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Cracking a Tough Nut* with a big Computer

Published online by Cambridge University Press:  10 February 2011

Farid F. Abraham
Affiliation:
IBM Research Division, Almaden Research Center, 650 Harry Road, San Jose, CA 95120–6099, farid@almaden.ibm.com
M. Rosenkrantzt
Affiliation:
Cornell Theory Center, Cornell University, Ithaca NY, 14853–3801
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Abstract

We have simulated the dynamical failure of three-dimensional notched solids under tension using molecular dynamics and up to 100 million atoms. We discovered a dynamical brittle-to-ductile transition in the rapid cleavage of rare-gas solids when the crack velocity approaches one-third of the Rayleigh sound speed. At this transition, the crack tip has already begun to roughen on the atomic scale. This suggests that the brittle crack undergoes a dynamic instability which immediately leads to the initiation of plastic failure by the spontaneous emission and proliferation of dislocations and crack arrest.

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