ABSTRACT
Boron nitride nanotubes (BNNTs) are a unique class of light and strong tubular nanostructure and are highly promising as reinforcing additives in ceramic materials. However, the mechanical strength of BNNT-ceramic interfaces remains largely unexplored. Here we report the first direct measurement of the interfacial strength by pulling out individual BNNTs from silica (silicon dioxide) matrices using in situ electron microscopy techniques. Our nanomechanical measurements show that the average interfacial shear stress reaches about 34.7 MPa, while density functional theory calculations reveal strong bonded interactions between BN and silica lattices with a binding energy of -6.98 eV nm-2. Despite this strong BNNT-silica binding, nanotube pull-out remains the dominant failure mode without noticeable silica matrix residues on the pulled-out tube surface. The fracture toughness of BNNT-silica ceramic matrix nanocomposite is evaluated based on the measured interfacial strength property, and substantial fracture toughness enhancements are demonstrated at small filler concentrations.
ABSTRACT
Carbon nanotubes (CNTs) are highly promising for strength reinforcement in polymer nanocomposites, but conflicting interfacial properties have been reported by single nanotube pull-out experiments. Here, we report the interfacial load transfer mechanisms during pull-out of CNTs from PMMA matrices, using massively- parallel molecular dynamics simulations. We show that the pull-out forces associated with non-bonded interactions between CNT and PMMA are generally small, and are weakly-dependent on the embedment length of the nanotube. These pull-out forces do not significantly increase with the presence of Stone Wales or vacancy defects along the nanotube. In contrast, low-density distribution of cross-links along the CNT-PMMA interface increases the pull-out forces by an order of magnitude. At each cross-linked site, mechanical unfolding and pull-out of single or pair polymer chain(s) attached to the individual cross-link bonds result in substantial interfacial strengthening and toughening, while contributing to interfacial slip between CNT and PMMA. Our interfacial shear-slip model shows that the interfacial loads are evenly-distributed among the finite number of cross-link bonds at low cross-link densities or for nanotubes with short embedment lengths. At higher cross-link densities or for nanotubes with longer embedment lengths, a no-slip zone now develops where shear-lag effects become important. Implications of these results, in the context of recent nanotube pull-out experiments, are discussed.
