Structural and elastic properties of Ge after Kr-ion irradiation at room temperature

Changes in the elastic properties of Ge induced by room-temperature irradiation with 3.5-MeV Kr ions have been determined and correlated with changes in the microstructure determined by transmission electron microscopy. Elastic-shear-moduli changes were measured by Brillouin scattering, and changes in local atomic arrangement were determined by Raman scattering. Amorphization decreased the elastic shear modulus of Ge by 17%. The fractional decrease was correlated with the amorphous volume fraction with a cross section of 4.5±0.5 nm2/ion. No change was observed in the shear modulus during void formation and growth. The elastic properties of the voided material are described by the Voigt averaging. However, as the voids evolved into a fibrous spongelike microstructure, a second dramatic elastic softening occurs which we attribute to the inability of the fibrous structure to support shear stresses. Raman scattering showed that, once formed, there was no change in the structure of the amorphous material at the atomic scale during void formation and subsequent void coalescence

Equation of state and phonon frequency calculations of diamond at high pressures

The pressure-volume relationship and the zone-center optical phonon frequency of cubic diamond at pressures up to 600 GPa have been calculated based on Density Functional Theory within the Local Density Approximation and the Generalized Gradient Approximation. Three different approaches, viz. a pseudopotential method applied in the basis of plane waves, an all-electron method relying on Augmented Plane Waves plus Local Orbitals, and an intermediate approach implemented in the basis of Projector Augmented Waves have been used. All these methods and approximations yield consistent results for the pressure derivative of the bulk modulus and the volume dependence of the mode Grueneisen parameter of diamond. The results are at variance with recent precise measurements up to 140 GPa. Possible implications for the experimental pressure determination based on the ruby luminescence method are discussed.Comment: 10 pages, 6 figure

Irradiation-induced amorphization and elastic shear instability in intermetallic compounds

Previously we reported a substantial ({approximately}50%) decrease in shear modulus prior to amorphization in Kr irradiated Zr{sub 3}Al, and proposed that amorphization is triggered when the crystalline lattice becomes unstable against shear stress. In the present work, the relation between amorphization and shear elastic instability has been investigated in two additional compounds (FeTi and NiAl) during room temperature irradiation with 1.7-MeV Kr{sup +}. A shear modulus was measured using Brillouin scattering; structural information was obtained in situ in a high voltage electron microscope interfaced to a tandem accelerator. During irradiation of FeTi, chemical disordering and a large ({approximately}40%) decrease of shear modulus were observed, and an amorphous phase developed subsequently. In contrast, NiAl remained crystalline and chemically ordered during irradiation, and exhibited only a {approximately}10% decrease in shear modulus. Hence, these two results provide further support that a shear instability triggers irradiation-induced amorphization. The shear instability mechanism may also apply to other solid-state amorphization techniques, e.g., hydrogen charging and mechanical deformation. 22 refs., 3 figs