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Phys. Rev. Lett. 92, 215505 (2004) [4 pages]

Exceptional Ideal Strength of Carbon Clathrates

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X. Blase1,*, Philippe Gillet2, A. San Miguel1, and P. Mélinon1
1Laboratoire de Physique de la Matière Condensée et des Nanostructures, Université Claude Bernard Lyon I and CNRS, 43 Bd du 11 Novembre 1918, 69622 Villeurbanne Cedex, France
2Laboratoire des Sciences de la Terre, Ecole Normale Supérieure de Lyon, 69364 Lyon, France

See Also: Erratum

Received 4 December 2003; published 28 May 2004

We study by means of ab initio calculations the ideal tensile and shear strengths of the C-46 clathrate phase. While its bulk modulus and elastic constants are smaller than in diamond, its strength is found to be in all directions larger than the critical stresses associated with the diamond {111} planes of easy slip. This can be related to the frustration by the clathrate cage structure of the diamond to graphite instability under hydrostatic stress conditions. The criteria for designing strong materials are discussed.

© 2004 The American Physical Society

URL:
http://link.aps.org/doi/10.1103/PhysRevLett.92.215505
DOI:
10.1103/PhysRevLett.92.215505
PACS:
61.48.+c, 62.20.–x, 71.15.Mb, 81.05.Tp

*Corresponding author.

Electronic address: xblase@lpmcn.univ-lyon1.fr

See Also

Erratum: X. Blase, Philippe Gillet, A. San Miguel, and P. Mélinon, Erratum: Exceptional Ideal Strength of Carbon Clathrates [Phys. Rev. Lett. 92, 215505 (2004)], Phys. Rev. Lett. 93, 239901 (2004).