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In glasses, atomic disorder combined with atomic connectivity makes understanding of the nature of the vibrations much more complex than in crystals or molecules. With a simple model, however, it is possible to show how disorder generates quasi-local modes on optic branches as well as on acoustic branches at low-frequency. The latter modes, possibly hybridizing with low-lying optic modes in real glasses, lead to the excess, low-frequency excitations known as {it boson-peak modes}, which are lacking in crystals. The spatially quasi-localized vibrations also explain anomalies in thermal conductivity and the end of the acoustic branches, two other specific features of glasses. Together with the quasi-localization of the modes at the nanometric scale, structural disorder lifts the crystalline or molecular spectroscopic selection rules and makes interpretation of experiments difficult. Nevertheless, vibrations in simple glasses such as vitreous silica or vitreous boron oxide are nowadays rather well described. But a comprehensive understanding of the boson peak modes remains a highly debated issue as illustrated by three archetypal glass systems, vitreous SiO$_2$ and B$_2$O$_3$ and amorphous silicon.
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The boson peak in metallic glasses is modeled in terms of local structural shear rearrangements. Using Eshelbys solution of the corresponding elasticity theory problem (J. D. Eshelby, Proc. Roy. Soc. A241, 376 (1957)), one can calculate the saddle point energy of such a structural rearrangement. The neighbourhood of the saddle point gives rise to soft resonant vibrational modes. One can calculate their density, their kinetic energy, their fourth order potential term and their coupling to longitudinal and transverse sound waves.
The anharmonic soft modes studied in recent numerical work in the glass phase of simple liquids have an unstable core, stabilized by the positive restoring forces of the surrounding elastic medium. The present paper formulates an unstable core version of the phenomenological soft potential model for the low temperature anomalies of glasses, relates a new numerical finding on low-barrier relaxations to old soft potential model results, and discusses experimental evidence for an unstable core of the boson peak modes.
We present a numerical investigation of the density fluctuations in a model glass under cyclic shear deformation. At low amplitude of shear, below yielding, the system reaches a steady absorbing state in which density fluctuations are suppressed revealing a clear fingerprint of hyperuniformity up to a finite length scale. The opposite scenario is observed above yielding, where the density fluctuations are strongly enhanced. We demonstrate that the transition to this state is accompanied by a spatial phase separation into two distinct hyperuniform regions, as a consequence of shear band formation above the yield amplitude.
A relaxation process, with the associated phenomenology of sound attenuation and sound velocity dispersion, is found in a simulated harmonic Lennard-Jones glass. We propose to identify this process with the so called microscopic (or instantaneous) relaxation process observed in real glasses and supercooled liquids. A model based on the memory function approach accounts for the observation, and allows to relate to each others: 1) the characteristic time and strength of this process, 2) the low frequency limit of the dynamic structure factor of the glass, and 3) the high frequency sound attenuation coefficient, with its observed quadratic dependence on the momentum transfer.
We show that harmonic vibrations in amorphous silicon can be decomposed to transverse and longitudinal components in all frequency range even in the absence of the well defined wave vector ${bf q}$. For this purpose we define the transverse component of the eigenvector with given $omega$ as a component, which does not change the volumes of Voronoi cells around atoms. The longitudinal component is the remaining orthogonal component. We have found the longitudinal and transverse components of the vibrational density of states for numerical model of amorphous silicon. The vibrations are mostly transverse below 7 THz and above 15 THz. In the frequency interval in between the vibrations have a longitudinal nature. Just this sudden transformation of vibrations at 7 THz from almost transverse to almost longitudinal ones explains the prominent peak in the diffusivity of the amorphous silicon just above 7 THz.
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