non-fullerene bulk heterojunction solar cells have achieved efficiencies as high as fullerene-based solar cells. Design principles for fullerene-free acceptors remain unclear ...

Journal: :International journal of clinical and experimental medicine 2015
Pengjun Zhang Xinyu Wen Feng Gu Xinsheng Zhang Juan Li Yulan Liu Jin Dong Xinxin Deng Xu Zhu Yaping Tian

We aimed to investigate the role of serum levels of polyunsaturated fatty acid (PUFA) in the development of colorectal cancer (CRC). Serum levels of n-3 and n-6 PUFA in 69 healthy control (Ctrl), 62 benign colorectal polys (CRP) and 100 CRC patients were detected by gas chromatograph. The adjusted odds ratio (OR) by quartiles of n-3 and n-6 PUFA were analyzed. During the process of Ctrl to CRP,...

Journal: :Chemical communications 2015
Bolong Zhang Jegadesan Subbiah Yu-Ying Lai Jonathan M White David J Jones Wallace W H Wong

A single isomer of fullerene bisadduct, PC61PF, was obtained from commercially available fullerene derivative, PC61BM, in one pot over two steps. The tether-directed remote functionalization approach provided a very simple and fast method to produce a single isomer of fullerene bisadduct with good yield and easy purification. Bulk heterojunction organic solar cells containing the bisadduct was ...

Journal: :iranian j. of fisheries science 2015
y. b che man f ehteshami c. p tan a christianus s shabanikakroodi

in this study,oil was extracted from the liver and visceral fat of patin (pangasianodon hypophthalmus) and refined. the yield of oil after refining was 49.98%. the major yield loss (34.20%) happened during the degumming procedure. fatty acids found in the crude and refined oil were c12:0, c14:0, c14:1, c16:0, c16:1, c18:0, c18:1, c18:2, c18:3, c18:4, c20:0, c20:1, c20:4, c20:5, and c22:6. the d...

Journal: :journal of physical & theoretical chemistry 2012
f. r. nikmaram jamshid najafpour

the b3lyp/6-31++g** density functional calculations were used to obtain minimum geometries and interaction energies between the molecular hydrogen and nanostructures of fullerenes, c20 (cage), c20 (bowl), c19si (bowl, penta), c19si (bowl, hexa). the h2 molecule is set as adsorbed in the distance of 3å at vertical position from surface above the pentagonal and hexagonal sites of nanostructures. ...

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