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Article

Atomistic Modeling of Grain Boundary Fracture in Diamond

Molecular dynamics simulations using a bond-order potential were carried out to investigate the behavior under load of several <001glt; and <011glt; symmetrical tilt grain boundaries in diamond. Cohesive energ...

O. A. Shenderova, D. W. Brenner, A. Omeltchenko, X. Su… in MRS Online Proceedings Library (1998)