Atomistic simulations are carried out for zeolite with ABW framework. The structure is modeled and force field simulations are preformed to investigate its elastic properties, bulk, shear modulus and auxeticity. Bulk moduli (Ks), Shear moduli (G), and Poissons ratios (ν) were found to be Ks=79.71725 GPa, G=16.93265 GPa, νxy = -0.2207, νxz= -0.5730, νyx= -0.71717, νyz=0.87013, νzx= -0.33097 and ...

In the current research with novel first and second differentiations of a yield function, Euler forward along with Euler backward with its consistent elastic-plastic modulus are newly implemented in finite element program in rate-independent plasticity. An elastic-plastic internally pressurized thick walled cylinder is analyzed with four famous criteria including both pressure dependent and ind...

Understanding the mechanism underlying the behavior of polymer-based nanocomposites requires investigation at the molecular level. In the current study, an atomistic simulation based on molecular dynamics was performed to characterize the mechanical properties of polycarbonate (PC) nanocomposites reinforced with single-walled armchair carbon nanotubes (SWCNT). The stiffness matrix and elastic p...

Motivated by interest in the elastic properties of high-strength amorphous metals, we examine the elastic properties of select crystalline phases. Using first-principles methods, we calculate elastic moduli in various chemical systems containing transition metals, specifically early (Ta,W) and late (Co,Ni). Theoretically predicted alloy elastic properties are verified for Ni-Ta by comparison wi...

Materials characterized by spatially homogeneous elastic moduli undergo affine distortions when subjected to external stress at their boundaries, i.e., their displacements from a uniform reference state grow linearly with position , and their strains are spatially constant. Many materials, including all macroscopically isotropic amorphous ones, have elastic moduli that vary randomly with positi...

Determination of the mechanical properties of carbon nanotubes is an essential step in their applications from macroscopic composites to nano-electro-mechanical systems. In this paper we report the results of a series of molecular dynamics simulations carried out to predict the elastic constants, i.e. the elements of the stiffness tensor, and the elastic moduli, namely the Young’s and shear mod...

BACKGROUND Studying mechanical properties of canine trabecular bone is important for a better understanding of fracture mechanics or bone disorders and is also needed for numerical simulation of canine femora. No detailed data about elastic moduli and degrees of anisotropy of canine femoral trabecular bone has been published so far, hence the purpose of this study was to measure the elastic mod...

Insight into a material’s high temperature mechanical and microstructural properties can be gained from knowledge of its elastic moduli. For a single-crystal material, the elastic modulus, Cijkl, provides information on the strain (εkl) stress (σij) relationship given by σij = Cijkl•εkl. This relationship shows that, for a given strain, a large elastic modulus will induce a large stress in the ...

Single-crystal Brillouin spectroscopy measurements have been carried out to 1073 K and ambient pressure to determine the elastic odulus tensor of a natural orthopyroxene, nearly pure Mg end-member (Mg0.994Fe0.002Al0.004)2(Si0.996Al0.004)2O6 orthoenstatite. hree single-crystal specimens with orthogonal crystallographic orientations were prepared for Brillouin measurements to determine ll the sin...