Branicio Paulo S, Kalia Rajiv K, Nakano Aiichiro, Vashishta Priya
Collaboratory for Advanced Computing and Simulations, Department of Chemical Engineering and Materials Science, University of Southern California, Los Angeles, California 90089-0242, USA.
Phys Rev Lett. 2006 Feb 17;96(6):065502. doi: 10.1103/PhysRevLett.96.065502. Epub 2006 Feb 15.
Atomistic mechanisms of fracture accompanying structural phase transformation (SPT) in AlN ceramic under hypervelocity impact are investigated using a 209 x 10(6) atom molecular-dynamics simulation. The shock wave generated by the impact splits into an elastic wave and a slower SPT wave that transforms the wurtzite structure into the rocksalt phase. The interaction between the reflected elastic wave and the SPT wave front generates nanovoids and dislocations into the wurtzite phase. Nanovoids coalesce into mode I cracks while dislocations give rise to kink bands and mode II cracking.
