1209.0865 (Miao Liu et al.)

Quantum Manifestation of Elastic Constants in Nanostructures    [PDF]

Miao Liu, Feng Liu

Generally, there are two distinct effects in modifying the properties of low-dimensional nanostructures: surface effect (SS) due to increased surface-volume ratio and quantum size effect (QSE) due to quantum confinement in reduced dimension. The SS has been widely shown to affect the elastic constants and mechanical properties of nanostructures. Here, using Pb nanofilm and graphene nanoribbon as model systems, we demonstrate the QSE on the elastic constants of nanostructures by first-principles calculations. We show that generally QSE is dominant in affecting the elastic constants of metallic nanostructures while SS is more pronounced in semiconductor and insulator nanostructures. Our findings have broad implications in quantum aspects of nanomechanics.

View original: http://arxiv.org/abs/1209.0865