corner
corner

Phys. Rev. B 64, 212103 (2001) [3 pages]

Ideal strength of diamond, Si, and Ge

Download: PDF (38 kB) Buy this article Export: BibTeX or EndNote (RIS)

David Roundy and Marvin L. Cohen
Department of Physics, University of California at Berkeley, Berkeley, California 94720
Materials Sciences Division, Lawrence Berkeley National Laboratory, Berkeley, California 94720

Received 3 July 2001; published 12 November 2001

We have calculated the ideal shear strength and ideal tensile strength of C, Si, and Ge in the diamond structure. We find ideal shear strengths of 95 GPa, 6.5 GPa, and 4.5 GPa, and ideal tensile strengths of 95 GPa, 23 GPa, and 14 GPa for C, Si and Ge respectively. The shear calculation is performed on the {111} slip plane sheared in a 112 direction, and the tensile load is applied in the 111 direction. We allowed for a full relaxation of the strains orthogonal to the applied strain as well as the atomic basis vectors.

© 2001 The American Physical Society

URL:
http://link.aps.org/doi/10.1103/PhysRevB.64.212103
DOI:
10.1103/PhysRevB.64.212103
PACS:
62.20.Fe, 62.20.Dc