Ab initio periodic Hartree-Fock (HF) theory was used to determine the elastic constants and selected phonon frequencies of bulk MgO; the accuracy of a posteriori correlation corrections to the periodic Hartree-Fock calculations is also discussed. Inc)usion of difFuse atomic orbitals in the MgO basis was necessary to accurately describe elastic distortions and phonon vibrations of the solid. The...

A first-principles approach to calculating the elastic stiffness coefficients at finite temperatures was proposed. It is based on the assumption that the temperature dependence of elastic stiffness coefficients mainly results from volume change as a function of temperature; it combines the first-principles calculations of elastic constants at 0 K and the first-principles phonon theory of therma...

The focus of the article is on the analysis of effective elastic properties of planar Solid Oxide Fuell Cell (SOFC) devices. An ideal periodic multi-layered composite (SOFC-like) reproducing the overall properties of multi-layer SOFC devices is defined. Adopting a non-local dynamic homogenization method, explicit expressions for overall elastic moduli and inertial terms of this material are der...

Interestin fiber reinforced polymeric (FRP) composites for structural highway applications has generated the need for reliable techniques which may be used to measure all of the elastic constants of these materials. Mechanical techniques may only be used to measure some of the engineering constants of these anisotropic materials due to the geometry of the pultruded members. Further, mechanical ...

We consider a periodic lattice structure in d=2 or 3 dimensions with unit cell comprising Z thin elastic members emanating from a similarly situated central node. A general theoretical approach provides an algebraic formula for the effective elasticity of such frameworks. The method yields the effective cubic elastic constants for three-dimensional space-filling lattices with Z=4, 6, 8, 12 and ...

The pressure effects on the lattice parameters and elastic constants of the tetragonal RNi2B2C (R=Y, Lu) are investigated by means of the first principles. The predicted lattice constants and elastic constants of YNi2B2C and LuNi2B2C at 0 GPa agree well with the available data. By the elastic stability criteria under isotropic pressure, it is predicted that YNi2B2C and LuNi2B2C with tetragonal ...

We have measured the changes in the ultrasonic wave velocity, induced by the application of uniaxial stresses in a Cu-Al-Ni single crystal. From these measurements, the complete set of third-order elastic constants has been obtained. The comparison of results for Cu-Al-Ni with available data for other Cu-based alloys has shown that all these alloys exhibit similar anharmonic behavior. By using ...

The surface expansion that is induced by the lateral pressure in the brush region of lipid membranes containing grafted polymers is deduced from the scaling and mean-field theories for the polymer brush, together with the equation of state for a lipid monolayer at the equivalence pressure with fluid lipid bilayers. Depending on the length and mole fraction of the polymer lipid, the membrane exp...

We use the ultrasonic transmission method to measure P-, SH-, and SV-wave velocities for Chelmsford Granite, Chicopee Shale, and Berea Sandstone in different directions up to 1000 bars confining pressure. The velocity measurements indicate that these three rocks are elastically anisotropic. The stiffness constants, dynamic Young's moduli, dynamic Poisson's ratios, and dynamic bulk moduli of the...