arXiv subjects

D. A. Parshin

Publications and source records attributed to D. A. Parshin.

17 recordsLinked to original sources

arXiv2019

Application of the random matrix theory to the boson peak in glasses

The density of vibrational states $g(ω)$ of an amorphous system is studied by using the random-matrix theory. Taking into account the most important correlations between elements of the random matrix of the system, equations for the density of vibrational states $g(ω)$ are obtained. The analysis of these equations shows that in the low-frequency region the vibrational density of states has the Debye behavior $g(ω) \sim ω^2$. In the higher frequency region, there is the boson peak as an additional contribution to the density of states. The obtained equations are in a good agreement with the numerical results and allow us to find an exact shape of the boson peak.

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arXiv2018

Propagative and diffusive regimes of acoustic damping in bulk amorphous material

In amorphous solids, a non-negligible part of thermal conductivity results from phonon scattering on the structural disorder. The conversion of acoustic energy into thermal energy is often measured by the Dynamical Structure Factor (DSF) thanks to inelastic neutron or X-Ray scattering. The DSF is used to quantify the dispersion relation of phonons, together with their damping. However, the connection of the dynamical structure factor with dynamical attenuation of wave packets in glasses is still a matter of debate. We focus here on the analysis of wave packets propagation in numerical models of amorphous silicon. We show that the DHO fits (Damped Harmonic Oscillator model) of the dynamical structure factors give a good estimate of the wave packets mean-free path, only below the Ioffe-Regel limit. Above the Ioffe-Regel limit and below the mobility edge, a pure diffusive regime without a definite mean free path is observed. The high-frequency mobility edge is characteristic of a transition to localized vibrations. Below the Ioffe-Regel criterion, a mixed regime is evidenced at intermediate frequencies, with a coexistence of propagative and diffusive wave fronts. The transition between these different regimes is analyzed in details and reveals a complex dynamics for energy transportation, thus raising the question of the correct modeling of thermal transport in amorphous materials.

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arXiv2015

Boson peak and Ioffe-Regel criterion in amorphous silicon-like materials: the effect of bond directionality

The vibrational properties of model amorphous materials are studied by combining complete analysis of the vibration modes, dynamical structure factor and energy diffusivity with exact diagonalization of the dynamical matrix and the Kernel Polynomial Method which allows a study of very large system sizes. Different materials are studied that differ only by the bending rigidity of the interactions in a Stillinger-Weber modelization used to describe amorphous silicon. The local bending rigidity can thus be used as a control parameter, to tune the sound velocity together with local bonds directionality. It is shown that for all the systems studied, the upper limit of the Boson peak corresponds to the Ioffe-Regel criterion for transverse waves, as well as to a minimum of the diffusivity. The Boson peak is followed by a diffusivity's increase supported by longitudinal phonons. The Ioffe-Regel criterion for transverse waves corresponds to a common characteristic mean-free path of 5-7 Å (which is slightly bigger for longitudinal phonons), while the fine structure of the vibrational density of states is shown to be sensitive to the local bending rigidity.

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arXiv2015

Transverse and longitudinal vibrations in amorphous silicon

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 $ω$ 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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arXiv2013

The Ioffe-Regel criterion and diffusion of vibrations in random lattices

We consider diffusion of vibrations in 3d harmonic lattices with strong force-constant disorder. Above some frequency w_IR, corresponding to the Ioffe-Regel crossover, notion of phonons becomes ill defined. They cannot propagate through the system and transfer energy. Nevertheless most of the vibrations in this range are not localized. We show that they are similar to diffusons introduced by Allen, Feldman et al., Phil. Mag. B 79, 1715 (1999) to describe heat transport in glasses. The crossover frequency w_IR is close to the position of the boson peak. Changing strength of disorder we can vary w_IR from zero value (when rigidity is zero and there are no phonons in the lattice) up to a typical frequency in the system. Above w_IR the energy in the lattice is transferred by means of diffusion of vibrational excitations. We calculated the diffusivity of the modes D(w) using both the direct numerical solution of Newton equations and the formula of Edwards and Thouless. It is nearly a constant above w_IR and goes to zero at the localization threshold. We show that apart from the diffusion of energy, the diffusion of particle displacements in the lattice takes place as well. Above w_IR a displacement structure factor S(q,w) coincides well with a structure factor of random walk on the lattice. As a result the vibrational line width Gamma(q)=D_u q^2 where D_u is a diffusion coefficient of particle displacements. Our findings may have important consequence for the interpretation of experimental data on inelastic x-ray scattering and mechanisms of heat transfer in glasses.

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arXiv2011

Sparse random matrices and vibrational spectra of amorphous solids

A random matrix approach is used to analyze the vibrational properties of amorphous solids. We investigated a dynamical matrix M=AA^T with non-negative eigenvalues. The matrix A is an arbitrary real NxN sparse random matrix with n independent non-zero elements in each row. The average values =0 and dispersion =V^2 for all non-zero elements. The density of vibrational states g(w) of the matrix M for N,n >> 1 is given by the Wigner quarter circle law with radius independent of N. We argue that for n^2 << N this model can be used to describe the interaction of atoms in amorphous solids. The level statistics of matrix M is well described by the Wigner surmise and corresponds to repulsion of eigenfrequencies. The participation ratio for the major part of vibrational modes in three dimensional system is about 0.2 - 0.3 and independent of N. Together with term repulsion it indicates clearly to the delocalization of vibrational excitations. We show that these vibrations spread in space by means of diffusion. In this respect they are similar to diffusons introduced by Allen, Feldman, et al., Phil. Mag. B 79, 1715 (1999) in amorphous silicon. Our results are in a qualitative and sometimes in a quantitative agreement with molecular dynamic simulations of real and model glasses.

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arXiv2011

Density of states in random lattices with translational invariance

We propose a random matrix approach to describe vibrational excitations in disordered systems. The dynamical matrix M is taken in the form M=AA^T where A is some real (not generally symmetric) random matrix. It guaranties that M is a positive definite matrix which is necessary for mechanical stability of the system. We built matrix A on a simple cubic lattice with translational invariance and interaction between nearest neighbors. We found that for certain type of disorder phonons cannot propagate through the lattice and the density of states g(w) is a constant at small w. The reason is a breakdown of affine assumptions and inapplicability of the elasticity theory. Young modulus goes to zero in the thermodynamic limit. It strongly reminds of the properties of a granular matter at the jamming transition point. Most of the vibrations are delocalized and similar to diffusons introduced by Allen, Feldman et al., Phil. Mag. B v.79, 1715 (1999).

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arXiv2009

Oscillations of Echo Amplitude in Glasses in a Magnetic Field Induced by Nuclear Dipole-Dipole Interaction

The effect of a magnetic field on the dipole echo amplitude in glasses (at temperatures of about 10 mK) induced by the dipole-dipole interaction of nuclear spins has been theoretically studied. It has been shown that a change in the positions of nuclear spins as a result of tunneling and their interaction with the external magnetic field E_H lead to a nonmonotonic magnetic field dependence of the dipole echo amplitude. The approximation that the nuclear dipole-dipole interaction energy E_d is much smaller than the Zeeman energy E_H has been found to be valid in the experimentally important cases. It has been shown that the dipole echo amplitude in this approximation may be described by a simple universal analytic function independent of the microscopic structure of the two-level systems. An excellent agreement of the theory with the experimental data has been obtained without fitting parameters (except for the unknown echo amplitude)

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arXiv2009

Effect of a Magnetic Field on the Dipole Echo in Glasses with Nuclear Quadrupole Moments

The effect of a magnetic field on the dipole echo amplitude in glasses at temperatures of about 10 mK caused by nonspherical nuclei with electric quadrupole moments has been studied theoretically. It has been shown that in this case, the two-level systems (TLS's) that determine the glass properties at low temperatures are transformed into more complicated multilevel systems. These systems have new properties as compared to usual TLS's and, in particular, exhibit oscillations of electric dipole echo amplitude in magnetic field. A general formula that describes the echo amplitude in an arbitrary split TLS has been derived with perturbation theory. Detailed analytic and numerical analysis of the formula has been performed. The theory agrees qualitatively and quantitatively well with experimental data.

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arXiv2009

A theory of the three-pulse electric-dipole echo in glasses in a magnetic field

We extended existing theory of the two-pulse electric-dipole echo in glasses in a magnetic field to the three-pulse echo. As is well known, at low temperatures two-level systems (TLS's) are responsible for the echo phenomenon in glasses. Using a diagram technique in the framework of perturbation theory we derived a simple formula for the three-pulse echo amplitude. As in the case of two-pulse echo the magnetic field dependence of the tree-pulse echo amplitude in glasses is related to quadrupole electric moments of TLS's non-spherical nuclei and/or dipole-dipole interaction of their nuclear spins. These two mechanisms are responsible for the fine level splitting of TLS. As a result TLS transforms to multi-level system with the fine level splitting depending on a magnetic field. Due to existence in the theory the additional parameter T - the time interval between the second and the third pulses we have more reach spectrum of echo oscillations in a magnetic field in comparison with the case of the two-pulse echo.

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arXiv2007

The Boson Peak and its Relation with Acoustic Attenuation in Glasses

Experimental results on the density of states and on the acoustic modes of glasses in the THz region are compared to the predictions of two categories of models. A recent one, solely based on an elastic instability, does not account for most observations. Good agreement without adjustable parameters is obtained with models including the existence of non-acoustic vibrational modes at THz frequency, providing in many cases a comprehensive picture for a range of glass anomalies.

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arXiv2007

Vibrational instability, two-level systems and Boson peak in glasses

We show that the same physical mechanism is fundamental for two seemingly different phenomena such as the formation of two-level systems in glasses and the Boson peak in the reduced density of low-frequency vibrational states g(w)/w^2. This mechanism is the vibrational instability of weakly interacting harmonic modes. Below some frequency w_c << w_0 (where w_0 is of the order of Debye frequency) the instability, controlled by the anharmonicity, creates a new stable universal spectrum of harmonic vibrations with a Boson peak feature as well as double-well potentials with a wide distribution of barrier heights. Both are determined by the strength of the interaction I ~ w_c between the oscillators. Our theory predicts in a natural way a small value for the important dimensionless parameter C ~ 10^{-4} for two-level systems in glasses. We show that C ~ I^{-3} and decreases with increasing of the interaction strength I. We show that the number of active two-level systems is very small, less than one per ten million of oscillators, in a good agreement with experiment. Within the unified approach developed in the present paper the density of the tunneling states and the density of vibrational states at the Boson peak frequency are interrelated.

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arXiv2004

Pressure dependence of the Boson peak in glasses

The inelastic scattering intensities of glasses and amorphous materials has a maximum at a low frequency, the so called Boson peak. Under applied hydrostatic pressure, $P$, the Boson peak frequency, $ω_{\rm b}$, is shifted upwards. We have shown previously that the Boson peak is created as a result of a vibrational instability due to the interaction of harmonic quasi localized vibrations (QLV). Applying pressure one exerts forces on the QLV. These shift the low frequency part of the excess spectrum to higher frequencies. For low pressures we find a shift of the Boson peak linear in $P$, whereas for high pressures the shift is $\propto P^{1/3}$. Our analytics is supported by simulation. The results are in agreement with the existing experiments.

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arXiv2004

Oscillations of the Electric-Dipole Echo in Glasses in a Magnetic Field

Using a simple diagram technique we derive the electric-dipole echo amplitude from two-level systems with a quadrupole nuclear moment in glasses in an external magnetic field. We show, that due to the quadrupole moment interaction of a tunneling particle with a gradient of an internal electric field, the echo amplitude experiences oscillations in rather weak magnetic fields. With an increase of the magnetic field, when the Zeeman energy becomes larger than the quadrupole energy splitting, the average echo amplitude increases and saturates (for high magnetic fields) at some level which is above the average level of echo oscillations for small magnetic fields.

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arXiv2003

Anharmonicity, vibrational instability and Boson peak in glasses

We show that a {\em vibrational instability} of the spectrum of weakly interacting quasi-local harmonic modes creates the maximum in the inelastic scattering intensity in glasses, the Boson peak. The instability, limited by anharmonicity, causes a complete reconstruction of the vibrational density of states (DOS) below some frequency $ω_c$, proportional to the strength of interaction. The DOS of the new {\em harmonic modes} is independent of the actual value of the anharmonicity. It is a universal function of frequency depending on a single parameter -- the Boson peak frequency, $ω_b$ which is a function of interaction strength. The excess of the DOS over the Debye value is $\proptoω^4$ at low frequencies and linear in $ω$ in the interval $ω_b \ll ω\ll ω_c$. Our results are in an excellent agreement with recent experimental studies.

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arXiv2000

Interaction of quasilocal harmonic modes and boson peak in glasses

The direct proportionality relation between the boson peak maximum in glasses, $ω_b$, and the Ioffe-Regel crossover frequency for phonons, $ω_d$, is established. For several investigated materials $ω_b = (1.5\pm 0.1)ω_d$. At the frequency $ω_d$ the mean free path of the phonons $l$ becomes equal to their wavelength because of strong resonant scattering on quasilocal harmonic oscillators. Above this frequency phonons cease to exist. We prove that the established correlation between $ω_b$ and $ω_d$ holds in the general case and is a direct consequence of bilinear coupling of quasilocal oscillators with the strain field.

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arXiv1999

Distribution of fractal dimensions at the Anderson transition

We investigated numerically the distribution of participation numbers in the 3d Anderson tight-binding model at the localization-delocalization threshold. These numbers in {\em one} disordered system experience strong level-to-level fluctuations in a wide energy range. The fluctuations grow substantially with increasing size of the system. We argue that the fluctuations of the correlation dimension, $D_2$ of the wave functions are the main reason for this. The distribution of these correlation dimensions at the transition is calculated. In the thermodynamic limit ($L\to \infty$) it does not depend on the system size $L$. An interesting feature of this limiting distribution is that it vanishes exactly at $D_{\rm 2max}=1.83$, the highest possible value of the correlation dimension at the Anderson threshold in this model.

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