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Topology and Electronic Structure of Onion-Like Carbon and Graphite/Diamond Nanocomposites

Title: Topology and Electronic Structure of Onion-Like Carbon and Graphite/Diamond Nanocomposites
Authors: Bulusheva, Lyubov G.; Okotrub, Alexander V.; Kuznetsov, Vladimir L.; Chuvilin, Andrew L.; Butenko, Yuriy V.; Heggie, Malcolm I.
Source: MRS Proceedings ; volume 703 ; ISSN 0272-9172 1946-4274
Publisher Information: Springer Science and Business Media LLC
Publication Year: 2001
Description: Annealing of nanodiamond at moderate temperature makes it possible to produce structures being intermediate in the carbon transformation from sp 3 - to sp 2 -state (graphite/diamond nanocomposites) and onion-like carbon (OLC). Electron microscopy shows such structures involve cage shells with spacing close to graphite. X-ray emission spectroscopy has been applied to examine the electronic structure of OLC and graphite/diamond nanocomposites. The CKα-spectra of OLC produced in the temperature range of 1600-1900 K were found to be markedly different from the spectrum of particles formed at 2140 K and characterized by better ordering of graphitic shells. The latter spectrum was shown to be very similar to the CKα-spectrum of polycrystalline graphite, while the former ones exhibited a significant increase of high-energy maximum that might be caused by the holed defect structure of graphitic networks forming at the intermediate annealing temperatures. To interpret experimental spectra, the quantum-chemical semiempirical AM1 calculation of icosahedral C 540 cage and that with holed defects was carried out. The lack of at least 22% atoms in an internal carbon cage was found to be essential to provide an increase of density of high-energy electronic states similar to that observed in the spectrum of OLC produced at 1900 K.
Document Type: article in journal/newspaper
Language: English
DOI: 10.1557/proc-703-v9.22
Availability: http://dx.doi.org/10.1557/proc-703-v9.22; https://www.cambridge.org/core/services/aop-cambridge-core/content/view/S1946427400593312
Rights: https://www.cambridge.org/core/terms
Accession Number: edsbas.571F18D8
Database: BASE