Novel sp³ forms of carbon predicted by evolutionary metadynamics and analysis of their synthesizability using transition path sampling

Experiments on cold compression of graphite have indicated the existence of a new superhard and transparent allotrope of carbon. Numerous metastable candidate structures featuring different topologies have been proposed for “superhard graphite”, showing a good agreement with experimental X-ray data....

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Bibliographic Details
Published in:Сверхтвердые материалы
Date:2012
Main Authors: Boulfelfel, S.E., Zhu, Q., Oganov, A.R.
Format: Article
Language:English
Published: Інститут надтвердих матеріалів ім. В.М. Бакуля НАН України 2012
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Online Access:https://nasplib.isofts.kiev.ua/handle/123456789/126007
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Journal Title:Digital Library of Periodicals of National Academy of Sciences of Ukraine
Cite this:Novel sp³ forms of carbon predicted by evolutionary metadynamics and analysis of their synthesizability using transition path sampling / S.E. Boulfelfel, Q. Zhu, A.R. Oganov // Сверхтвердые материалы. — 2012. — № 6. — С. 12-24. — Бібліогр.: 46 назв. — англ.

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Digital Library of Periodicals of National Academy of Sciences of Ukraine