The transmission spectrum of sound through a phononic crystal subjected to liquid flow
DEFF Research Database (Denmark)
Declercq, Nico F.; Chehami, Lynda; Moiseyenko, Rayisa P.
2018-01-01
, density, and concentration measurement of liquid solutions. However, no study of possible flow-speed influence on PC filter characteristics has been reported. For the case in which fluid-flow measurements without the presence of a PC is considered, we can cite, for example, Nishimura et al.,11...... to the large contrast in their densities and elastic constants, as this has been shown to be an effective approach for the formation of bandgaps in other studies on phononic crystals.12–14 To study effects of liquid flow on the transmission spectrum, that spectrum was first determined using through......The influence of liquid-flow up to 7 mm/s is examined on transmission spectra of phononic crystals, revealing a potential use for slow liquid-flow measurement techniques. It is known that transmission of ultrasound through a phononic crystal is determined by its periodicity and depends...
Manipulation of Phonons with Phononic Crystals
Energy Technology Data Exchange (ETDEWEB)
Leseman, Zayd Chad [Univ. of New Mexico, Albuquerque, NM (United States)
2015-07-09
There were three research goals associated with this project. First, was to experimentally demonstrate phonon spectrum control at THz frequencies using Phononic Crystals (PnCs), i.e. demonstrate coherent phonon scattering with PnCs. Second, was to experimentally demonstrate analog PnC circuitry components at GHz frequencies. The final research goal was to gain a fundamental understanding of phonon interaction using computational methods. As a result of this work, 7 journal papers have been published, 1 patent awarded, 14 conference presentations given, 4 conference publications, and 2 poster presentations given.
Phonon manipulation with phononic crystals.
Energy Technology Data Exchange (ETDEWEB)
Kim Bongsang; Hopkins, Patrick Edward; Leseman, Zayd C.; Goettler, Drew F.; Su, Mehmet F. (University of New Mexico, Albuquerque, NM); El-Kady, Ihab Fathy; Reinke, Charles M.; Olsson, Roy H., III
2012-01-01
In this work, we demonstrated engineered modification of propagation of thermal phonons, i.e. at THz frequencies, using phononic crystals. This work combined theoretical work at Sandia National Laboratories, the University of New Mexico, the University of Colorado Boulder, and Carnegie Mellon University; the MESA fabrication facilities at Sandia; and the microfabrication facilities at UNM to produce world-leading control of phonon propagation in silicon at frequencies up to 3 THz. These efforts culminated in a dramatic reduction in the thermal conductivity of silicon using phononic crystals by a factor of almost 30 as compared with the bulk value, and about 6 as compared with an unpatterned slab of the same thickness. This work represents a revolutionary advance in the engineering of thermoelectric materials for optimal, high-ZT performance. We have demonstrated the significant reduction of the thermal conductivity of silicon using phononic crystal structuring using MEMS-compatible fabrication techniques and in a planar platform that is amenable to integration with typical microelectronic systems. The measured reduction in thermal conductivity as compared to bulk silicon was about a factor of 20 in the cross-plane direction [26], and a factor of 6 in the in-plane direction. Since the electrical conductivity was only reduced by a corresponding factor of about 3 due to the removal of conductive material (i.e., porosity), and the Seebeck coefficient should remain constant as an intrinsic material property, this corresponds to an effective enhancement in ZT by a factor of 2. Given the number of papers in literature devoted to only a small, incremental change in ZT, the ability to boost the ZT of a material by a factor of 2 simply by reducing thermal conductivity is groundbreaking. The results in this work were obtained using silicon, a material that has benefitted from enormous interest in the microelectronics industry and that has a fairly large thermoelectric power
Gorishnyy, T; Ullal, C K; Maldovan, M; Fytas, G; Thomas, E L
2005-03-25
In this Letter we propose the use of hypersonic phononic crystals to control the emission and propagation of high frequency phonons. We report the fabrication of high quality, single crystalline hypersonic crystals using interference lithography and show that direct measurement of their phononic band structure is possible with Brillouin light scattering. Numerical calculations are employed to explain the nature of the observed propagation modes. This work lays the foundation for experimental studies of hypersonic crystals and, more generally, phonon-dependent processes in nanostructures.
Features of the optical branch of phonon spectrum in La2CuO4 single crystals
International Nuclear Information System (INIS)
Zavaritskij, N.V.; Makarov, V.I.; Klochko, V.S.; Molchanov, V.N.; Tamazyan, R.A.; Yurgens, A.A.
1991-01-01
The X-ray acoustic and thermal study of La 2 CuO 4 single crystal is applied in order to determine the tetra-ortho transition and anomalies in the temperature behaviour of the longitudinal sound velocity and absorption due to the acoustic and optical branches of the La 2 CuO 4 phonon spectrum. The different temperature values of these features are interpreted as manifestation of the optical soft mode deformation caused by the various element composition of additions in single crystals
Phononic crystals fundamentals and applications
Adibi, Ali
2016-01-01
This book provides an in-depth analysis as well as an overview of phononic crystals. This book discusses numerous techniques for the analysis of phononic crystals and covers, among other material, sonic and ultrasonic structures, hypersonic planar structures and their characterization, and novel applications of phononic crystals. This is an ideal book for those working with micro and nanotechnology, MEMS (microelectromechanical systems), and acoustic devices. This book also: Presents an introduction to the fundamentals and properties of phononic crystals Covers simulation techniques for the analysis of phononic crystals Discusses sonic and ultrasonic, hypersonic and planar, and three-dimensional phononic crystal structures Illustrates how phononic crystal structures are being deployed in communication systems and sensing systems.
Tunable Topological Phononic Crystals
Chen, Zeguo
2016-05-27
Topological insulators first observed in electronic systems have inspired many analogues in photonic and phononic crystals in which remarkable one-way propagation edge states are supported by topologically nontrivial band gaps. Such band gaps can be achieved by breaking the time-reversal symmetry to lift the degeneracy associated with Dirac cones at the corners of the Brillouin zone. Here, we report on our construction of a phononic crystal exhibiting a Dirac-like cone in the Brillouin zone center. We demonstrate that simultaneously breaking the time-reversal symmetry and altering the geometric size of the unit cell result in a topological transition that we verify by the Chern number calculation and edge-mode analysis. We develop a complete model based on the tight binding to uncover the physical mechanisms of the topological transition. Both the model and numerical simulations show that the topology of the band gap is tunable by varying both the velocity field and the geometric size; such tunability may dramatically enrich the design and use of acoustic topological insulators.
Two-phonon bound states in imperfect crystals
International Nuclear Information System (INIS)
Behera, S.N.; Samsur, Sk.
1980-01-01
The question of the occurrence of two-phonon bound states in imperfect crystals is investigated. It is shown that the anharmonicity mediated two-phonon bound state which is present in perfect crystals gets modified due to the presence of impurities. Moreover, the possibility of the occurrence of a purely impurity mediated two-phonon bound state is demonstrated. The bound state frequencies are calculated using the simple Einstein oscillator model for the host phonons. The two-phonon density of states for the imperfect crystal thus obtained has peaks at the combination and difference frequencies of two host phonons besides the peaks at the bound state frequencies. For a perfect crystal the theory predicts a single peak at the two-phonon bound state frequency in conformity with experimental observations and other theoretical calculations. Experimental data on the two-phonon infrared absorption and Raman scattering from mixed crystals of Gasub(1-c)Alsub(c)P and Gesub(1-c)Sisub(c) are analysed to provide evidence in support of impurity-mediated two-phonon bound states. The relevance of the zero frequency (difference spectrum) peak to the central peak, observed in structural phase transitions, is conjectured. (author)
Phononic crystals and elastodynamics: Some relevant points
Energy Technology Data Exchange (ETDEWEB)
Aravantinos-Zafiris, N. [Dept. of Materials Science, University of Patras, Patras 26504 (Greece); Department of Sound and Musical Instruments Technology, Ionian Islands Technological Educational Institute, Lixouri, 28200 (Greece); Sigalas, M. M. [Dept. of Materials Science, University of Patras, Patras 26504 (Greece); Kafesaki, M. [Institute of Electronic Structure and Laser (IESL), Foundation for Research and Technology, Hellas (FORTH), P.O. Box 1387, 70013 Heraklion, Crete (Greece); Dept. of Materials Science and Technology, Univ. of Crete (Greece); Economou, E. N. [Institute of Electronic Structure and Laser (IESL), Foundation for Research and Technology, Hellas (FORTH), P.O. Box 1387, 70013 Heraklion, Crete (Greece); Dept. of Physics, Univ. of Crete (Greece)
2014-12-15
In the present paper we review briefly some of the first works on wave propagation in phononic crystals emphasizing the conditions for the creation of acoustic band-gaps and the role of resonances to the band-gap creation. We show that useful conclusions in the analysis of phononic band gap structures can be drawn by considering the mathematical similarities of the basic classical wave equation (Helmholtz equation) with Schrödinger equation and by employing basic solid state physics concepts and conclusions regarding electronic waves. In the second part of the paper we demonstrate the potential of phononic systems to be used as elastic metamaterials. This is done by demonstrating negative refraction in phononic crystals and subwavelength waveguiding in a linear chain of elastic inclusions, and by proposing a novel structure with close to pentamode behavior. Finally the potential of phononic structures to be used in liquid sensor applications is discussed and demonstrated.
Phononic crystals and elastodynamics: Some relevant points
International Nuclear Information System (INIS)
Aravantinos-Zafiris, N.; Sigalas, M. M.; Kafesaki, M.; Economou, E. N.
2014-01-01
In the present paper we review briefly some of the first works on wave propagation in phononic crystals emphasizing the conditions for the creation of acoustic band-gaps and the role of resonances to the band-gap creation. We show that useful conclusions in the analysis of phononic band gap structures can be drawn by considering the mathematical similarities of the basic classical wave equation (Helmholtz equation) with Schrödinger equation and by employing basic solid state physics concepts and conclusions regarding electronic waves. In the second part of the paper we demonstrate the potential of phononic systems to be used as elastic metamaterials. This is done by demonstrating negative refraction in phononic crystals and subwavelength waveguiding in a linear chain of elastic inclusions, and by proposing a novel structure with close to pentamode behavior. Finally the potential of phononic structures to be used in liquid sensor applications is discussed and demonstrated
Evarestov, R A; Losev, M V
2009-12-01
For the first time the convergence of the phonon frequencies and dispersion curves in terms of the supercell size is studied in ab initio frozen phonon calculations on LiF crystal. Helmann-Feynman forces over atomic displacements are found in all-electron calculations with the localized atomic functions (LCAO) basis using CRYSTAL06 program. The Parlinski-Li-Kawazoe method and FROPHO program are used to calculate the dynamical matrix and phonon frequencies of the supercells. For fcc lattice, it is demonstrated that use of the full supercell space group (including the supercell inner translations) enables to reduce essentially the number of the displacements under consideration. For Hartree-Fock (HF), PBE and hybrid PBE0, B3LYP, and B3PW exchange-correlation functionals the atomic basis set optimization is performed. The supercells up to 216 atoms (3 x 3 x 3 conventional unit cells) are considered. The phonon frequencies using the supercells of different size and shape are compared. For the commensurate with supercell k-points the best agreement of the theoretical results with the experimental data is found for B3PW exchange-correlation functional calculations with the optimized basis set. The phonon frequencies at the most non-commensurate k-points converged for the supercell consisting of 4 x 4 x 4 primitive cells and ensures the accuracy 1-2% in the thermodynamic properties calculated (the Helmholtz free energy, entropy, and heat capacity at the room temperature). (c) 2009 Wiley Periodicals, Inc.
Beryllium phonon spectrum from cold neutron measurements
International Nuclear Information System (INIS)
Bulat, I.A.
1979-01-01
The inelastic coherent scattering of neutrons with the initial energy E 0 =4.65 MeV on the spectrometer according to the time of flight is studied in polycrystalline beryllium. The measurements are made for the scattering angles THETA=15, 30, 45, 60, 75 and 90 deg at 293 K. The phonon spectrum of beryllium, i-e. g(w) is reestablished from the experimental data. The data obtained are compared with the data of model calculations. It is pointed out that the phonon spectrum of beryllium has a bit excessive state density in the energy range from 10 to 30 MeV. It is caused by the insufficient statistical accuracy of the experiment at low energy transfer
Synthetic thermoelectric materials comprising phononic crystals
El-Kady, Ihab F; Olsson, Roy H; Hopkins, Patrick; Reinke, Charles; Kim, Bongsang
2013-08-13
Synthetic thermoelectric materials comprising phononic crystals can simultaneously have a large Seebeck coefficient, high electrical conductivity, and low thermal conductivity. Such synthetic thermoelectric materials can enable improved thermoelectric devices, such as thermoelectric generators and coolers, with improved performance. Such synthetic thermoelectric materials and devices can be fabricated using techniques that are compatible with standard microelectronics.
Ionizing particle detection based on phononic crystals
Energy Technology Data Exchange (ETDEWEB)
Aly, Arafa H., E-mail: arafa16@yahoo.com, E-mail: arafa.hussien@science.bsu.edu.eg; Mehaney, Ahmed; Eissa, Mostafa F. [Physics Department, Faculty of Science, Beni-Suef University, Beni-Suef (Egypt)
2015-08-14
Most conventional radiation detectors are based on electronic or photon collections. In this work, we introduce a new and novel type of ionizing particle detector based on phonon collection. Helium ion radiation treats tumors with better precision. There are nine known isotopes of helium, but only helium-3 and helium-4 are stable. Helium-4 is formed in fusion reactor technology and in enormous quantities during Big Bang nucleo-synthesis. In this study, we introduce a technique for helium-4 ion detection (sensing) based on the innovative properties of the new composite materials known as phononic crystals (PnCs). PnCs can provide an easy and cheap technique for ion detection compared with conventional methods. PnC structures commonly consist of a periodic array of two or more materials with different elastic properties. The two materials are polymethyl-methacrylate and polyethylene polymers. The calculations showed that the energies lost to target phonons are maximized at 1 keV helium-4 ion energy. There is a correlation between the total phonon energies and the transmittance of PnC structures. The maximum transmission for phonons due to the passage of helium-4 ions was found in the case of making polyethylene as a first layer in the PnC structure. Therefore, the concept of ion detection based on PnC structure is achievable.
Multiple topological phases in phononic crystals
Chen, Zeguo
2017-11-20
We report a new topological phononic crystal in a ring-waveguide acoustic system. In the previous reports on topological phononic crystals, there are two types of topological phases: quantum Hall phase and quantum spin Hall phase. A key point in achieving quantum Hall insulator is to break the time-reversal (TR) symmetry, and for quantum spin Hall insulator, the construction of pseudo-spin is necessary. We build such pseudo-spin states under particular crystalline symmetry (C-6v) and then break the degeneracy of the pseudo-spin states by introducing airflow to the ring. We study the topology evolution by changing both the geometric parameters of the unit cell and the strength of the applied airflow. We find that the system exhibits three phases: quantum spin Hall phase, conventional insulator phase and a new quantum anomalous Hall phase.
Semi-Dirac points in phononic crystals
Zhang, Xiujuan
2014-01-01
A semi-Dirac cone refers to a peculiar type of dispersion relation that is linear along the symmetry line but quadratic in the perpendicular direction. It was originally discovered in electron systems, in which the associated quasi-particles are massless along one direction, like those in graphene, but effective-mass-like along the other. It was reported that a semi-Dirac point is associated with the topological phase transition between a semi-metallic phase and a band insulator. Very recently, the classical analogy of a semi-Dirac cone has been reported in an electromagnetic system. Here, we demonstrate that, by accidental degeneracy, two-dimensional phononic crystals consisting of square arrays of elliptical cylinders embedded in water are also able to produce the particular dispersion relation of a semi-Dirac cone in the center of the Brillouin zone. A perturbation method is used to evaluate the linear slope and to affirm that the dispersion relation is a semi-Dirac type. If the scatterers are made of rubber, in which the acoustic wave velocity is lower than that in water, the semi-Dirac dispersion can be characterized by an effective medium theory. The effective medium parameters link the semi-Dirac point to a topological transition in the iso-frequency surface of the phononic crystal, in which an open hyperbola is changed into a closed ellipse. This topological transition results in drastic change in wave manipulation. On the other hand, the theory also reveals that the phononic crystal is a double-zero-index material along the x-direction and photonic-band-edge material along the perpendicular direction (y-direction). If the scatterers are made of steel, in which the acoustic wave velocity is higher than that in water, the effective medium description fails, even though the semi-Dirac dispersion relation looks similar to that in the previous case. Therefore different wave transport behavior is expected. The semi-Dirac points in phononic crystals described in
Phononic crystals bring sound to a focus
Energy Technology Data Exchange (ETDEWEB)
Sanchez-Dehesa, Jose
2004-09-01
Three years ago researchers at the University of California at San Diego created a storm in the world of optics when they announced that they had made a material that exhibited negative refraction. Light rays entering such a 'negative index' material are not bent towards the normal -- as happens in all known materials in nature -- but beyond the normal. Now physicists in China and Canada have demonstrated the equivalent phenomenon with sound waves in a material known as a 'phononic crystal'. (U.K.)
Kuleev, I G
2001-01-01
The effect of normal processes of the phonon-phonon scattering on the thermal conductivity of the germanium crystals with various isotopic disorder degrees is considered. The phonon pulse redistribution in the normal scattering processes both inside each oscillatory branch (the Simons mechanism) and between various phonon oscillatory branches (the Herring mechanism) is accounted for. The contributions of the longitudinal and cross-sectional phonons drift motion into the thermal conductivity are analyzed. It is shown that the pulse redistribution in the Herring relaxation mechanism leads to essential suppression of the longitudinal phonons drift motion in the isotopically pure germanium crystals. The calculations results of thermal conductivity for the Herring relaxation mechanism agree well with experimental data on the germanium crystals with various isotopic disorder degrees
Investigation of quasi-one-dimensional finite phononic crystal with ...
Indian Academy of Sciences (India)
the results analysed by the finite element software, ANSYS. We hope that the results will be helpful in practical applications of phononic crystals. Keywords. Finite phononic crystal; band gap; frequency-response functions. PACS Nos 43.20.+g; 43.40.+s; 63.20.−e. 1. Introduction. In recent years, the propagation of classical ...
Controlling elastic waves with small phononic crystals containing rigid inclusions
Peng, Pai
2014-05-01
We show that a two-dimensional elastic phononic crystal comprising rigid cylinders in a solid matrix possesses a large complete band gap below a cut-off frequency. A mechanical model reveals that the band gap is induced by negative effective mass density, which is affirmed by an effective medium theory based on field averaging. We demonstrate, by two examples, that such elastic phononic crystals can be utilized to design small devices to control low-frequency elastic waves. One example is a waveguide made of a two-layer anisotropic elastic phononic crystal, which can guide and bend elastic waves with wavelengths much larger than the size of the waveguide. The other example is the enhanced elastic transmission of a single-layer elastic phononic crystal loaded with solid inclusions. The effective mass density and reciprocal of the modulus of the single-layer elastic phononic crystal are simultaneously near zero. © CopyrightEPLA, 2014.
Wet-etched phononic crystal waveguiding on GaAs
Muzar, Edward; Azodi Aval, Golnaz; Stotz, James A. H.
2018-01-01
A wet-etched phononic crystal waveguide in GaAs with approximately two micron deep inclusions is studied both numerically and experimentally for controlled surface acoustic wave propagation. Numerically, the phononic crystal was modelled using the finite element method (FEM) with COMSOL Multiphysics, and the surface displacement of the acoustic waves was measured using optical interferometry. The computed filter response of the phononic crystal confirmed that the phononic crystal was an effective stop band filter in the interval of 400 MHz and 450 MHz. An L1 linear defect waveguide with a stepped funnel entrance design is shown to perform well at a surface acoustic wave frequency of 410.344 MHz and in agreement to simulated results. The phononic crystal waveguide system shows promise for use in acoustic control of GaAs-based quantum nanostructures.
Double Dirac cones in phononic crystals
Li, Yan
2014-07-07
A double Dirac cone is realized at the center of the Brillouin zone of a two-dimensional phononic crystal (PC) consisting of a triangular array of core-shell-structure cylinders in water. The double Dirac cone is induced by the accidental degeneracy of two double-degenerate Bloch states. Using a perturbation method, we demonstrate that the double Dirac cone is composed of two identical and overlapping Dirac cones whose linear slopes can also be accurately predicted from the method. Because the double Dirac cone occurs at a relatively low frequency, a slab of the PC can be mapped onto a slab of zero refractive index material by using a standard retrieval method. Total transmission without phase change and energy tunneling at the double Dirac point frequency are unambiguously demonstrated by two examples. Potential applications can be expected in diverse fields such as acoustic wave manipulations and energy flow control.
Remarkable reduction of thermal conductivity in phosphorene phononic crystal.
Xu, Wen; Zhang, Gang
2016-05-05
Phosphorene has received much attention due to its interesting physical and chemical properties, and its potential applications such as thermoelectricity. In thermoelectric applications, low thermal conductivity is essential for achieving a high figure of merit. In this work, we propose to reduce the thermal conductivity of phosphorene by adopting the phononic crystal structure, phosphorene nanomesh. With equilibrium molecular dynamics simulations, we find that the thermal conductivity is remarkably reduced in the phononic crystal. Our analysis shows that the reduction is due to the depressed phonon group velocities induced by Brillouin zone folding, and the reduced phonon lifetimes in the phononic crystal. Interestingly, it is found that the anisotropy ratio of thermal conductivity could be tuned by the 'non-square' pores in the phononic crystal, as the phonon group velocities in the direction with larger projection of pores is more severely suppressed, leading to greater reduction of thermal conductivity in this direction. Our work provides deep insight into thermal transport in phononic crystals and proposes a new strategy to reduce the thermal conductivity of monolayer phosphorene.
Band structures in fractal grading porous phononic crystals
Wang, Kai; Liu, Ying; Liang, Tianshu; Wang, Bin
2018-05-01
In this paper, a new grading porous structure is introduced based on a Sierpinski triangle routine, and wave propagation in this fractal grading porous phononic crystal is investigated. The influences of fractal hierarchy and porosity on the band structures in fractal graidng porous phononic crystals are clarified. Vibration modes of unit cell at absolute band gap edges are given to manifest formation mechanism of absolute band gaps. The results show that absolute band gaps are easy to form in fractal structures comparatively to the normal ones with the same porosity. Structures with higher fractal hierarchies benefit multiple wider absolute band gaps. This work provides useful guidance in design of fractal porous phononic crystals.
Weyl points and Fermi arcs in a chiral phononic crystal
Li, Feng; Huang, Xueqin; Lu, Jiuyang; Ma, Jiahong; Liu, Zhengyou
2018-01-01
Topological semimetals are materials whose band structure contains touching points that are topologically nontrivial and can host quasiparticle excitations that behave as Dirac or Weyl fermions. These so-called Weyl points not only exist in electronic systems, but can also be found in artificial periodic structures with classical waves, such as electromagnetic waves in photonic crystals and acoustic waves in phononic crystals. Due to the lack of spin and a difficulty in breaking time-reversal symmetry for sound, however, topological acoustic materials cannot be achieved in the same way as electronic or optical systems. And despite many theoretical predictions, experimentally realizing Weyl points in phononic crystals remains challenging. Here, we experimentally realize Weyl points in a chiral phononic crystal system, and demonstrate surface states associated with the Weyl points that are topological in nature, and can host modes that propagate only in one direction. As with their photonic counterparts, chiral phononic crystals bring topological physics to the macroscopic scale.
Energy Technology Data Exchange (ETDEWEB)
Kuleyev, I. G., E-mail: kuleev@imp.uran.ru; Kuleyev, I. I.; Bakharev, S. M.; Ustinov, V. V. [Russian Academy of Sciences, Institute of Metal Physics, Ural Branch (Russian Federation)
2016-09-15
We study the effect of anisotropy in elastic properties on the electron–phonon drag and thermoelectric phenomena in gapless semiconductors with degenerate charge-carrier statistics. It is shown that phonon focusing leads to a number of new effects in the drag thermopower at low temperatures, when diffusive phonon scattering from the boundaries is the predominant relaxation mechanism. We analyze the effect of phonon focusing on the dependences of the thermoelectromotive force (thermopower) in HgSe:Fe crystals on geometric parameters and the heat-flow directions relative to the crystal axes in the Knudsen regime of the phonon gas flow. The crystallographic directions that ensure the maximum and minimum values of the thermopower are determined and the role of quasi-longitudinal and quasi-transverse phonons in the drag thermopower in HgSe:Fe crystals at low temperatures is analyzed. It is shown that the main contribution to the drag thermopower comes from slow quasi-transverse phonons in the directions of focusing in long samples.
Phonon interactions with methyl radicals in single crystals
Directory of Open Access Journals (Sweden)
James W. Wells
2017-04-01
Full Text Available The high temperature ESR spectra’s anomalous appearance at very low temperatures for the methyl radical created in single crystals is explained by magnetic dipole interactions with neighboring protons. These protons acting via phonon vibrations induce resonant oscillations with the methyl group to establish a very temperature sensitive ‘‘relaxation’’ mode that allows the higher energy ‘‘E’’ state electrons with spin 12 to ‘‘decay’’ into ‘‘A’’ spin 12 states. Because of the amplitude amplification with temperature, the ‘‘E’’ state population is depleted and the ‘‘A’’ state population augmented to produce the high temperature ESR spectrum. This phenomenon is found to be valid for all but the very highest barriers to methyl group tunneling. In support, a time dependent spin population study shows this temperature evolution in the state populations under this perturbation.
One-dimensional hypersonic phononic crystals.
Gomopoulos, N; Maschke, D; Koh, C Y; Thomas, E L; Tremel, W; Butt, H-J; Fytas, G
2010-03-10
We report experimental observation of a normal incidence phononic band gap in one-dimensional periodic (SiO(2)/poly(methyl methacrylate)) multilayer film at gigahertz frequencies using Brillouin spectroscopy. The band gap to midgap ratio of 0.30 occurs for elastic wave propagation along the periodicity direction, whereas for inplane propagation the system displays an effective medium behavior. The phononic properties are well captured by numerical simulations. The porosity in the silica layers presents a structural scaffold for the introduction of secondary active media for potential coupling between phonons and other excitations, such as photons and electrons.
Phononic crystals with one-dimensional defect as sensor materials
Aly, Arafa H.; Mehaney, Ahmed
2017-09-01
Recently, sensor technology has attracted great attention in many fields due to its importance in many engineering applications. In the present work, we introduce a study using the innovative properties of phononic crystals in enhancing a new type of sensors based on the intensity of transmitted frequencies inside the phononic band gaps. Based on the transfer matrix method and Bloch theory, the expressions of the reflection coefficient and dispersion relation are presented. Firstly, the influences of filling fraction ratio and the angle of incidence on the band gap width are discussed. Secondly, the localization of waves inside band gaps is discussed by enhancing the properties of the defected phononic crystal. Compared to the periodic structure, localization modes involved within the band structure of phononic crystals with one and two defect layers are presented and compared. Trapped localized modes can be detected easily and provide more information about defected structures. Such method could increase the knowledge of manufacturing defects by measuring the intensity of propagated waves in the resonant cavities and waveguides. Moreover, several factors enhance the role of the defect layer on the transmission properties of defected phononic crystals are presented. The acoustic band gap can be used to detect or sense the type of liquids filling the defect layer. The liquids make specific resonant modes through the phononic band gaps that related to the properties of each liquid. The frequency where the maximum resonant modes occur is correlated to material properties and allows to determine several parameters such as the type of an unknown material.
Subwavelength waveguiding of surface phonons in pillars-based phononic crystal
Directory of Open Access Journals (Sweden)
Mahmoud Addouche
2014-12-01
Full Text Available In this study, we theoretically analyze the guiding of surface phonons through locally resonant defects in pillars-based phononic crystal. Using finite element method, we simulate the propagation of surface phonons through a periodic array of cylindrical pillars deposited on a semi-infinite substrate. This structure displays several band gaps, some of which are due to local resonances of the pillar. By introducing pillar defects inside the phononic structure, we show the possibility to perform a waveguiding of surface phonons based on two mechanisms that spatially confine the elastic energy in very small waveguide apertures. A careful choice of the height of the defect pillars, allows to shift the frequency position of the defect modes inside or outside the locally resonant band gaps and create two subwavelenght waveguiding mechanisms. The first is a classical mechanism that corresponds to the presence of the defect modes inside the locally resonant band gap. The seconde is due to the hybridation between the phonon resonances of defect modes and the surface phonons of the semi-infinite homogenous medium. We discuss the nature and the difference between both waveguiding phenomena.
Soft phononic crystals with deformation-independent band gaps
Zhang, Pu; Parnell, William J.
2017-04-01
Soft phononic crystals have the advantages over their stiff counterparts of being flexible and reconfigurable. Normally, the band gaps of soft phononic crystals will be modified after deformation due to both geometric and constitutive nonlinearity. Indeed these are important properties that can be exploited to tune the dynamic properties of the material. However, in some instances, it may be that one wishes to deform the medium while retaining the band gap structure. A special class of soft phononic crystals is described here with band gaps that are independent or almost-independent of the imposed mechanical deformation, which enables the design of phononic crystals with robust performance. This remarkable behaviour originates from transformation elasticity theory, which leaves the wave equation and the eigenfrequencies invariant after deformation. The necessary condition to achieve such a property is that the Lagrangian elasticity tensor of the hyperelastic material should be constant, i.e. independent of deformation. It is demonstrated that incompressible neo-Hookean materials exhibit such a unique property. Semilinear materials also possess this property under special loading conditions. Phononic crystals composed of these two materials are studied theoretically and the predictions of invariance, or the manner in which the response deviates from invariance, are confirmed via numerical simulation.
Integrated phononic crystal resonators based on adiabatically-terminated phononic crystal waveguides
Directory of Open Access Journals (Sweden)
Razi Dehghannasiri
2016-12-01
Full Text Available In this letter, we demonstrate a new design for integrated phononic crystal (PnC resonators based on confining acoustic waves in a heterogeneous waveguide-based PnC structure. In this architecture, a PnC waveguide that supports a single mode at the desired resonance frequencies is terminated by two waveguide sections with no propagating mode at those frequencies (i.e., have mode gap. The proposed PnC resonators are designed through combining the spatial-domain and the spatial-frequency domain (i.e., the k-domain analysis to achieve a smooth mode envelope. This design approach can benefit both membrane-based and surface-acoustic-wave-based architectures by confining the mode spreading in k-domain that leads to improved electromechanical excitation/detection coupling and reduced loss through propagating bulk modes.
Phonon Spectrum Engineering in Rolled-up Micro- and Nano-Architectures
Directory of Open Access Journals (Sweden)
Vladimir M. Fomin
2015-10-01
Full Text Available We report on a possibility of efficient engineering of the acoustic phonon energy spectrum in multishell tubular structures produced by a novel high-tech method of self-organization of micro- and nano-architectures. The strain-driven roll-up procedure paved the way for novel classes of metamaterials such as single semiconductor radial micro- and nano-crystals and multi-layer spiral micro- and nano-superlattices. The acoustic phonon dispersion is determined by solving the equations of elastodynamics for InAs and GaAs material systems. It is shown that the number of shells is an important control parameter of the phonon dispersion together with the structure dimensions and acoustic impedance mismatch between the superlattice layers. The obtained results suggest that rolled up nano-architectures are promising for thermoelectric applications owing to a possibility of significant reduction of the thermal conductivity without degradation of the electronic transport.
Directory of Open Access Journals (Sweden)
Mao Liu
2015-01-01
Full Text Available A new two-dimensional locally resonant phononic crystal with microcavity structure is proposed. The acoustic wave band gap characteristics of this new structure are studied using finite element method. At the same time, the corresponding displacement eigenmodes of the band edges of the lowest band gap and the transmission spectrum are calculated. The results proved that phononic crystals with microcavity structure exhibited complete band gaps in low-frequency range. The eigenfrequency of the lower edge of the first gap is lower than no microcavity structure. However, for no microcavity structure type of quadrilateral phononic crystal plate, the second band gap disappeared and the frequency range of the first band gap is relatively narrow. The main reason for appearing low-frequency band gaps is that the proposed phononic crystal introduced the local resonant microcavity structure. This study provides a good support for engineering application such as low-frequency vibration attenuation and noise control.
Thermal characterization of nanoscale phononic crystals using supercell lattice dynamics
Directory of Open Access Journals (Sweden)
Bruce L. Davis
2011-12-01
Full Text Available The concept of a phononic crystal can in principle be realized at the nanoscale whenever the conditions for coherent phonon transport exist. Under such conditions, the dispersion characteristics of both the constitutive material lattice (defined by a primitive cell and the phononic crystal lattice (defined by a supercell contribute to the value of the thermal conductivity. It is therefore necessary in this emerging class of phononic materials to treat the lattice dynamics at both periodicity levels. Here we demonstrate the utility of using supercell lattice dynamics to investigate the thermal transport behavior of three-dimensional nanoscale phononic crystals formed from silicon and cubic voids of vacuum. The periodicity of the voids follows a simple cubic arrangement with a lattice constant that is around an order of magnitude larger than that of the bulk crystalline silicon primitive cell. We consider an atomic-scale supercell which incorporates all the details of the silicon atomic locations and the void geometry. For this supercell, we compute the phonon band structure and subsequently predict the thermal conductivity following the Callaway-Holland model. Our findings dictate that for an analysis based on supercell lattice dynamics to be representative of the properties of the underlying lattice model, a minimum supercell size is needed along with a minimum wave vector sampling resolution. Below these minimum values, a thermal conductivity prediction of a bulk material based on a supercell will not adequately recover the value obtained based on a primitive cell. Furthermore, our results show that for the relatively small voids and void spacings we consider (where boundary scattering is dominant, dispersion at the phononic crystal unit cell level plays a noticeable role in determining the thermal conductivity.
Topology optimization of two-dimensional asymmetrical phononic crystals
Energy Technology Data Exchange (ETDEWEB)
Dong, Hao-Wen [Institute of Engineering Mechanics, Beijing Jiaotong University, Beijing 100044 (China); Su, Xiao-Xing [School of Electronic and Information Engineering, Beijing Jiaotong University, Beijing 100044 (China); Wang, Yue-Sheng, E-mail: yswang@bjtu.edu.cn [Institute of Engineering Mechanics, Beijing Jiaotong University, Beijing 100044 (China); Zhang, Chuanzeng [Department of Civil Engineering, University of Siegen, D-57068 Siegen (Germany)
2014-01-17
The multiple elitist genetic algorithm with the adaptive fuzzy fitness granulation (AFFG) is used to design the phononic crystals with large relative bandgap width (BGW) for combined out-of-plane and in-plane wave modes. Without assumption on the symmetry of the unit-cell, we obtain an asymmetrical phononic crystal with the relative BGW which is quite larger than that of the optimized symmetrical structure. With the help of AFFG, the number of the fitness function evaluations is reduced by over 50% and the procedure converges 5 times faster than the conventional evolutionary algorithm to reach the same final fitness values.
Band structures and localization properties of aperiodic layered phononic crystals
Energy Technology Data Exchange (ETDEWEB)
Yan Zhizhong, E-mail: zzyan@bit.edu.cn [Department of Applied Mathematics, Beijing Institute of Technology, Beijing 100081 (China); Zhang Chuanzeng [Department of Civil Engineering, University of Siegen, D-57078 Siegen (Germany)
2012-03-15
The band structures and localization properties of in-plane elastic waves with coupling of longitudinal and transverse modes oblique propagating in aperiodic phononic crystals based on Thue-Morse and Rudin-Shapiro sequences are studied. Using transfer matrix method, the concept of the localization factor is introduced and the correctness is testified through the Rytov dispersion relation. For comparison, the perfect periodic structure and the quasi-periodic Fibonacci system are also considered. In addition, the influences of the random disorder, local resonance, translational and/or mirror symmetries on the band structures of the aperiodic phononic crystals are analyzed in this paper.
Phonon spectrum, mechanical and thermophysical properties of thorium carbide
Energy Technology Data Exchange (ETDEWEB)
Pérez Daroca, D., E-mail: pdaroca@tandar.cnea.gov.ar [Gerencia de Investigación y Aplicaciones, Comisión Nacional de Energía Atómica (Argentina); Consejo Nacional de Investigaciones Cientı´ficas y Técnicas (Argentina); Jaroszewicz, S. [Gerencia de Investigación y Aplicaciones, Comisión Nacional de Energía Atómica (Argentina); Instituto de Tecnología Jorge A. Sabato, UNSAM-CNEA (Argentina); Llois, A.M. [Gerencia de Investigación y Aplicaciones, Comisión Nacional de Energía Atómica (Argentina); Consejo Nacional de Investigaciones Cientı´ficas y Técnicas (Argentina); Mosca, H.O. [Gerencia de Investigación y Aplicaciones, Comisión Nacional de Energía Atómica (Argentina); Instituto de Tecnología Jorge A. Sabato, UNSAM-CNEA (Argentina)
2013-06-15
In this work, we study, by means of density functional perturbation theory and the pseudopotential method, mechanical and thermophysical properties of thorium carbide. These properties are derived from the lattice dynamics in the quasi-harmonic approximation. The phonon spectrum of ThC presented in this article, to the best authors’ knowledge, have not been studied, neither experimentally, nor theoretically. We compare mechanical properties, volume thermal expansion and molar specific capacities with previous results and find a very good agreement.
Peculiarities of the phonon spectrum of InxGa1-xAs epitaxial layers
International Nuclear Information System (INIS)
Solov'eva, E.V.; Gogaladze, D.T.; Belogorokhov, A.N.
1991-01-01
Consideration is given to results of investigation of In 053 Ga 0.47 As epitaxial layers, oriented in (100) plane and grown in 750-550 deg C range. Reguliarities of change of phonon spectrum, representing a sensitive function of the character of atom distribution in crystal lattice and forces of their interaction, were studied. It is shown that change of crystallization temperature leads to change of the character of distribution of solid solution components: from chaotic one (at 750 deg C) through ordering to clustering
Phonon spectrum of lead oxychloride Pb3O2Cl2: Ab initio calculation and experiment
Zakir'yanov, D. O.; Chernyshev, V. A.; Zakir'yanova, I. D.
2016-02-01
IR and Raman spectra of Pb3O2Cl2 in the range of 50-600 cm-1 have been detected for the first time. Ab initio calculations of the crystal structure and the phonon spectrum of Pb3O2Cl2 in the framework of LCAO approach have been performed by the Hartree-Fock method and in the framework of the density functional theory with the use of hybrid functionals. The results of calculations have made it possible to interpret the experimental vibration spectra and reveal silent modes, which do not manifest themselves in these spectra but influence the optical properties of the crystal.
A new hybrid phononic crystal in low frequencies
Energy Technology Data Exchange (ETDEWEB)
Zhang, Z., E-mail: zhangz@dlut.edu.cn; Han, X.K.
2016-11-25
A novel hybrid phononic crystal is designed to obtain wider band gaps in low frequency range. The hybrid phononic crystal consists of rubber slab with periodic holes and plumbum stubs. In comparison with the phononic crystal without periodic holes, the new designed phononic crystal can obtain wider band gaps and better vibration damping characteristics. The wider band gap can be attributed to the interaction of local resonance and Bragg scattering. The controlling of the BG is explained by the strain energy of the hybrid PC and the introduced effective mass. The effects of the geometrical parameters and the shapes of the stubs and holes on the controlling of waves are further studied. - Highlights: • A novel hybrid PC structure is proposed in current work. The new designed hybrid PC shows wider BG in low frequency range and better vibration damping characteristics. • Strain energy and effective mass are introduced for the investigations on the mechanism of the controlling of BGs in PC structure. • The effects of the geometrical parameters and the shapes of the stubs and holes on the controlling of waves are further studied for optimal design.
Phonon-enhanced crystal growth and lattice healing
Buonassisi, Anthony; Bertoni, Mariana; Newman, Bonna
2013-05-28
A system for modifying dislocation distributions in semiconductor materials is provided. The system includes one or more vibrational sources for producing at least one excitation of vibrational mode having phonon frequencies so as to enhance dislocation motion through a crystal lattice.
Nonlinear Phononic Periodic Structures and Granular Crystals
2012-02-10
in crystalline solids. Physical Review B, 2001. 64(6): p. 064302. 18. Maris, H.J. and S. Tamura, Propagation of acoustic phonon solitons in... mathematics . American Scientist, 2009. 97(6). 28. Duncan, D.B., et al., SOLITONS ON LATTICES. Physica D, 1993. 68(1): p. 1-11. 29. Kartashov, Y.V., B.A...Malomed, and L. Torner, Solitons in nonlinear lattices. Reviews of Modern Physics , 2011. 83(1): p. 247. 30. Kevrekidis, P.G., Non-linear waves in
Photon control of phonons in mixed crystal quantum dots
Energy Technology Data Exchange (ETDEWEB)
Ingale, Alka
2003-12-15
Coherent phonon oscillations in solids can be excited impulsively by a single femtosecond laser pulse whose duration is shorter than a phonon period. In the impulsive stimulated Raman scattering (ISRS) experiment, scattering of probe is monitored as a function of time with respect to pump to generate time domain spectra of coherent phonons. In this paper, we present one such study of CdSe{sub 0.68}Te{sub 0.32} (d{approx}80 A) quantum dots in glass matrix, i.e semiconductor-doped glass (SDG) RG780 from Schott, USA and the experiment was performed at Prof. Merlin's laboratory at the University of Michigan, USA. Here, we present first report of selectively driving only CdSe-like modes in these mixed crystal quantum dots using photon control with two pump beams.
Cavity-type hypersonic phononic crystals
International Nuclear Information System (INIS)
Sato, A; Fytas, G; Pennec, Y; Djafari-Rouhani, B; Yanagishita, T; Masuda, H; Knoll, W
2012-01-01
We report on the engineering of the phonon dispersion diagram in monodomain anodic porous alumina (APA) films through the porosity and physical state of the material residing in the nanopores. Lattice symmetry and inclusion materials are theoretically identified to be the main factors which control the hypersonic acoustic wave propagation. This involves the interaction between the longitudinal and the transverse modes in the effective medium and a flat band characteristic of the material residing in the cavities. Air and filled nanopores, therefore, display markedly different dispersion relations and the inclusion materials lead to a locally resonant structural behavior uniquely determining their properties under confinement. APA films emerge as a new platform to investigate the rich acoustic phenomena of structured composite matter. (paper)
Designing Phononic Crystals with Wide and Robust Band Gaps
Jia, Zian; Chen, Yanyu; Yang, Haoxiang; Wang, Lifeng
2018-04-01
Phononic crystals (PnCs) engineered to manipulate and control the propagation of mechanical waves have enabled the design of a range of novel devices, such as waveguides, frequency modulators, and acoustic cloaks, for which wide and robust phononic band gaps are highly preferable. While numerous PnCs have been designed in recent decades, to the best of our knowledge, PnCs that possess simultaneous wide and robust band gaps (to randomness and deformations) have not yet been reported. Here, we demonstrate that by combining the band-gap formation mechanisms of Bragg scattering and local resonances (the latter one is dominating), PnCs with wide and robust phononic band gaps can be established. The robustness of the phononic band gaps are then discussed from two aspects: robustness to geometric randomness (manufacture defects) and robustness to deformations (mechanical stimuli). Analytical formulations further predict the optimal design parameters, and an uncertainty analysis quantifies the randomness effect of each designing parameter. Moreover, we show that the deformation robustness originates from a local resonance-dominant mechanism together with the suppression of structural instability. Importantly, the proposed PnCs require only a small number of layers of elements (three unit cells) to obtain broad, robust, and strong attenuation bands, which offer great potential in designing flexible and deformable phononic devices.
Designing Phononic Crystals with Wide and Robust Band Gaps
Energy Technology Data Exchange (ETDEWEB)
Chen, Yanyu [National Renewable Energy Laboratory (NREL), Golden, CO (United States); Jia, Zian [State University of New York at Stony Brook; Yang, Haoxiang [State University of New York at Stony Brook; Wang, Lifeng [State University of New York at Stony Brook
2018-04-16
Phononic crystals (PnCs) engineered to manipulate and control the propagation of mechanical waves have enabled the design of a range of novel devices, such as waveguides, frequency modulators, and acoustic cloaks, for which wide and robust phononic band gaps are highly preferable. While numerous PnCs have been designed in recent decades, to the best of our knowledge, PnCs that possess simultaneous wide and robust band gaps (to randomness and deformations) have not yet been reported. Here, we demonstrate that by combining the band-gap formation mechanisms of Bragg scattering and local resonances (the latter one is dominating), PnCs with wide and robust phononic band gaps can be established. The robustness of the phononic band gaps are then discussed from two aspects: robustness to geometric randomness (manufacture defects) and robustness to deformations (mechanical stimuli). Analytical formulations further predict the optimal design parameters, and an uncertainty analysis quantifies the randomness effect of each designing parameter. Moreover, we show that the deformation robustness originates from a local resonance-dominant mechanism together with the suppression of structural instability. Importantly, the proposed PnCs require only a small number of layers of elements (three unit cells) to obtain broad, robust, and strong attenuation bands, which offer great potential in designing flexible and deformable phononic devices.
Tunable topological phases in photonic and phononic crystals
Chen, Zeguo
2018-02-18
Topological photonics/phononics, inspired by the discovery of topological insulators, is a prosperous field of research, in which remarkable one-way propagation edge states are robust against impurities or defect without backscattering. This dissertation discusses the implementation of multiple topological phases in specific designed photonic and phononic crystals. First, it reports a tunable quantum Hall phase in acoustic ring-waveguide system. A new three-band model focused on the topological transitions at the Γ point is studied, which gives the functionality that nontrivial topology can be tuned by changing the strengths of the couplings and/or the broken time-reversal symmetry. The resulted tunable topological edge states are also numerically verified. Second, based on our previous studied acoustic ring-waveguide system, we introduce anisotropy by tuning the couplings along different directions. We find that the bandgap topology is related to the frequency and directions. We report our proposal on a frequency filter designed from such an anisotropic topological phononic crystal. Third, motivated by the recent progress on quantum spin Hall phases, we propose a design of time-reversal symmetry broken quantum spin Hall insulators in photonics, in which a new quantum anomalous Hall phase emerges. It supports a chiral edge state with certain spin orientations, which is robust against the magnetic impurities. We also report the realization of the quantum anomalous Hall phase in phononics.
Band structures in Sierpinski triangle fractal porous phononic crystals
Energy Technology Data Exchange (ETDEWEB)
Wang, Kai; Liu, Ying, E-mail: yliu5@bjtu.edu.cn; Liang, Tianshu
2016-10-01
In this paper, the band structures in Sierpinski triangle fractal porous phononic crystals (FPPCs) are studied with the aim to clarify the effect of fractal hierarchy on the band structures. Firstly, one kind of FPPCs based on Sierpinski triangle routine is proposed. Then the influence of the porosity on the elastic wave dispersion in Sierpinski triangle FPPCs is investigated. The sensitivity of the band structures to the fractal hierarchy is discussed in detail. The results show that the increase of the hierarchy increases the sensitivity of ABG (Absolute band gap) central frequency to the porosity. But further increase of the fractal hierarchy weakens this sensitivity. On the same hierarchy, wider ABGs could be opened in Sierpinski equilateral triangle FPPC; whilst, a lower ABG could be opened at lower porosity in Sierpinski right-angled isosceles FPPCs. These results will provide a meaningful guidance in tuning band structures in porous phononic crystals by fractal design.
Lumped model for rotational modes in phononic crystals
Peng, Pai
2012-10-16
We present a lumped model for the rotational modes induced by the rotational motion of individual scatterers in two-dimensional phononic crystals comprised of square arrays of solid cylindrical scatterers in solid hosts. The model provides a physical interpretation of the origin of the rotational modes, reveals the important role played by the rotational motion in determining the band structure, and reproduces the dispersion relations in a certain range. The model increases the possibilities of manipulating wave propagation in phononic crystals. In particular, expressions derived from the model for eigenfrequencies at high symmetry points unambiguously predict the presence of a new type of Dirac-like cone at the Brillouin center, which is found to be the result of accidental degeneracy of the rotational and dipolar modes.
Tri-component phononic crystals for underwater anechoic coatings
International Nuclear Information System (INIS)
Zhao, Honggang; Liu, Yaozong; Wen, Jihong; Yu, Dianlong; Wen, Xisen
2007-01-01
Localized resonance in phononic crystal, composed of three-dimensional arrays of composite units, has been discovered recently. The composite unit is a high-density sphere coated by soft silicon rubber. In this Letter, the absorptive properties induced by the localized resonance are systemically investigated. The mode conversions during the Mie scattering of a single coated lead sphere in unbounded epoxy are analyzed by referring the elements of the scattering matrix. Then the anechoic properties of a slab containing a plane of such composite scatterers are investigated with the multiple-scattering method by accounting the effects of the multiple scattering and the viscous dissipation. The results show that the longitudinal to transverse mode conversion nearby the locally resonant region is an effective way to enhance the anechoic performance of the finite slab of phononic crystal. Then, the influences of the viscoelasticity of the silicon rubber and the coating thickness on the acoustic properties of the finite slab are investigated for anechoic optimization. Finally, we synthetically consider the destructive scattering in the finite slab of phononic crystal and the backing, and design an anechoic slab composed of bi-layer coated spheres. The results show that the most of the incident energy is absorbed at the desired frequency band
Analysis of Bending Waves in Phononic Crystal Beams with Defects
Directory of Open Access Journals (Sweden)
Yongqiang Guo
2018-01-01
Full Text Available Existing investigations on imperfect phononic crystal beams mainly concern periodic multi-span beams carrying either one or two channel waves with random or deterministic disorder in span-length. This paper studies the two channel bending waves in phononic crystal beams consisting of many phases of materials with defects introduced as one structural segment having different cross-sectional dimensions or material parameters. The method of reverberation-ray matrix (MRRM based on the Timoshenko beam theory, which can conduct high-frequency analysis, is extended for the theoretical analysis of dispersion and transmission of bending waves. The supercell technique and the Floquet–Bloch theorem are adopted for modeling the dispersion characteristics, and the whole finite structural model is used to calculate the transmission spectra. Experimental measurements and numerical calculations are provided to validate the displacement transmission obtained by the proposed MRRM, with the effect of damping on transmission spectra being concerned. The high-frequency calculation applicability of the proposed MRRM is also confirmed by comparing the present results with the corresponding ones either using the transfer matrix method (TMM or MRRM based on Euler—Bernoulli beam theory. The influences of defect size, defect form, and unit-cell number on the transmission spectra and the band structures are discussed. The drawn conclusions may be useful for designing or evaluating the defected phononic crystal beams in bending wave control. In addition, our conclusions are especially potential for identifying the defect location through bending wave signals.
Thermal transport in phononic crystals: The role of zone folding effect
Dechaumphai, Edward; Chen, Renkun
2012-04-01
Recent experiments [Yu et al., Nature Nanotech 5, 718 (2010); Tang et al., Nano Lett. 10, 4279 (2010); Hopkins etal., Nano Lett. 11, 107(2011)] on silicon based nanoscale phononic crystals demonstrated substantially reduced thermal conductivity compared to bulk Si, which cannot be explained by incoherent phonon boundary scattering within the Boltzmann Transport Equation (BTE). In this paper, partial coherent treatment of phonons, where phonons are regarded as either wave or particles depending on their frequencies, was considered. Phonons with mean free path smaller than the characteristic size of phononic crystals are treated as particles and the transport in this regime is modeled by BTE with phonon boundary scattering taken into account. On the other hand, phonons with mean free path longer than the characteristic size are treated as waves. In this regime, phonon dispersion relations are computed using the Finite Difference Time Domain (FDTD) method and are found to be modified due to the zone folding effect. The new phonon spectra are then used to compute phonon group velocity and density of states for thermal conductivity modeling. Our partial coherent model agrees well with the recent experimental results on in-plane thermal conductivity of phononic crystals. Our study highlights the importance of zone folding effect on thermal transport in phononic crystals.
Jin, Jae Sik
2017-03-01
Phonon dynamics in nanostructures is critically important to thermoelectric and optoelectronic devices because it determines the transport and other crucial properties. However, accurately evaluating the phonon lifetimes is extremely difficult. This study reports on the development of a new semi-empirical method to estimate the full-spectrum phonon lifetimes in thin silicon films at room temperature based on the experimental data on the phonon mean-free-path spectrum in bulk silicon and a phenomenological consideration of phonon transport in thin films. The bulk of this work describes the theory and the validation; then, we discuss the trend of the phonon lifetimes in thin silicon films when their thicknesses decrease.
International Nuclear Information System (INIS)
Wen Jihong; Yu, Dianlong; Wang Gang; Zhao Honggang; Liu Yaozong; Wen Xisen
2007-01-01
The directional propagation characteristics of elastic wave during pass bands in two-dimensional thin plate phononic crystals are analyzed by using the lumped-mass method to yield the phase constant surface. The directions and regions of wave propagation in phononic crystals for certain frequencies during pass bands are predicted with the iso-frequency contour lines of the phase constant surface, which are then validated with the harmonic responses of a finite two-dimensional thin plate phononic crystals with 16x16 unit cells. These results are useful for controlling the wave propagation in the pass bands of phononic crystals
Observation of surface-guided waves in holey hypersonic phononic crystal
Benchabane, Sarah; Gaiffe, Olivier; Ulliac, Gwenn; Salut, Roland; Achaoui, Younes; Laude, Vincent
2011-04-01
We observe experimentally the propagation of surface-guided waves in a hypersonic phononic crystal, both in the radiative and nonradiative regions of the spectrum. Combining electrical measurements in reflection and transmission as well as optical maps of the surface displacement, a band gap extending from 0.6 to 0.95 GHz is identified in a square lattice array of 1 μm radius air holes milled in lithium niobate. The optical measurements reveal the transmission of surface-guided waves above the band gap, well inside the sound cone.
Tc, 2Δ0/KBTc and parameters of phonon spectrum for amorphous superconductors
International Nuclear Information System (INIS)
Cao Xiaowen
1987-04-01
After the correlations between superconducting parameters T C and 2Δ 0 , the parameters of the phonon spectrum, λ, , 2 > and Hall coefficient R H and between the superconducting T C and the parameters of the phonon spectrum ω 0 and /ω 0 were researched analytically. It had been found that there is a maximum of the above-mentioned both superconducting and the phonon spectrum parameters in the region of R H = -3.5 to -4.0 x 10 -11 m 3 /AS and that the materials having high ω 0 is favourable to obtain amorphous superconductors with high T C as well as that the relation between T C and the degree of the lattice disorder (i.e. /ω 0 value) is linear. On the basis of the above-mentioned results, a formula of T C and 2Δ 0 /k B T C of amorphous superconductors had been given. According to both proposed formula, it is noted for the first time that amorphous superconductor of the non-transition metals and their alloys is either a typical strong coupling superconductor which has a much larger 2 Δ 0 /k B T C than BCS theory or a extreme weak coupling superconductor which has a much smaller 2 Δ 0 /k B T C than BCS theory. Of coures, they can be also a weak coupling superconductor whose 2 Δ 0 /k B T C is consistent with BCS theory or approximate to one. The reason that the measurement value of 2 Δ 0 /k BTC of the weak coupling superconductors in the crystal state deviates obviously from BCS theory has been explained
Asymptotic Analysis of High-Contrast Phononic Crystals and a Criterion for the Band-Gap Opening
Ammari, H.; Kang, H.; Lee, H.
2006-01-01
We investigate the band-gap structure of the frequency spectrum for elastic waves in a high-contrast, two-component periodic elastic medium. We consider two-dimensional phononic crystals consisting of a background medium which is perforated by an array of holes periodic along each of the two orthogonal coordinate axes. In this paper we establish a full asymptotic formula for dispersion relations of phononic band structures as the contrast of the shear modulus and that of the density become la...
Topological Design of Cellular Phononic Band Gap Crystals.
Li, Yang Fan; Huang, Xiaodong; Zhou, Shiwei
2016-03-10
This paper systematically investigated the topological design of cellular phononic crystals with a maximized gap size between two adjacent bands. Considering that the obtained structures may sustain a certain amount of static loadings, it is desirable to ensure the optimized designs to have a relatively high stiffness. To tackle this issue, we conducted a multiple objective optimization to maximize band gap size and bulk or shear modulus simultaneously with a prescribed volume fraction of solid material so that the resulting structures can be lightweight, as well. In particular, we first conducted the finite element analysis of the phononic band gap crystals and then adapted a very efficient optimization procedure to resolve this problem based on bi-directional evolutionary structure optimization (BESO) algorithm in conjunction with the homogenization method. A number of optimization results for maximizing band gaps with bulk and shear modulus constraints are presented for out-of-plane and in-plane modes. Numerical results showed that the optimized structures are similar to those obtained for composite case, except that additional slim connections are added in the cellular case to support the propagation of shear wave modes and meanwhile to satisfy the prescribed bulk or shear modulus constraints.
Topological Design of Cellular Phononic Band Gap Crystals
Directory of Open Access Journals (Sweden)
Yang Fan Li
2016-03-01
Full Text Available This paper systematically investigated the topological design of cellular phononic crystals with a maximized gap size between two adjacent bands. Considering that the obtained structures may sustain a certain amount of static loadings, it is desirable to ensure the optimized designs to have a relatively high stiffness. To tackle this issue, we conducted a multiple objective optimization to maximize band gap size and bulk or shear modulus simultaneously with a prescribed volume fraction of solid material so that the resulting structures can be lightweight, as well. In particular, we first conducted the finite element analysis of the phononic band gap crystals and then adapted a very efficient optimization procedure to resolve this problem based on bi-directional evolutionary structure optimization (BESO algorithm in conjunction with the homogenization method. A number of optimization results for maximizing band gaps with bulk and shear modulus constraints are presented for out-of-plane and in-plane modes. Numerical results showed that the optimized structures are similar to those obtained for composite case, except that additional slim connections are added in the cellular case to support the propagation of shear wave modes and meanwhile to satisfy the prescribed bulk or shear modulus constraints.
Acoustic waveguiding in a silicon carbide phononic crystals at microwave frequencies
Ghasemi Baboly, M.; Reinke, C. M.; Griffin, B. A.; El-Kady, I.; Leseman, Z. C.
2018-03-01
Two dimensional SiC-air phononic crystals have been modeled, fabricated, and tested with a measured bandgap ranging from 665 to 693 MHz. Snowflake air inclusions on a hexagonal lattice were used for the phononic crystal. By manipulating the phononic crystal lattice and inserting circular inclusions, a waveguide was created at 680 MHz. The combined insertion loss and propagation loss for the waveguide is 8.2 dB, i.e., 39% of the energy is guided due to the high level of the confinement afforded by the phononic crystal. The SiC-air phononic crystals and waveguides were fabricated using a CMOS-compatible process, which allows for seamless integration of these devices into wireless communication systems operating at microwave frequencies.
Parylene-C microfibrous thin films as phononic crystals
Chindam, Chandraprakash; Lakhtakia, Akhlesh; Awadelkarim, Osama O.
2017-07-01
Phononic bandgaps of Parylene-C microfibrous thin films ( μ\\text{FTF} s) were computationally determined by treating them as phononic crystals comprising identical microfibers arranged either on a square or a hexagonal lattice. The microfibers could be columnar, chevronic, or helical in shape, and the host medium could be either water or air. All bandgaps were observed to lie in the 0.01-162.9-MHz regime, for microfibers of realistically chosen dimensions. The upper limit of the frequency of bandgaps was the highest for the columnar μ\\text{FTF} and the lowest for the chiral μ\\text{FTF} . More bandgaps exist when the host medium is water than air. Complete bandgaps were observed for the columnar μ\\text{FTF} with microfibers arranged on a hexagonal lattice in air, the chevronic μ\\text{FTF} with microfibers arranged on a square lattice in water, and the chiral μ\\text{FTF} with microfibers arranged on a hexagonal lattice in either air or water. The softness of the Parylene-C μ\\text{FTF} s makes them mechanically tunable, and their bandgaps can be exploited in multiband ultrasonic filters.
Topological design of phononic crystals for unidirectional acoustic transmission
Chen, Yafeng; Meng, Fei; Sun, Guangyong; Li, Guangyao; Huang, Xiaodong
2017-12-01
The realization of unidirectional acoustic transmission (UAT) has recently aroused great attention owing to the versatile possibility in acoustics-based applications. This paper extends the bi-directional evolutionary structural optimization (BESO) method to the design of phononic crystal (PC) for achieving UAT. The optimization objective is to enlarge the minimum imaginary part of wave vectors along Γ-X while keep that along Γ-M less than the constraint value. We systematically studied the design of symmetric and asymmetric PCs at various frequencies. Numerical examples demonstrate that the proposed optimization algorithm is effective for creating the partial band gap at the specified frequency. The UAT with high rectifying efficiency is then successfully realized by placing the optimized PC in a bend wave guide. The results also show that the asymmetric PCs are more favorable for the design of broadband UAT devices compared with symmetric ones.
Accidental degeneracy of double Dirac cones in a phononic crystal
Chen, Ze-Guo
2014-04-09
Artificial honeycomb lattices with Dirac cone dispersion provide a macroscopic platform to study the massless Dirac quasiparticles and their novel geometric phases. In this paper, a quadruple-degenerate state is achieved at the center of the Brillouin zone in a two-dimensional honeycomb lattice phononic crystal, which is a result of accidental degeneracy of two double-degenerate states. In the vicinity of the quadruple-degenerate state, the dispersion relation is linear. Such quadruple degeneracy is analyzed by rigorous representation theory of groups. Using method, a reduced Hamiltonian is obtained to describe the linear Dirac dispersion relations of this quadruple-degenerate state, which is well consistent with the simulation results. Near such accidental degeneracy, we observe some unique properties in wave propagating, such as defect-insensitive propagating character and the Talbot effect.
Multi-channel unidirectional transmission of phononic crystal heterojunctions
Xu, Zhenlong; Tong, Jie; Wu, Fugen
2018-02-01
Two square steel columns are arranged in air to form two-dimensional square lattice phononic crystals (PNCs). Two PNCs can be combined into a non-orthogonal 45∘ heterojunction when the difference in the directional band gaps of the two PNC types is utilized. The finite element method is used to calculate the acoustic band structure, the heterogeneous junction transmission characteristics, acoustic field distribution, and many others. Results show that a non-orthogonal PNC heterojunction can produce a multi-channel unidirectional transmission of acoustic waves. With the square scatterer rotated, the heterojunction can select a frequency band for unidirectional transmission performance. This capability is particularly useful for constructing acoustic diodes with wide-bands and high-efficiency unidirectional transmission characteristics.
Seismic isolation of buildings on two dimensional phononic crystal foundation
Han, Lin; Li, Xiao-mei; Zhang, Yan
2017-11-01
In order to realize the seismic isolation of buildings, we establish the two dimensional phononic crystal (PC) foundation which has the cell with the size close to the regular concrete test specimens, and is composed of the concrete base, rubber coating and lead cylindrical core. We study the in-plane band gap (BG) characteristics in it, through the analysis of the frequency dispersion relation and frequency response result. To lower the start BG frequency to the seismic frequency range, we also study the influences of material parameters (the elastic modulus of coating and density of cylindrical core) and geometry parameters (the thickness of coating, radius of cylindrical core and lattice constant) on BG ranges. The study could help to design the PC foundation for seismic isolation of building.
Acoustic frequency filter based on anisotropic topological phononic crystals
Chen, Zeguo
2017-11-02
We present a design of acoustic frequency filter based on a two-dimensional anisotropic phononic crystal. The anisotropic band structure exhibits either a directional or a combined (global + directional) bandgap at certain frequency regions, depending on the geometry. When the time-reversal symmetry is broken, it may introduce a topologically nontrivial bandgap. The induced nontrivial bandgap and the original directional bandgap result in various interesting wave propagation behaviors, such as frequency filter. We develop a tight-binding model to characterize the effective Hamiltonian of the system, from which the contribution of anisotropy is explicitly shown. Different from the isotropic cases, the Zeeman-type splitting is not linear and the anisotropic bandgap makes it possible to achieve anisotropic propagation characteristics along different directions and at different frequencies.
Acoustic cloaking by a near-zero-index phononic crystal
Zheng, Li-Yang
2014-04-21
Zero-refractive-index materials may lead to promising applications in various fields. Here, we design and fabricate a near Zero-Refractive-Index (ZRI) material using a phononic crystal (PC) composed of a square array of densely packed square iron rods in air. The dispersion relation exhibits a nearly flat band across the Brillouin zone at the reduced frequency f = 0.5443c/a, which is due to Fabry-Perot (FP) resonance. By using a retrieval method, we find that both the effective mass density and the reciprocal of the effective bulk modulus are close to zero at frequencies near the flat band. We also propose an equivalent tube network model to explain the mechanisms of the near ZRI effect. This FP-resonance-induced near ZRI material offers intriguing wave manipulation properties. We demonstrate both numerically and experimentally its ability to shield a scattering obstacle and guide acoustic waves through a bent structure.
Polar phonons and spin excitations coupling in multiferroic BiFeO3 crystals
Rovillain, P.; Cazayous, M.; Gallais, Y.; Sacuto, A.; Lobo, R. P. S. M.; Lebeugle, D.; Colson, D.
2009-01-01
Raman scattering measurements on BiFeO3 single crystals show an important coupling between the magnetic order and lattice vibrations. The temperature evolution of phonons shows that the lowest energy E and A1 phonon modes are coupled to the spin order up to the Neel temperature. Furthermore, low temperature anomalies associated with the spin re-orientation are observed simultaneously in both the E phonon and the magnon. These results suggest that magnetostriction plays an important role in Bi...
DEFF Research Database (Denmark)
Willatzen, Morten; Duggen, Lars
2017-01-01
In this paper we investigate theoretically the influence of piezoelectric coupling on phonon dispersion relations. Specifically we solve dispersion relations for a fully coupled zinc-blende freestanding quantum well for different orientations of the crystal unit cell. It is shown that the phonon...... mode density in GaAs can change by a factor of approximately 2–3 at qx a = 1 for different crystal-growth directions relative to the slab thickness direction. In particular, it is found that optical and acoustic phonon modes are always piezoelectrically coupled, independent of the crystal...... that the piezoelectric effect leads to a drastically enhanced coupling of acoustic and optical phonon modes and increase in the local phonon density of states near the plasma frequency where the permittivity approaches zero....
Crystal electric field-phonon interaction in NdCu2
International Nuclear Information System (INIS)
Hense, K.; Gratz, E.; Nowotny, H.; Loewenhaupt, M.; Hoser, A.
2004-01-01
A comparison of the crystal electric field (CF)-level schema of NdCu 2 and its measured phonon dispersion relation suggests that some of the phonon branches should show a measurable coupling with the CF. The presented inelastic neutron scattering data obtained from triple axis spectrometer measurements confirm this interaction. In addition, a theoretical model describing the experimental data is presented
Phonon spectrum in a nanoparticle mechanically coupled to a substrate
Patton, K.
2001-12-01
We calculate the vibrational density-of-states in an insulating nanoparticle that is in weak mechanical contact with a semi-infinite substrate. The work is motivated by a recent experiment by Yang et al., where the low-energy phonon density-of-states of Y2O3 nanoparticles doped with Eu was measured. Preliminary results presented here, based on the conventional quasiparticle-pole approximation for the phonon propagator, are in reasonable agreement with experiment.
Generation, detection and spectroscopic studies of high-frequency nonequilibrium phonons in crystals
International Nuclear Information System (INIS)
Dennis, W.M.; Yen, W.M.
2007-01-01
In this article we will review studies conducted in the past two decades on the dynamic properties of high-frequency (THz) phonons generated monochromatically with high power far infrared (FIR) laser pulses using defect-induced phonon absorption and detected using a vibronic sideband spectrometer fashioned after that devised by Kaplyanskii, the honoree of this special issue. The temporal and spectral evolution of the phonon signature provides information on the mechanisms that dominate the relaxation of high-frequency phonons in real crystals
Long, Yao; Chen, Jun
2018-01-01
We develop a method to calculate the local vibrational mode and phonon refraction probability of a 1,3,5-triamino-2,4,6-trinitrobenzene/graphite interface, and use them to evaluate the interfacial free energy, heat capacity and thermal conductivity. We find that the heat exchange across the interface is sensitive with five incident phonon states. The frequencies, vibrational modes, refraction angles and refraction probabilities of the sensitive states are calculated. The relationship between vibrational modes and thermodynamic properties at the interface is obtained.
Bloch wave deafness and modal conversion at a phononic crystal boundary
Directory of Open Access Journals (Sweden)
Vincent Laude
2011-12-01
Full Text Available We investigate modal conversion at the boundary between a homogeneous incident medium and a phononic crystal, with consideration of the impact of symmetry on the excitation of Bloch waves. We give a quantitative criterion for the appearance of deaf Bloch waves, which are antisymmetric with respect to a symmetry axis of the phononic crystal, in the frame of generalized Fresnel formulas for reflection and transmission at the phononic crystal boundary. This criterion is used to index Bloch waves in the complex band structure of the phononic crystal, for directions of incidence along a symmetry axis. We argue that within deaf frequency ranges transmission is multi-exponential, as it is within frequency band gaps.
Bloch wave deafness and modal conversion at a phononic crystal boundary
Laude, Vincent; Moiseyenko, Rayisa P.; Benchabane, Sarah; Declercq, Nico F.
2011-12-01
We investigate modal conversion at the boundary between a homogeneous incident medium and a phononic crystal, with consideration of the impact of symmetry on the excitation of Bloch waves. We give a quantitative criterion for the appearance of deaf Bloch waves, which are antisymmetric with respect to a symmetry axis of the phononic crystal, in the frame of generalized Fresnel formulas for reflection and transmission at the phononic crystal boundary. This criterion is used to index Bloch waves in the complex band structure of the phononic crystal, for directions of incidence along a symmetry axis. We argue that within deaf frequency ranges transmission is multi-exponential, as it is within frequency band gaps.
Stress Induced Phononic Properties and Surface Waves in 2D Model of Auxetic Crystal
International Nuclear Information System (INIS)
Trzupek, D.; Twarog, D.; Zielinski, P.
2009-01-01
Elastic stiffness parameters are determined in a 2D model system of rigid rods interacting by harmonic force constants. Any positive ('' normal '' crystal) or negative (auxetic crystal) Poisson ratio can be obtained in this model as a function of the external stress. Conditions for opening an absolute stop band (phononic crystal) and for various kinds of surface waves are obtained. (authors)
Peculiarities of FeSi phonon spectrum induced by a change of atomic volume
Energy Technology Data Exchange (ETDEWEB)
Parshin, P. P., E-mail: Parshin-PP@nrcki.ru, E-mail: neupar45@yandex.ru; Chumakov, A. I.; Alekseev, P. A. [National Research Center Kurchatov Institute (Russian Federation); Nemkovski, K. S. [Forschungszentrum Jülich GmbH, Jülich Centre for Neutron Sciences (JCNS), Heinz Maier-Leibnitz Zentrum (MLZ) (Germany); Dubrovinskii, L. [Universität Bazreuth, Bayerisches Geoinstitut (Germany); Kantor, A. [European Synchrotron Radiation Facility (France); Perßon, J. [JARA-FIT Forschungszentrum Jülich GmbH, Jülich Centre for Neutron Science (JCNS) and Peter Grünberg Institut (PGI) (Germany); Rüffer, R. [European Synchrotron Radiation Facility (France)
2016-12-15
We analyze in detail the results of experimental investigations of the evolution of the thermal vibration spectra for iron atoms in iron monosilicide FeSi depending on two external parameters, viz., temperature T (in the range 46–297 K at pressure P = 0.1 MPa) and pressure P (in the range 0.1 MPa–43 GPa at temperature T = 297 K), obtained by nuclear inelastic scattering of synchrotron radiation. The decrease of the atomic volume is accompanied by a rearrangement of the phonon spectrum, which is manifested, in particular, in the splitting of the low-energy peak in the spectrum and in an increase of the energy for all phonons. The changes of the average energy of the iron atom vibrational spectrum and of the Debye energy with decreasing atomic volume are analyzed. Different versions of FeSi electron spectrum variation, which can be used to explain the observed phonon anomalies, are considered.
Expectation-based approach for one-dimensional randomly disordered phononic crystals
International Nuclear Information System (INIS)
Wu, Feng; Gao, Qiang; Xu, Xiaoming; Zhong, Wanxie
2014-01-01
An expectation-based approach to the statistical theorem is proposed for the one-dimensional randomly disordered phononic crystal. In the proposed approach, the expectations of the random eigenstates of randomly disordered phononic crystals are investigated. In terms of the expectations of the random eigenstates, the wave propagation and localization phenomenon in the random phononic crystal could be understood in a statistical perspective. Using the proposed approach, it is proved that for a randomly disordered phononic crystal, the Bloch theorem holds in the perspective of expectation. A one-dimensional randomly disordered binary phononic crystal consisting of two materials with the random geometry size or random physical parameter is addressed by using the proposed approach. From the result, it can be observed that with the increase of the disorder degree, the localization of the expectations of the eigenstates is strengthened. The effect of the random disorder on the eigenstates at higher frequencies is more significant than that at lower frequencies. Furthermore, after introducing the random disorder into phononic crystals, some random divergent eigenstates are changed to localized eigenstates in expectation sense.
Nonlocal electron-phonon coupling in the pentacene crystal: Beyond the Γ-point approximation
Yi, Yuanping
2012-01-01
There is currently increasing interest in understanding the impact of the nonlocal (Peierls-type) electron-phonon mechanism on charge transport in organic molecular semiconductors. Most estimates of the non-local coupling constants reported in the literature are based on the Γ-point phonon modes. Here, the influence of phonon modes spanning the entire Brillouin zone (phonon dispersion) on the nonlocal electron-phonon couplings is investigated for the pentacene crystal. The phonon modes are obtained by using a supercell approach. The results underline that the overall nonlocal couplings are substantially underestimated by calculations taking sole account of the phonons at the Γ point of the unit cell. The variance of the transfer integrals based on Γ-point normal-mode calculations at room temperature is underestimated in some cases by 40% for herringbone-type dimers and by over 80% for cofacial dimers. Our calculations show that the overall coupling is somewhat larger for holes than for electrons. The results also suggest that the interactions of charge carriers (both electrons and holes) with acoustic and optical phonons are comparable. Therefore, an adequate description of the charge-transport properties in pentacene and similar systems requires that these two electron-phonon coupling mechanisms be treated on the same footing. © 2012 American Institute of Physics.
Directory of Open Access Journals (Sweden)
Eugene P. Prokopev
2012-10-01
Full Text Available The article, Basing on the example of ionic crystals shows that polarization of crystal framework by oppositely charged polarons (positronium atom (ps invokes the change of positronium binding energy and leads to the renormalization of electron and positron effective masses as well. Such interaction of electron and positronium atom of positron with optical phonons leads to additional repelling interaction, besides coulomb attractive. Furthermore, the existence of positronium atom with major and minor radius is possible in the atmosphere of crystal phonons.
Geometric tuning of thermal conductivity in three-dimensional anisotropic phononic crystals.
Wei, Zhiyong; Wehmeyer, Geoff; Dames, Chris; Chen, Yunfei
2016-10-07
Molecular dynamics simulations are performed to investigate the thermal transport properties of a three-dimensional (3D) anisotropic phononic crystal consisting of silicon nanowires and films. The calculation shows that the in-plane thermal conductivity is negatively correlated with the out-of-plane thermal conductivity upon making geometric changes, whether varying the nanowire diameter or the film thickness. This enables the anisotropy ratio of thermal conductivity to be tailored over a wide range, in some cases by more than a factor of 20. Similar trends in thermal conductivity are also observed from an independent phonon ray tracing simulation considering only diffuse boundary scattering effects, though the range of anisotropy ratios is smaller than that obtained in MD simulation. By analyzing the phonon dispersion relation with varied geometric parameters, it is found that increasing the nanowire diameter increases the out-of-plane acoustic phonon group velocities, but reduces the in-plane longitudinal and fast transverse acoustic phonon group velocities. The calculated phonon irradiation further verified the negative correlation between the in-plane and the out-of-plane thermal conductivity. The proposed 3D phononic crystal may find potential application in thermoelectrics, energy storage, catalysis and sensing applications owing to its widely tailorable thermal conductivity.
DEFF Research Database (Denmark)
Duggen, Lars; Willatzen, Morten
2017-01-01
This paper presents a theoretical investigation of phonon dispersion in piezoelectric slabs of hexagonal crystal symmetry (wurtzite). Specifically we solve the fully coupled dispersion relations in a GaN free standing quantum well by varying the crystal growth direction from the [001] axis...
Ab Initio and Phenomenological Modeling of the Phonon Spectrum of Superhard cp-BC2N
Basalaev, Yu. M.; Kopytov, A. V.; Pavlova, T. Yu.; Poplavnoi, A. S.
2015-11-01
The phonon spectrum of hypothetical superhard cp-BC2N is calculated based on ab initio method of density functional in the center of the Brillouin zone and interpolated over the entire Brillouin zone using the Keating phenomenological model. The interaction parameters are determined by optimization of the IR- and Ramanactive frequencies for a phenomenological model by their comparison with the results of ab initio calculations. Numerical values of short-range interaction constants and charges are in agreement with the characteristics of the chemical bond calculated ab initio. These parameters have transparent physical meaning and chemical nature and can further be used for both qualitative estimations of any physical and physico-chemical quantities and quantitative calculations of the phonon spectra of a number of isostructural compounds. The Keating phenomenological model is used to study the genesis of the phonon spectrum from the spectra of sublattices.
Interface nano-confined acoustic waves in polymeric surface phononic crystals
Energy Technology Data Exchange (ETDEWEB)
Travagliati, Marco, E-mail: marco.travagliati@iit.it [Center for Nanotechnology Innovation@NEST, Istituto Italiano di Tecnologia, Piazza San Silvestro 12, 56127 Pisa (Italy); NEST, Scuola Normale Superiore and Istituto Nanoscienze-CNR, Piazza San Silvestro 12, 56127 Pisa (Italy); Nardi, Damiano [JILA and Department of Physics, University of Colorado, 440 UCB, Boulder, Colorado 80309 (United States); Giannetti, Claudio; Ferrini, Gabriele; Banfi, Francesco, E-mail: francesco.banfi@unicatt.it [i-LAMP and Dipartimento di Matematica e Fisica, Università Cattolica del Sacro Cuore, Via Musei 41, 25121 Brescia (Italy); Gusev, Vitalyi [LAUM, UMR-CNRS 6613, Université du Maine, av. O. Messiaen, 72085 Le Mans (France); Pingue, Pasqualantonio [NEST, Scuola Normale Superiore and Istituto Nanoscienze-CNR, Piazza San Silvestro 12, 56127 Pisa (Italy); Piazza, Vincenzo [Center for Nanotechnology Innovation@NEST, Istituto Italiano di Tecnologia, Piazza San Silvestro 12, 56127 Pisa (Italy)
2015-01-12
The impulsive acoustic dynamics of soft polymeric surface phononic crystals is investigated here in the hypersonic frequency range by near-IR time-resolved optical diffraction. The acoustic response is analysed by means of wavelet spectral methods and finite element modeling. An unprecedented class of acoustic modes propagating within the polymer surface phononic crystal and confined within 100 nm of the nano-patterned interface is revealed. The present finding opens the path to an alternative paradigm for characterizing the mechanical properties of soft polymers at interfaces and for sensing schemes exploiting polymers as embedding materials.
The bandgap controlling by geometrical symmetry design in hybrid phononic crystal
Zhang, Z.; Han, X. K.; Ji, G. M.
2018-02-01
The effects of symmetries on the bandgap in a newly designed hybrid phononic crystal plate composed of rubber slab and epoxy resin stub are studied for better controlling of bandgaps. The point group symmetry is changed by changing the orientation of the stub. The translation group symmetry is changed by changing the side length and the height of adjacent stubs. Results show that the point group symmetry and translation group symmetry can be important factors for controlling of the bandgaps of phononic crystal. Wider bandgap is obtained by suitable orientation of the stub. Lower bandgap appears when the differences between the adjacent stubs become bigger in supercell.
DEFF Research Database (Denmark)
Jin, Yabin; Fernez, Nicolas; Pennec, Yan
2016-01-01
We investigate the properties of a phononic crystal plate with hollow pillars and introduce the existence of whispering-gallery modes (WGMs). We show that by tuning the inner radius of the hollow pillar, these modes can merge inside both Bragg and low frequency band gaps, deserving phononic crystal...
The Nature of the Phonon Spectrum and the Analysis of Lattice Thermal Conductivity
International Nuclear Information System (INIS)
Joshi, S.K.; Sharma, K.C.
1965-01-01
An analysis of lattice thermal conductivity is presented, wherein a more realistic phonon spectrum is utilized than the usual Debye-like phonon spectrum consisting of one average acoustic branch. We have first used an anisotropic continuum dispersive model in our calculation of the temperature dependence of the lattice thermal conductivity of germanium. The approach that we have utilized in this calculation is a modified version of Callaway's formulation. Houston's six- and three-term integration procedures are used in evaluating rather formidable integrals over lattice frequencies. Suitable prevalent expressions for relaxation times for boundary and impurity scatterings and three-phonon normal and Umklapp processes are used. A good fit to the experimental data of Holland and Slack and Glassbrenner is obtained for germanium from 2 to 1000°K by adjusting the four constants occurring in the integrals. On the face of reliable neutron spectroscopic evidence, we know that germanium has very disperse transverse branches and for them an anisotropic continuum dispersive model also yields a poor representation. We therefore thought it appropriate to utilize the very elaborate shell model for the lattice dynamics of germanium put forth by Cochran. With a proper adjustment of the parameters entering in our formulation for the calculation of lattice thermal conductivity, we again find a good fit with the experimental data. We are led to a conclusion that the nature of the phonon spectrum does not greatly influence the analysis of lattice thermal conductivity data according to current approaches and the niceties of the phonon spectrum are lost in the adjustment of the various parameters involved. It is felt that instead of putting too much labour in evaluating the tedious integrals for more realistic lattice dynamical models, it is better to investigate the validity of various relaxation time assumptions that have gone into these integrals. (author) [fr
Xu, Pei-Cang; Li, Ru-Bi; Shang, Tong-Ming; Zhou, Jian; Sun, Jian-Hua; You, Jing-Lin
2010-05-01
Silicate melts are special fractal dimension system that is metastable state of near-way order and far-way disorder. In this paper, the size of nanometer aggregation structure and the frequences of phonon vibration like mode in the low dimension silicate series (CaO-Al2O3-SiO2 and Na2-Al2O3-SiO2 series) synthesized via high temperature melting and sol gel methods were measured by means of small-angle X-ray scattering (SAXS), low wavenumber Raman spectrum (LWRS) and high temperature Raman spectrum (HTRS in situ measuring). The nanometer self-similarity aggregation structure(it's size is about a few nm to a few tens nm) and phonic phonon vibration like modes of low temperature silicate gel, high temperature silicate melts and it's quenching glasses phases were obtained. So a quantitative method by HTRS for measuring the aggregation size in the high temperature melts was established. The results showed that the aggregation size of the silicate melts is smaller at high temperature than at room temperature and the number of bridge oxygen in one Si-O tetrahedron in network structure units is decreasing at high temperature. This study work provides important theory and information for deliberating geochemistry characteristic, crystallization & evolution of natural magma and enhancing performance of low dimension silicate matelials.
Double Dirac cone in two-dimensional phononic crystals beyond circular cells
Dai, Hongqing; Liu, Tingting; Jiao, Junrui; Xia, Baizhan; Yu, Dejie
2017-04-01
A double Dirac cone plays a significant role in the design of zero-refractive-index metamaterials without phase variation and topological insulators with pseudospin states. We present a study on the formation of a double Dirac cone in two-dimensional phononic crystals consisting of either hexagonal or triangular columns in air. We arranged hexagonal and triangular columns separately in a honeycomb lattice to explore the influence of phononic crystal symmetry on the formation of the double Dirac cone. The results show that phononic crystals forming a honeycomb lattice with C6v or C6 symmetry induce an accidental degeneracy, but C3v and C3 cannot. We also demonstrate that by varying the filling ratio of the hexagonal columns, a topological phase transformation induced by energy band inversion with dipolar and quadrupolar states occurs near the double Dirac cone. Transmission properties for acoustic tunneling and waveform shaping are confirmed in two numerical simulation examples. A discussion is given on the formation of the double Dirac cone in different phononic crystal symmetries in a honeycomb lattice. The conclusions suggest a new route for designing topological and zero-refractive-index acoustic devices.
The A1g mode in the Hg-1201 phonon spectrum as an indicator of N→S transition
International Nuclear Information System (INIS)
Dovgij, Ya.
2011-01-01
By analyzing the structure of and the temperature changes in HgBa 2 CuO 4+y phonon spectra, the electron-phonon coupling constant g has been determined for the first time. It is shown that this compound is a superconductor with strong coupling. A frequency interval around 60.4 MeV in the HgBa 2 CuO 4+y phonon spectrum, which may be classed as a 'soft mode', is revealed. The dominant partial contribution to the density of phonon states in that spectral range is found to be given by O(2) atomic vibrations.
Directory of Open Access Journals (Sweden)
METODIJA NAJDOSKI
2000-07-01
Full Text Available Fourier-transform infrared (FT-IR reflection spectra, asquired at nearnormal incidence, were recorded from single crystals belonging to six crystal systems: CsCr(SO42.12H2O (alum, cubic, K2CuCl2·2H2O (Mitscherlichite, tetragonal, CaCO3 (calcite, hexagonal, KHSO4 (mercallite, orthorhombic, CaSO4·2H2O (gypsum, monoclinic and CuSO4·5H2O (chalcantite, triclinic. The acquired IR reflection spectra were further transformed into absorption spectra, employing the Kramers-Kronig transformation. Except for the cubic alums, the spectra strongly depend on the crystal face from which they were recorded; this is a consequence of anisotropy. Phonons of a given symmetry (E-species, in tetragonal/hexagonal and B-species, in monoclinic crystals may be resolved without using a polariser. The spectrum may be simplified in the case of an orthorhombic crystal, as well. The longitudinal-optical (LO and transversal-optical (TO mode frequencies were calculated in the case of optically isotropic and the simplified spectra of optically uniaxial crystals.
Neutron-Phonon Interaction Studies in Copper, Zinc and Magnesium Single Crystals
International Nuclear Information System (INIS)
Maliszewski, E.; Sosnowski, J.; Blinowski, K.; Kozubowski, J.; Padlo, L.; Sledziewska, D.
1963-01-01
The phonon dispersion relations in copper single crystals has been studied by means of a triple-axis crystal neutron spectrometer. In the [100] direction the transversal branch, not reported in the papers of Cabie and Jacrot, has been found. This branch fits well to the recent data of sound velocity; however, it differs partly from the X-ray results of Jacobsen. For the longitudinal branch in the [100] direction the dispersion curve obtained by Cribier and Jacrot is lying well above the Jacobsen's curve, and the experimental points reported in the present paper support the results of Cribier and Jacrot. The phonon dispersion relations in zinc and magnesium single crystals has been studied using the cold neutron method and by means of a triple-axis crystal neutron spectrometer as well. The scattering surfaces in the [1010] plane were traced, the AT and AL branches found and the phonon dispersion relations in the [001] and [010] directions obtained. The results have been compared with those obtained by Johnson with X-rays. In the [001] direction the present results fit well lo Johnson's foe the AL branch. In the [010] direction for the AT branch a large discrepancy has been found between Johnson's and the present results. Some explanation of this discrepancy is given. Similar measurements in the same directions in magnesium single crystals are under way and will be reported. (author) [fr
Mu, Liwen; Li, Yifan; Mehra, Nitin; Ji, Tuo; Zhu, Jiahua
2017-04-05
In this work, poly(vinyl alcohol) (PVA)/amino acid (AA) composites were prepared by a self-organized crystallization process. Five different AAs (cysteine, aspartic acid, glutamic acid, ornithine, and lysine) were selected based on their similar functional groups but different molecular structures. The different PVA-AA interactions in the five PVA/AA composites lead to two crystal patterns, i.e., continuous network (cysteine and lysine) and discrete particles (glutamic acid, ornithine, and aspartic acid). Scanning thermal microscopy is then applied to map the distribution of thermal conduction in these composites. It is found that the interface surrounding the crystals plays a dominating role in phonon transport where the polymer chains are greatly restrained by the interfacial confinement effect. Continuous crystal network builds up a continuous interface that facilitates phonon transfer while phonon scattering occurs in discrete crystalline structures. Significantly improved thermal conductivity of ∼0.7 W/m·K is observed in PVA/cysteine composite with AA loading of 8.4 wt %, which corresponds to a 170% enhancement as compared to pure PVA. The strong PVA-AA molecular interaction and self-organized crystal structure are considered the major reasons for the unique interface property and superior thermal conductivity.
Topologically protected elastic waves in one-dimensional phononic crystals of continuous media
Kim, Ingi; Iwamoto, Satoshi; Arakawa, Yasuhiko
2018-01-01
We report the design of silica-based 1D phononic crystals (PnCs) with topologically distinct complete phononic bandgaps (PnBGs) and the observation of a topologically protected state of elastic waves at their interface. By choosing different structural parameters of unit cells, two PnCs can possess a common PnBG with different topological natures. At the interface between the two PnCs, a topological interface mode with a quality factor of ∼5,650 is observed in the PnBG. Spatial confinement of the interface mode is also confirmed by the photoelastic imaging technique. Such topologically protected elastic states are potentially applicable in the construction of novel phononic devices.
Design and Fabrication Challenges for Millimeter-Scale Three-Dimensional Phononic Crystals
Directory of Open Access Journals (Sweden)
Frieder Lucklum
2017-11-01
Full Text Available While phononic crystals can be theoretically modeled with a variety of analytical and numerical methods, the practical realization and comprehensive characterization of complex designs is often challenging. This is especially important for the nearly limitless possibilities of periodic, three-dimensional structures. In this contribution, we take a look at these design and fabrication challenges of different 3D phononic elements based on recent research using additive manufacturing. Different fabrication technologies introduce specific limitations in terms of, e.g., material choices, minimum feature size, aspect ratios, or support requirements that have to be taken into account during design and theoretical modeling. We discuss advantages and disadvantages of additive technologies suitable for millimeter and sub-millimeter feature sizes. Furthermore, we present comprehensive experimental characterization of finite, simple cubic lattices in terms of wave polarization and propagation direction to demonstrate the substantial differences between complete phononic band gap and application oriented directional band gaps of selected propagation modes.
Energy Technology Data Exchange (ETDEWEB)
Potemkin, F V; Mareev, E I [International Laser Center, M. V. Lomonosov Moscow State University, Moscow (Russian Federation); Khodakovskii, N G [A M Prokhorov General Physics Institute, Russian Academy of Sciences, Moscow (Russian Federation); Mikheev, P M
2013-08-31
The dynamics of coherent phonons in fluorine-containing crystals was investigated by pump-probe technique in the plasma production regime. Several phonon modes, whose frequencies are overtones of the 0.38-THz fundamental frequency, were simultaneously observed in a lithium fluoride crystal. Phonons with frequencies of 1 and 0.1 THz were discovered in a calcium fluoride crystal and coherent phonons with frequencies of 1 THz and 67 GHz were observed in a barium fluoride crystal. Furthermore, in the latter case the amplitudes of phonon mode oscillations were found to significantly increase 15 ps after laser irradiation. (interaction of laser radiation with matter)
International Nuclear Information System (INIS)
Li Jing; Liu Zhengyou; Qiu Chunyin
2008-01-01
By using of the multiple scattering methods, we study the negative refraction imaging effect of solid acoustic waves by two-dimensional three-component phononic crystals composed of coated solid inclusions placed in solid matrix. We show that localized resonance mechanism brings on a group of flat single-mode bands in low-frequency region, which provides two equivalent frequency surfaces (EFS) close to circular. The two constant frequency surfaces correspond to two Bloch modes, a right-handed and a left-handed, whose leading mode are respectively transverse (T) and longitudinal (L) modes. The negative refraction behaviors of the two kinds of modes have been demonstrated by simulation of a Gaussian beam through a finite system. High-quality far-field imaging by a planar lens for transverse or longitudinal waves has been realized separately. This three-component phononic crystal may thus serve as a mode selector in negative refraction imaging of solid acoustic waves
Wave propagation in one-dimensional solid-fluid quasi-periodic and aperiodic phononic crystals
Energy Technology Data Exchange (ETDEWEB)
Chen Ali, E-mail: alchen@bjtu.edu.cn [Institute of Engineering Mechanics, Beijing Jiaotong University, Beijing 100044 (China); Wang Yuesheng [Institute of Engineering Mechanics, Beijing Jiaotong University, Beijing 100044 (China); Zhang Chuanzeng [Department of Civil Engineering, University of Siegen, D-57068 Siegen (Germany)
2012-02-01
The propagation of the elastic waves in one-dimensional (1D) solid-fluid quasi-periodic phononic crystals is studied by employing the concept of the localization factor, which is calculated by the transfer matrix method. The solid-fluid interaction effect at the interfaces between the solid and the fluid components is considered. For comparison, the periodic systems and aperiodic Thue-Morse sequence are also analyzed in this paper. The splitting phenomenon of the pass bands and bandgaps are discussed for these 1D solid-fluid systems. At last the influences of the material impedance ratios on the band structures of the 1D solid-fluid quasi-periodic phononic crystals arranged as Fibonacci sequence are discussed.
Band structures tunability of bulk 2D phononic crystals made of magneto-elastic materials
Directory of Open Access Journals (Sweden)
J. O. Vasseur
2011-12-01
Full Text Available The feasibility of contactless tunability of the band structure of two-dimensional phononic crystals is demonstrated by employing magnetostrictive materials and applying an external magnetic field. The influence of the amplitude and of the orientation with respect to the inclusion axis of the applied magnetic field are studied in details. Applications to tunable selective frequency filters with switching functionnality and to reconfigurable wave-guides and demultiplexing devices are then discussed.
Surface acoustic waves in finite slabs of three-dimensional phononic crystals
Sainidou, R.; Djafari-Rouhani, B.; Vasseur, J. O.
2008-01-01
We study theoretically, by means of layer-multiple-scattering techniques, the propagation of elastic waves through finite slabs of phononic crystals consisting of metallic spheres in a polyester matrix, embedded in air. In particular, we focus on the study of modes localized on the surfaces of the structure. Their origin and behavior, as well as the physical parameters that influence and determine their appearance, are investigated in detail. Our results reveal the existence of absolute phono...
Generalized thermoelastic wave band gaps in phononic crystals without energy dissipation
Wu, Ying; Yu, Kaiping; Li, Xiao; Zhou, Haotian
2016-01-01
We present a theoretical investigation of the thermoelastic wave propagation in the phononic crystals in the context of Green-Nagdhi theory by taking thermoelastic coupling into account. The thermal field is assumed to be steady. Thermoelastic wave band structures of 3D and 2D are derived by using the plane wave expansion method. For the 2D problem, the anti-plane shear mode is not affected by the temperature difference. Thermoelastic wave bands of the in-plane x-y mode are calculated for lead/silicone rubber, aluminium/silicone rubber, and aurum/silicone rubber phononic crystals. The new findings in the numerical results indicate that the thermoelastic wave bands are composed of the pure elastic wave bands and the thermal wave bands, and that the thermal wave bands can serve as the low boundary of the first band gap when the filling ratio is low. In addition, for the lead/silicone rubber phononic crystals the effects of lattice type (square, rectangle, regular triangle, and hexagon) and inclusion shape (circle, oval, and square) on the normalized thermoelastic bandwidth and the upper/lower gap boundaries are analysed and discussed. It is concluded that their effects on the thermoelastic wave band structure are remarkable.
Analysis of Longitudinal Waves in Rod-Type Piezoelectric Phononic Crystals
Directory of Open Access Journals (Sweden)
Longfei Li
2016-04-01
Full Text Available Phononic crystals can be used to control elastic waves due to their frequency bands. This paper analyzes the passive and active control as well as the dispersion properties of longitudinal waves in rod-type piezoelectric phononic crystals over large frequency ranges. Based on the Love rod theory for modeling the longitudinal wave motions in the constituent rods and the method of reverberation-ray matrix (MRRM for deriving the member transfer matrices of the constituent rods, a modified transfer matrix method (MTMM is proposed for the analysis of dispersion curves by combining with the Floquet–Bloch principle and for the calculation of transmission spectra. Numerical examples are provided to validate the proposed MTMM for analyzing the band structures in both low and high frequency ranges. The passive control of longitudinal-wave band structures is studied by discussing the influences of the electrode’s thickness, the Poisson’s effect and the elastic rod inserts in the unit cell. The influences of electrical boundaries (including electric-open, applied electric capacity, electric-short and applied feedback control conditions on the band structures are investigated to illustrate the active control scheme. From the calculated comprehensive frequency spectra over a large frequency range, the dispersion properties of the characteristic longitudinal waves in rod-type piezoelectric phononic crystals are summarized.
Experimental study on the sound absorption characteristics of continuously graded phononic crystals
Directory of Open Access Journals (Sweden)
X. H. Zhang
2016-10-01
Full Text Available Novel three-dimensional (3D continuously graded phononic crystals (CGPCs have been designed, and fabricated by 3D printing. Each of the CGPCs is an entity instead of a combination of several other samples, and the porosity distribution of the CGPC along the incident direction is nearly linear. The sound absorption characteristics of CGPCs were experimentally investigated and compared with those of uniform phononic crystals (UPCs and discretely stepped phononic crystals (DSPCs. Experimental results show that CGPCs demonstrate excellent sound absorption performance because of their continuously graded structures. CGPCs have higher sound absorption coefficients in the large frequency range and more sound absorption coefficient peaks in a specific frequency range than UPCs and DSPCs. In particular, the sound absorption coefficients of the CGPC with a porosity of 0.6 and thickness of 30 mm are higher than 0.56 when the frequency is 1350–6300 Hz and are all higher than 0.2 in the studied frequency range (1000–6300 Hz. CGPCs are expected to have potential application in noise control, especially in the broad frequency and low-frequency ranges.
Nonlinear phonons in high-Tc superconductors mixed crystals
International Nuclear Information System (INIS)
Gadzhiev, B.R.; Dzhavadov, N.A.
1998-01-01
The integrodifferential kinetic equation which is a generalization of the Landau-Ginzburg formalism is introduced. The peculiarities of nonlinear kinetics are investigated by entering the nonlocal function, which is a quantitative measure of time dispersion. The classification nonlocal function is made by its Hausdorff dimensionality d c . It is shown that in the case d c c =1, the relaxation equation is the equation of damping harmonic oscillator. In the case d c >1, the relaxation equation contains the time derivation arbitrary high order. After linearization of the corresponding dynamic equations near the corresponding nonlinear static equations the dispersion and then after spatial averaging, temperature and frequency dependency of corresponding dynamic susceptibility have been determined. It is shown that in the cases d c c >1 the temperature evolution system alongside with the soft mode is accompanied by the modes which depend nonlinearly on the temperature. The physical nature of quasiscattering in the incommensurate phases of layered crystals is studied. The obtained theoretical results are applied to the layered HTSC crystals. (author)
Ansari, M. H.; Attarzadeh, M. A.; Nouh, M.; Karami, M. Amin
2018-01-01
In this paper, a physical platform is proposed to change the properties of phononic crystals in space and time in order to achieve nonreciprocal wave transmission. The utilization of magnetoelastic materials in elastic phononic systems is studied. Material properties of magnetoelastic materials change significantly with an external magnetic field. This property is used to design systems with a desired wave propagation pattern. The properties of the magnetoelastic medium are changed in a traveling wave pattern, which changes in both space and time. A phononic crystal with such a modulation exhibits one-way wave propagation behavior. An extended transfer matrix method (TMM) is developed to model a system with time varying properties. The stop band and the pass band of a reciprocal and a nonreciprocal bar are found using this method. The TMM is used to find the transfer function of a magnetoelastic bar. The obtained results match those obtained via the theoretical Floquet-Bloch approach and numerical simulations. It is shown that the stop band in the transfer function of a system with temporal varying property for the forward wave propagation is different from the same in the backward wave propagation. The proposed configuration enables the physical realization of a class of smart structures that incorporates nonreciprocal wave propagation.
Phononic Crystal Made of Multilayered Ridges on a Substrate for Rayleigh Waves Manipulation
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Mourad Oudich
2017-12-01
Full Text Available We present a phononic crystal to achieve efficient manipulation of surface acoustic waves (SAW. The structure is made of finite phononic micro-ridges arranged periodically in a substrate surface. Each ridge is constructed by staking silicon and tungsten layers so that it behaves as one-dimensional phononic crystal which exhibits band gaps for elastic waves. The band gap allows the existence of resonance modes where the elastic energy is either confined within units in the free end of the ridge or the ones in contact with the substrate. We show that SAW interaction with localized modes in the free surface of the ridge gives rise to sharp attenuation in the SAW transmission, while the modes confined within the ridge/substrate interface cause broad band attenuations of SAW. Furthermore, we demonstrate that the coupling between the two kinds of modes within the band gap gives high SAW transmission amplitude in the form of Fano-like peaks with high quality factor. The structure could provide an interesting solution for accurate SAW control for sensing applications, for instance.
Imaging off-plane shear waves with a two-dimensional phononic crystal lens
International Nuclear Information System (INIS)
Chiang Chenyu; Luan Pigang
2010-01-01
A two-dimensional flat phononic crystal (PC) lens for focusing off-plane shear waves is proposed. The lens consists of a triangular lattice hole-array, embedded in a solid matrix. The self-collimation effect is employed to guide the shear waves propagating through the lens along specific directions. The Dirichlet-to-Neumann maps (DtN) method is employed to calculate the band structure of the PC, which can avoid the problems of bad convergence and fake bands automatically in the void-solid PC structure. When the lens is illuminated by the off-plane shear waves emanating from a point source, a subwavelength image appears in the far-field zone. The imaging characteristics are investigated by calculating the displacement fields explicitly using the multiple scattering method, and the results are in good agreement with the ray-trace predictions. Our results may provide insights for designing new phononic devices.
Christianson, Caleb; Mukhopadhyay, Saikat; Sachse, Wolfgang; Stewart, Derek
2014-03-01
Phononic crystals are two- and three-dimensional structures with a periodic arrangement of two or more materials with different acoustic properties. Depending on the size, structure, and characteristics of the constituent materials, metamaterials with interesting acoustic properties can be formed. These crystals can be used to control the transmission of sound at selected frequencies, focus sound, or serve as waveguides. In this talk, we will focus on the transmission of ultrasonic waves through polydimethylsiloxane (PDMS) films with entrapped air bubbles. Two different theoretical models were used to predict ultrasonic transmission through air-PDMS crystals: (1) a simple scattering model for a series of partially reflective thin films and (2) the code MULTEL, which calculates the transmission using multiple scattering theory. A fabrication process was also developed to stack layers of the crystals with unprecedented alignment. We measured the ultrasonic transmission through the films using the ultrasonic through-transmission mode in a water bath and found an excellent agreement between the measured and calculated transmission. Additionally, we used these models to predict the performance of new phononic structures by scanning a large parameter space and showed how ultrasonic transmission through PDMS layers can be engineered by varying the dimensions, separation, and arrangement of air bubbles. This work was supported by the National Science Foundation.
Wu, Songtao; Zhu, Gaohua; Zhang, Jin S; Banerjee, Debasish; Bass, Jay D; Ling, Chen; Yano, Kazuhisa
2014-05-21
We report anisotropic expansion of self-assembled colloidal polystyrene-poly(dimethylsiloxane) crystals and its impact on the phonon band structure at hypersonic frequencies. The structural expansion was achieved by a multistep infiltration-polymerization process. Such a process expands the interplanar lattice distance 17% after 8 cycles whereas the in-plane distance remains unaffected. The variation of hypersonic phonon band structure induced by the anisotropic lattice expansion was recorded by Brillouin measurements. In the sample before expansion, a phononic band gap between 3.7 and 4.4 GHz is observed; after 17% structural expansion, the gap is shifted to a lower frequency between 3.5 and 4.0 GHz. This study offers a facile approach to control the macroscopic structure of colloidal crystals with great potential in designing tunable phononic devices.
Surface acoustic waves in two dimensional phononic crystal with anisotropic inclusions
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Ketata H.
2012-06-01
Full Text Available An analysis is given to the band structure of the two dimensional solid phononic crystal considered as a semi infinite medium. The lattice includes an array of elastic anisotropic materials with different shapes embedded in a uniform matrix. For illustration two kinds of phononic materials are assumed. A particular attention is devoted to the computational procedure which is mainly based on the plane wave expansion (PWE method. It has been adapted to Matlab environment. Numerical calculations of the dispersion curves have been achieved by introducing particular functions which transform motion equations into an Eigen value problem. Significant improvements are obtained by increasing reasonably the number of Fourier components even when a large elastic mismatch is assumed. Such approach can be generalized to different types of symmetry and permit new physical properties as piezoelectricity to be added. The actual semi infinite phononic structure with a free surface has been shown to support surface acoustic waves (SAW. The obtained dispersion curves reveal band gaps in the SAW branches. It has been found that the influence, of the filling factor and anisotropy on their band gaps, is different from that of bulk waves.
A new perspective for analyzing complex band structures of phononic crystals
Meng, Lingkai; Shi, Zhifei; Cheng, Zhibao
2018-03-01
Rewriting the formulation of the Bloch waves, this paper presents a new perspective for analyzing the complex band structures of the in-plane waves in 2D phononic crystals. Using the proposed formulation, a new finite element based method is developed for analyzing 2D periodic systems. The results of the validation example prove that the proposed method can provide exact solutions for both the real and complex band structures of 2D periodic systems. Furthermore, using the proposed method, the complex band structures of a 2D periodic structure are calculated. The physical meanings of the obtained complex band structures are discussed by performing the wave mode analysis.
Omnidirectional refractive devices for flexural waves based on graded phononic crystals
Energy Technology Data Exchange (ETDEWEB)
Torrent, Daniel, E-mail: daniel.torrent@iemn.univ-lille1.fr; Pennec, Yan; Djafari-Rouhani, Bahram [Institut d' Electronique, de Microléctronique et de Nanotechnologie, UMR CNRS 8520, Université de Lille 1, 59655 Villeneuve d' Ascq (France)
2014-12-14
Different omnidirectional refractive devices for flexural waves in thin plates are proposed and numerically analyzed. Their realization is explained by means phononic crystal plates, where a previously developed homogenization theory is employed for the design of graded index refractive devices. These devices consist of a circular cluster of inclusions with a properly designed gradient in their radius. With this approach, the Luneburg and Maxwell lenses and a family of beam splitters for flexural waves are proposed and analyzed. Results show that these devices work properly in a broadband frequency region, being therefore an efficient approach for the design of refractive devices specially interesting for nano-scale applications.
Design and fabrication of a phononic-crystal-based Love wave resonator in GHz range
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Ting-Wei Liu
2014-12-01
Full Text Available This paper presents a method for designing and fabricating a Love wave resonator utilizing the phononic crystal (PC as the reflectors. The PCs were formed by depositing 2D, periodically etched silica film on a quartz substrate. We analyzed the PC structure, and within its partial bandgap we designed a one-port resonator that contained a set of inter-digital transducer (IDT inside the resonant cavity bonded by two PC arrays. With sub-micrometer structures, the resonator was designed to operate at 1.25 GHz. The device was fabricated by employing the microelectromechanical system (MEMS fabrication technology and the resonant performance was evaluated.
Kosevich, Yu. A.; Potyomina, L. G.; Darinskii, A. N.; Strelnikov, I. A.
2018-03-01
The paper theoretically studies the possibility of using the effects of phonon interference between paths through different interatomic bonds for the control of phonon heat transfer through internal crystal interfaces and for the design of phonon metamirrors and meta-absorbers. These metamirrors and meta-absorbers are considered to be defect nanolayers of atomic-scale thicknesses embedded in a crystal. Several analytically solvable three-dimensional lattice-dynamics models of the phonon metamirrors and meta-absorbers at the internal crystal planes are described. It is shown that due to destructive interference in the two or more phonon paths, the internal crystal planes, fully or partially filled with weakly bound or heavy-isotope defect atoms, can completely reflect or completely absorb phonons at the transmission antiresonances, whose wavelengths are larger than the effective thickness of the metamirror or meta-absorber. Due to cooperative superradiant effect, the spectral widths of the two-path interference antiresonances for the plane waves are given by the square of partial filling fraction in the defect crystal plane. Our analysis reveals that the presence of two or more phonon paths plays the dominant role in the emergence of the transmission antiresonances in phonon scattering at the defect crystal planes and in reduction of the thermal interface conductance in comparison with the Fano-resonance concept. We study analytically phonon transmission through internal crystal plane in a model cubic lattice of Si-like atoms, partially filled with Ge-like defect atoms. Such a plane can serve as interference phonon metamirror with the transmission antiresonances in the vicinities of eigenmode frequencies of Ge-like defect atoms in the terahertz frequency range. We predict the extraordinary phonon transmission induced by the two-path constructive interference of the lattice waves in resonance with the vibrations of rare host atoms, periodically distributed in the
Kamaraju, N.; Kumar, Sunil; Freysz, Eric; Sood, A. K.
2010-05-01
Combination of femtosecond Kerr, two photon absorption, and impulsive stimulated Raman scattering (ISRS) experiments have been carried out to investigate the effect of pulse energy and crystal temperature on the generation of coherent polaritons and phonons in ⟨110⟩ cut ZnTe single crystals of three different resistivities. We demonstrate that the effect of two photon induced free carriers on the creation of both the polaritons and phonons is largest at 4 K where the free carrier lifetime is enhanced. The temperature dependant ISRS on high and low purity ZnTe crystals allows us to unambiguously assign the phonon mode at 3.5 THz to the longitudinal acoustic mode at X-point in the Brillouin zone, LA(X).
Wang, Gang; Liu, Yao-Zong; Wen, Ji-Hong; Yu, Dian-Long
2006-02-01
The low-frequency band gap and the corresponding vibration modes in two-dimensional ternary locally resonant phononic crystals are restudied successfully with the lumped-mass method. Compared with the work of C. Goffaux and J. Sánchez-Dehesa (Phys. Rev. B 67 14 4301(2003)), it is shown that there exists an error of about 50% in their calculated results of the band structure and one band is missing in their results. Moreover, the in-plane modes shown in their paper are improper, which results in the wrong conclusion on the mechanism of the ternary locally resonant phononic crystals. Based on the lumped-mass method and better description of the vibration modes according to the band gaps, the locally resonant mechanism in forming the subfrequency gaps is thoroughly analysed. The rule used to judge whether a resonant mode in the phononic crystals can result in a corresponding subfrequency gap is also verified in this ternary case.
Research on soundproof properties of cylindrical shells of generalized phononic crystals
Liu, Ru; Shu, Haisheng; Wang, Xingguo
2017-04-01
Based on the previous studies, the concept of generalized phononic crystals (GPCs) is further introduced into the cylindrical shell structures in this paper. And a type of cylindrical shells of generalized phononic crystals (CS-GPCs) is constructed, the structural field and acoustic-structural coupled field of the composite cylindrical shells are examined respectively. For the structural field, the transfer matrix method of mechanical state vector is adopted to build the transfer matrix of radial waves propagating from inside to outside. For the acoustic-structural coupled field, the expressions of the acoustic transmission/reflection coefficients and the sound insulation of acoustic waves with the excitation of center line sound source are set up. And the acoustic transmission coefficient and the frequency response of sound insulation in this mode were numerical calculated. Furthermore, the theoretical analysis results are verified by using the method of combining the numerical calculation and finite element simulation. Finally, the effects of inner and outer fluid parameters on the transmission/reflection coefficients of CS-GPCs are analyzed in detail.
Evanescent coupling between surface and linear-defect guided modes in phononic crystals
Cicek, Ahmet; Salman, Aysevil; Adem Kaya, Olgun; Ulug, Bulent
2016-01-01
Evanescent coupling between surface and linear-defect waveguide modes in a two-dimensional phononic crystal of steel cylinders in air is numerically demonstrated. When the ratio of scatterer radii to the lattice constant is set to 0.47 in the square phononic crystal, the two types of modes start interacting if there is one-row separation between the surface and waveguide. Supercell band structure computations through the Finite Element Method suggest that the waveguide band is displaced significantly, whereas the surface band remains almost intact when the waveguide and surface are in close proximity. The two resultant hybrid bands are such that the coupling length, which varies between 8 and 22 periods, initially changes linearly with frequency, while a much sharper variation is observed towards the top of the lower hybrid band. Such small values facilitate the design of compact devices based on heterogeneous coupling. Finite-element simulations demonstrate bilateral coupling behaviour, where waves incident from either the surface or waveguide can efficiently couple to the other side. The coupling lengths calculated from simulation results are in agreement with the values predicted from the supercell band structure. The possible utilisation of the coupling scheme in sensing applications, especially in acoustic Doppler velocimetry, is discussed.
Phononic Crystal Plate with Hollow Pillars Actively Controlled by Fluid Filling
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Yabin Jin
2016-05-01
Full Text Available We investigate theoretically the properties of phononic crystal plates with hollow pillars. Such crystals can exhibit confined whispering gallery modes around the hollow parts of the pillars whose localization can be increased by separating the pillar from the plate by a full cylinder. We discuss the behaviors of these modes and their potential applications in guiding and filtering. Filling the hollow parts with a fluid gives rise to new localized modes, which depend on the physical properties and height of the fluid. Thus, these modes can be actively controlled for the purpose of multichannel multiplexing. In particular, one can obtain localized modes associated with the compressional vibrations of the fluid along its height. They can be used for the purpose of sensing the acoustic properties of the fluid or their variations with temperature.
Energy Technology Data Exchange (ETDEWEB)
Morvan, B.; Tinel, A.; Sainidou, R.; Rembert, P. [Laboratoire Ondes et Milieux Complexes, UMR CNRS 6294, Université du Havre, 75 rue Bellot, 76058 Le Havre (France); Vasseur, J. O.; Hladky-Hennion, A.-C. [Institut d' Electronique, de Micro-électronique et de Nanotechnologie, UMR CNRS 8520, Cité Scientifique, 59652 Villeneuve d' Ascq Cedex (France); Swinteck, N.; Deymier, P. A. [Department of Materials Science and Engineering, University of Arizona, Tucson, Arizona 85721 (United States)
2014-12-07
Phononic crystals (PC) can be used to control the dispersion properties of acoustic waves, which are essential to direct their propagation. We use a PC-based two-dimensional solid/solid composite to demonstrate experimentally and theoretically the spatial filtering of a monochromatic non-directional wave source and its emission in a surrounding water medium as an ultra-directional beam with narrow angular distribution. The phenomenon relies on square-shaped equifrequency contours (EFC) enabling self-collimation of acoustic waves within the phononic crystal. Additionally, the angular width of collimated beams is controlled via the EFC size-shrinking when increasing frequency.
Shcherbakov, Alexandre S; Arellanes, Adan Omar
2017-12-01
During subsequent development of the recently proposed multi-frequency parallel spectrometer for precise spectrum analysis of wideband radio-wave signals, we study potentials of new acousto-optical cells exploiting selected crystalline materials at the limits of their capabilities. Characterizing these wide-aperture cells is non-trivial due to new features inherent in the chosen regime of an advanced non-collinear one-phonon anomalous light scattering by elastic waves with significantly elevated acoustic losses. These features can be observed simpler in uniaxial, tetragonal, and trigonal crystals possessing linear acoustic attenuation. We demonstrate that formerly studied additional degree of freedom, revealed initially for multi-phonon regimes of acousto-optical interaction, can be identified within the one-phonon geometry as well and exploited for designing new cells. We clarify the role of varying the central acoustic frequency and acoustic attenuation using the identified degree of freedom. Therewith, we are strongly restricted by a linear regime of acousto-optical interaction to avoid the origin of multi-phonon processes within carrying out a multi-frequency parallel spectrum analysis of radio-wave signals. Proof-of-principle experiments confirm the developed approaches and illustrate their applicability to innovative technique for an advanced spectrum analysis of wideband radio-wave signals with the improved resolution in an extended frequency range.
Coupling between crystal field transitions and phonons in the 4f-electron system CeCu2
Czech Academy of Sciences Publication Activity Database
Schedler, R.; Witte, U.; Loewenhaupt, M.; Kulda, Jiří
2003-01-01
Roč. 335, 1, 2, 3, 4 (2003), s. 41-43 ISSN 0921-4526 R&D Projects: GA AV ČR KSK1048102 Keywords : crystal field phonon coupling Subject RIV: BG - Nuclear, Atomic and Molecular Physics, Colliders Impact factor: 0.908, year: 2003
Plane Wave-Perturbative Method for Evaluating the Effective Speed of Sound in 1D Phononic Crystals
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J. Flores Méndez
2016-01-01
Full Text Available A method for calculating the effective sound velocities for a 1D phononic crystal is presented; it is valid when the lattice constant is much smaller than the acoustic wave length; therefore, the periodic medium could be regarded as a homogeneous one. The method is based on the expansion of the displacements field into plane waves, satisfying the Bloch theorem. The expansion allows us to obtain a wave equation for the amplitude of the macroscopic displacements field. From the form of this equation we identify the effective parameters, namely, the effective sound velocities for the transverse and longitudinal macroscopic displacements in the homogenized 1D phononic crystal. As a result, the explicit expressions for the effective sound velocities in terms of the parameters of isotropic inclusions in the unit cell are obtained: mass density and elastic moduli. These expressions are used for studying the dependence of the effective, transverse and longitudinal, sound velocities for a binary 1D phononic crystal upon the inclusion filling fraction. A particular case is presented for 1D phononic crystals composed of W-Al and Polyethylene-Si, extending for a case solid-fluid.
Study of crystal-field excitations and Raman active phonons in o-DyMnO.sub.3./sub..
Czech Academy of Sciences Publication Activity Database
Jandl, S.; Mansouri, S.; Mukhin, A.A.; Ivanov, V.Yu.; Balbashov, A.; Gospodino, M.M.; Nekvasil, Vladimír; Orlita, Milan
2011-01-01
Roč. 323, č. 8 (2011), s. 1104-1108 ISSN 0304-8853 R&D Projects: GA AV ČR IAA100100803 Institutional research plan: CEZ:AV0Z10100521 Keywords : manganite * multiferroic * Raman active phonons * crystal fields Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 1.780, year: 2011
Oudich, M.; Djafari-Rouhani, B.; Bonello, B.; Pennec, Y.; Hemaidia, S.; Sarry, F.; Beyssen, D.
2018-03-01
We present a design of phononic crystal based on pillars distributed on a substrate surface in which each pillar is constructed by a periodic stacking of PMMA and silicon layers. The pillar behaves like a one-dimensional phononic crystal which allows the creation of band gaps that prohibit wave propagation along the pillar. Thanks to this property, we show that confined modes are produced at the pillar-substrate interface which couples with surface acoustic waves (SAW) and causes their attenuation. Furthermore, by tailoring a defect inside the phononic pillar, we reveal the possibility to create confined cavity modes inside the band gap which can strongly couple with SAW. The cavity modes can be excited by SAW and the coupling produces sharp SAW transmissions. Additionally, we demonstrate that the coupling between the cavity modes and the confined modes at the pillar-substrate interface can give rise to a Fano-like resonance. We also evidence the possibility of generating an acoustic analogue of electromagnetically induced transparency for SAW with high transmission in a narrow bandwidth. The system presents perspectives for the design of high-quality-factor phononic excitation for optomechanic devices and phonon circuits based on SAW manipulation.
Nardi, Damiano; Travagliati, Marco; Siemens, Mark E; Li, Qing; Murnane, Margaret M; Kapteyn, Henry C; Ferrini, Gabriele; Parmigiani, Fulvio; Banfi, Francesco
2011-10-12
High-frequency surface acoustic waves can be generated by ultrafast laser excitation of nanoscale patterned surfaces. Here we study this phenomenon in the hypersonic frequency limit. By modeling the thermomechanics from first-principles, we calculate the system's initial heat-driven impulsive response and follow its time evolution. A scheme is introduced to quantitatively access frequencies and lifetimes of the composite system's excited eigenmodes. A spectral decomposition of the calculated response on the eigemodes of the system reveals asymmetric resonances that result from the coupling between surface and bulk acoustic modes. This finding allows evaluation of impulsively excited pseudosurface acoustic wave frequencies and lifetimes and expands our understanding of the scattering of surface waves in mesoscale metamaterials. The model is successfully benchmarked against time-resolved optical diffraction measurements performed on one-dimensional and two-dimensional surface phononic crystals, probed using light at extreme ultraviolet and near-infrared wavelengths.
Waveguiding Effect in the Gigahertz Frequency Range in Pillar-based Phononic-Crystal Slabs
Pourabolghasem, Reza; Dehghannasiri, Razi; Eftekhar, Ali Asghar; Adibi, Ali
2018-01-01
The waveguiding effect for a phononic-crystal (PnC)-based device operating in the gigahertz (GHz) frequency regime is experimentally demonstrated. To that end, a metallic pillar-based PnC membrane with a PnC band gap in the GHz frequency range is designed, and, based on that, an acoustic waveguide operating in the GHz regime is designed and fabricated. To characterize the fabricated PnC waveguide, a set of focusing interdigital transducers is designed and fabricated, enabling efficient excitation and detection of acoustic signals inside the PnC waveguide. The finite-element method is used to study the acoustic properties of the proposed structures and optimize their design. Experimental evidence supporting the existence of the waveguiding effect in the proposed structure in the GHz frequency regime is provided, showing reasonable agreement with the numerical calculations.
Guiding and confinement of interface acoustic waves in solid-fluid pillar-based phononic crystals
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M. F. Mohd Razip Wee
2016-12-01
Full Text Available Pillar-based phononic crystals exhibit some unique wave phenomena due to the interaction between surface acoustic modes of the substrate and local resonances supported by pillars. In this paper, we extend the investigations by taking into account the presence of a liquid medium. We particularly demonstrate that local resonances dramatically decrease the phase velocity of Scholte-Stoneley wave, which leads to a slow wave at the solid/fluid interface. Moreover, we show that increasing the height of pillars introduces a new set of branches of interface modes and drastically affects the acoustic energy localization. Indeed, while some modes display a highly confined pressure between pillars, others exponentially decay in the fluid or only propagate in the solid without disturbing the fluid pressure. These theoretical results, performed by finite element method, highlight a new acoustic wave confinement suitable in various applications such as acoustophoresis, lab on chip and microfluidics.
Band Structures Analysis Method of Two-Dimensional Phononic Crystals Using Wavelet-Based Elements
Directory of Open Access Journals (Sweden)
Mao Liu
2017-10-01
Full Text Available A wavelet-based finite element method (WFEM is developed to calculate the elastic band structures of two-dimensional phononic crystals (2DPCs, which are composed of square lattices of solid cuboids in a solid matrix. In a unit cell, a new model of band-gap calculation of 2DPCs is constructed using plane elastomechanical elements based on a B-spline wavelet on the interval (BSWI. Substituting the periodic boundary conditions (BCs and interface conditions, a linear eigenvalue problem dependent on the Bloch wave vector is derived. Numerical examples show that the proposed method performs well for band structure problems when compared with those calculated by traditional FEM. This study also illustrates that filling fractions, material parameters, and incline angles of a 2DPC structure can cause band-gap width and location changes.
First-principles study of Dirac and Dirac-like cones in phononic and photonic crystals
Mei, Jun
2012-07-24
By using the k•p method, we propose a first-principles theory to study the linear dispersions in phononic and photonic crystals. The theory reveals that only those linear dispersions created by doubly degenerate states can be described by a reduced Hamiltonian that can be mapped into the Dirac Hamiltonian and possess a Berry phase of -π. Linear dispersions created by triply degenerate states cannot be mapped into the Dirac Hamiltonian and carry no Berry phase, and, therefore should be called Dirac-like cones. Our theory is capable of predicting accurately the linear slopes of Dirac and Dirac-like cones at various symmetry points in a Brillouin zone, independent of frequency and lattice structure. © 2012 American Physical Society.
Realization of a 33 GHz phononic crystal fabricated in a freestanding membrane
Directory of Open Access Journals (Sweden)
Drew F. Goettler
2011-12-01
Full Text Available Phononic crystals (PnCs are man-made structures with periodically varying material properties such as density, ρ, and elastic modulus, E. Periodic variations of the material properties with nanoscale characteristic dimensions yield PnCs that operate at frequencies above 10 GHz, allowing for the manipulation of thermal properties. In this article, a 2D simple cubic lattice PnC operating at 33 GHz is reported. The PnC is created by nanofabrication with a focused ion beam. A freestanding membrane of silicon is ion milled to create a simple cubic array of 32 nm diameter holes that are subsequently backfilled with tungsten to create inclusions at a spacing of 100 nm. Simulations are used to predict the operating frequency of the PnC. Additional modeling shows that milling a freestanding membrane has a unique characteristic; the exit via has a conical shape, or trumpet-like appearance.
Opening complete band gaps in two dimensional locally resonant phononic crystals
Zhou, Xiaoling; Wang, Longqi
2018-05-01
Locally resonant phononic crystals (LRPCs) which have low frequency band gaps attract a growing attention in both scientific and engineering field recently. Wide complete locally resonant band gaps are the goal for researchers. In this paper, complete band gaps are achieved by carefully designing the geometrical properties of the inclusions in two dimensional LRPCs. The band structures and mechanisms of different types of models are investigated by the finite element method. The translational vibration patterns in both the in-plane and out-of-plane directions contribute to the full band gaps. The frequency response of the finite periodic structures demonstrate the attenuation effects in the complete band gaps. Moreover, it is found that the complete band gaps can be further widened and lowered by increasing the height of the inclusions. The tunable properties by changing the geometrical parameters provide a good way to open wide locally resonant band gaps.
Kokkedee, J.J.J.
As predicted by harmonic theory the outgoing inelastic spectrum of neutrons, scattered coherently by a single crystal, for a particular angle of scattering consists of a number of delta-function peaks superposed on a continuous background. The peaks correspond to one-phonon processes in which one
Mavrin, B. N.; Reshetnyak, V. V.
2017-07-01
Using the DFT method, we study the phonon properties of an α-B12 rhombohedral crystal in the basis set of plane waves and its electronic structure in the localized basis set of Gaussians. It follows from the phonon dispersion that the crystal possesses a dynamical stability. The effective Born charges, the oscillator strengths, the transverse-longitudinal splitting, and the dielectric functions of dipole modes are calculated. We show that charge transfer from polar to equatorial atoms takes place in a B12 icosahedron, while B-B bonds have predominantly a covalent character. In the density of states of acoustic modes, we reveal a structure that can manifest itself in the spectra of disordered boron compounds. From the dispersion of electronic bands, the occurrence of an indirect energy gap follows. The overlap of partial densities implies the hybridization of s and p electronic states in boron atoms.
Energy Technology Data Exchange (ETDEWEB)
2014-11-24
ThermoPhonon is a stand-alone code, which can be integrated into other software packages. Typically, it is used together with a density functional theory (DFT) code (such as VASP, Wien2k, AbInit, SIESTA) and a phonon code (such as Phonopy or Phon). The workflow is the following. Molecular dynamics (MD) in a supercell at a given temperature T is performed using another code. After sufficient equilibration, the output in the form of atomic positions and forces for a large number of selected MD steps is recorded into a file. If needed, one can modify this file by applying additional constraints, such as enforced crystal symmetry or subtracted motion of the center of mass. ThermoPhonon reads the file with atomic positions and forces and writes a new file with the force constants. Force constants can be used by another code (such as Phonopy or Phon) to produce phonon spectrum for plotting, in the assumption of known equilibrium atomic positions provided in a separate file.
NanoFIBrication of a two-dimensional phononic crystal in a free standing membrane.
Energy Technology Data Exchange (ETDEWEB)
Leseman, Zayd C. (University of New Mexico, Albuquerque, NM); Goettler, Drew F. (University of New Mexico, Albuquerque, NM); Su, Mehmet F. (University of New Mexico, Albuquerque, NM); El-Kady, Ihab Fathy; Olsson, Roy H., III
2010-06-01
A two-dimensional phononic crystal (PnC) that can operate in the GHz range is created in a freestanding silicon substrate using NanoFIBrication (using a focused ion beam (FIB) to fabricate nanostructures). First, a simple cubic 6.75 x 6.75 ?m array of vias with 150 nm spacing is generated. After patterning the vias, they are backfilled with void-free tungsten scatterers. Each via has a diameter of 48 nm. Numerical calculations predict this 2D PnC will generate a band gap near 22 GHz. A protective layer of chromium on top of the thin (100 nm) silicon membrane confines the surface damage to the chromium, which can be removed at a later time. Inspection of the underside of the membrane shows the vias flaring out at the exit, which we are dubbing the 'trumpet effect'. The trumpet effect is explained by modeling the lateral damage in a freestanding membrane.
An ultra-accurate numerical method in the design of liquid phononic crystals with hard inclusion
Li, Eric; He, Z. C.; Wang, G.; Liu, G. R.
2017-12-01
The phononics crystals (PCs) are periodic man-made composite materials. In this paper, a mass-redistributed finite element method (MR-FEM) is formulated to study the wave propagation within liquid PCs with hard inclusion. With a perfect balance between stiffness and mass in the MR-FEM model, the dispersion error of longitudinal wave is minimized by redistribution of mass. Such tuning can be easily achieved by adjusting the parameter r that controls the location of integration points of mass matrix. More importantly, the property of mass conservation in the MR-FEM model indicates that the locations of integration points inside or outside the element are immaterial. Four numerical examples are studied in this work, including liquid PCs with cross and circle hard inclusions, different size of inclusion and defect. Compared with standard finite element method, the numerical results have verified the accuracy and effectiveness of MR-FEM. The proposed MR-FEM is a unique and innovative numerical approach with its outstanding features, which has strong potentials to study the stress wave within multi-physics PCs.
Anisotropic surface acoustic waves in tungsten/lithium niobate phononic crystals
Sun, Jia-Hong; Yu, Yuan-Hai
2018-02-01
Phononic crystals (PnC) were known for acoustic band gaps for different acoustic waves. PnCs were already applied in surface acoustic wave (SAW) devices as reflective gratings based on the band gaps. In this paper, another important property of PnCs, the anisotropic propagation, was studied. PnCs made of circular tungsten films on a lithium niobate substrate were analyzed by finite element method. Dispersion curves and equal frequency contours of surface acoustic waves in PnCs of various dimensions were calculated to study the anisotropy. The non-circular equal frequency contours and negative refraction of group velocity were observed. Then PnC was applied as an acoustic lens based on the anisotropic propagation. Trajectory of SAW passing PnC lens was calculated and transmission of SAW was optimized by selecting proper layers of lens and applying tapered PnC. The result showed that PnC lens can suppress diffraction of surface waves effectively and improve the performance of SAW devices.
Extreme control of impulse transmission by cylinder-based nonlinear phononic crystals
Chaunsali, Rajesh; Toles, Matthew; Yang, Jinkyu; Kim, Eunho
2017-10-01
We present a novel device that can offer two extremes of elastic wave propagation - nearly complete transmission and strong attenuation under impulse excitation. The mechanism of this highly tunable device relies on intermixing effects of dispersion and nonlinearity. The device consists of identical cylinders arranged in a chain, which interact with each other as per nonlinear Hertz contact law. For a 'dimer' configuration, i.e., two different contact angles alternating in the chain, we analytically, numerically, and experimentally show that impulse excitation can either propagate as a localized wave, or it can travel as a highly dispersive wave. Remarkably, these extremes can be achieved in this periodic arrangement simply by in-situ control of contact angles between cylinders. We close the discussion by highlighting the key characteristics of the mechanisms that facilitate strong attenuation of incident impulse. These include low-to-high frequency scattering, and turbulence-like cascading in a periodic system. We thus envision that these adaptive, cylinder-based nonlinear phononic crystals, in conjunction with conventional impact mitigation mechanisms, could be used to design highly tunable and efficient impact manipulation devices.
Strong Carrier–Phonon Coupling in Lead Halide Perovskite Nanocrystals
2017-01-01
We highlight the importance of carrier–phonon coupling in inorganic lead halide perovskite nanocrystals. The low-temperature photoluminescence (PL) spectrum of CsPbBr3 has been investigated under a nonresonant and a nonstandard, quasi-resonant excitation scheme, and phonon replicas of the main PL band have been identified as due to the Fröhlich interaction. The energy of longitudinal optical (LO) phonons has been determined from the separation of the zero phonon band and phonon replicas. We reason that the observed LO phonon coupling can only be related to an orthorhombically distorted crystal structure of the perovskite nanocrystals. Additionally, the strength of carrier–phonon coupling has been characterized using the ratio between the intensities of the first phonon replica and the zero-phonon band. PL emission from localized versus delocalized carriers has been identified as the source of the observed discrepancies between the LO phonon energy and phonon coupling strength under quasi-resonant and nonresonant excitation conditions, respectively. PMID:29019652
Phonon-induced renormalization of the electron spectrum of biased bilayer graphene
Kryuchkov, S. V.; Kukhar, E. I.
2018-05-01
The effect of the electron-phonon interaction on the electron subsystem of the bilayer graphene has been investigated in the case when there is a potential bias between the graphene layers. The electron-phonon interaction has been shown to lead to increasing of the curvature of the lower dispersion branch of the conduction band of the bigraphene in the vicinity of the Dirac point. The latter corresponds to the decreasing of the absolute value of the electron effective mass. The corresponding correction to the effective mass has been calculated. Dependence of this correction on the bias has been investigated. Influence of such effect on the bigraphene conductivity is discussed.
Study of crystal-field excitations and Raman active phonons in o-DyMnO3
International Nuclear Information System (INIS)
Jandl, S.; Mansouri, S.; Mukhin, A.A.; Yu Ivanov, V.; Balbashov, A.; Gospodino, M.M.; Nekvasil, V.; Orlita, M.
2011-01-01
In DyMnO 3 orthorhombic single crystals, the weak Raman active phonon softening below T=100 K is correlated with the study of infrared active Dy 3+ CF excitations as a function of temperature and under applied magnetic field. We detect five H 13/2 CF transitions that we predict with appropriate CF Hamiltonian and we confirm that the magnetic easy axis lies in the ab plane. While the CF energy level shifts below T=100 K reflect different displacements of the oxygen ions that contribute to the phonon softening, lifting of the ground state Kramers doublet degeneracy (∼30 cm -1 ) is observed below T N =39 K due to the anisotropic Mn 3+ -Dy 3+ interaction, which could be responsible for the stability of the bc-cycloid ferroelectric phase. - Research highlights: → Origin of Raman active phonon softening in the multiferroic o-DyMnO 3 . → A crystal-field study under magnetic field of Dy 3+ in o-DyMnO 3 . → Location of the magnetic easy axis in o-DyMnO 3 . → Lifting of Kramers doublet degeneracy in o-DyMnO 3 .
Lattice instability and soft phonons in single-crystal La/sub 2-//sub x/Sr/sub x/CuO4
International Nuclear Information System (INIS)
Boeni, P.; Axe, J.D.; Shirane, G.
1988-01-01
The dispersion of the low-lying phonon branches of several doped and undoped single crystals of La/sub 2-//sub x/Sr/sub x/CuO 4 have been investigated by using inelastic-neutron-scattering techniques. The zone-center modes are in good agreement with Raman measurements. The reported peaks in the phonon density of states show up at energies that correspond to extrema in the dispersion curves of the transverse and longitudinal acoustic branches near the zone boundary. The tetragonal-to-orthorhombic phase transition is caused by a softening of transverse-optic-phonon mode at the X point. The rotational nature of the soft mode leads to moderate weak electron-phonon coupling and the mode is unlikely to enhance significantly conventional phonon mediated superconductivity. We did not observe any evidence for the predicted breathing-mode instability near the zone boundary
International Nuclear Information System (INIS)
Zhang, Shunzu; Gao, Yuanwen
2017-01-01
A theoretical model is established to study the size-dependent performance of flexural wave propagation in magneto-elastic phononic crystal (PC) nanobeam with surface effect based on Euler–Bernoulli beam theory and Gurtin–Murdoch theory. Considering the magneto-mechanical coupling constitutive relation of magnetostrictive material, the influence of surface effect on band structure is calculated by the plane wave expansion method for PC nanobeam subjected to pre-stress and magnetic field loadings. Through the example of an epoxy/Terfenol-D PC nanobeam, it can be observed that the characteristics of flexural wave band structures are size-dependent, and remarkably affected by surface effect when the dimension of the PC beam reduces to the nanoscale. The edges and width of the band gap with surface effect are higher than those without surface effect, especially for high frequency region. And surface effect gradually reduces with the increasing of bulk layer-to-surface layer thickness ratio until the band gap descends to a constant for the conventional one in the absence of surface effect. The effects of surface elasticity and piezomagneticity on band gap are more prominent than the residual surface stress. In addition, a distinctly nonlinear variation of band gap appears under the combined effects of pre-stress and magnetic field. Moreover, with the varying of filling fraction, multi-peaks of the width of the band gap are obtained and discussed. These results could be helpful for the intelligent regulation of magneto-elastic PC nanobeam and the design of nanobeam-based devices. (paper)
Zhang, Shunzu; Gao, Yuanwen
2017-11-01
A theoretical model is established to study the size-dependent performance of flexural wave propagation in magneto-elastic phononic crystal (PC) nanobeam with surface effect based on Euler-Bernoulli beam theory and Gurtin-Murdoch theory. Considering the magneto-mechanical coupling constitutive relation of magnetostrictive material, the influence of surface effect on band structure is calculated by the plane wave expansion method for PC nanobeam subjected to pre-stress and magnetic field loadings. Through the example of an epoxy/Terfenol-D PC nanobeam, it can be observed that the characteristics of flexural wave band structures are size-dependent, and remarkably affected by surface effect when the dimension of the PC beam reduces to the nanoscale. The edges and width of the band gap with surface effect are higher than those without surface effect, especially for high frequency region. And surface effect gradually reduces with the increasing of bulk layer-to-surface layer thickness ratio until the band gap descends to a constant for the conventional one in the absence of surface effect. The effects of surface elasticity and piezomagneticity on band gap are more prominent than the residual surface stress. In addition, a distinctly nonlinear variation of band gap appears under the combined effects of pre-stress and magnetic field. Moreover, with the varying of filling fraction, multi-peaks of the width of the band gap are obtained and discussed. These results could be helpful for the intelligent regulation of magneto-elastic PC nanobeam and the design of nanobeam-based devices.
International Nuclear Information System (INIS)
Chen, R.; Trucano, P.
1978-01-01
The mean-square amplitudes of vibration in graphite based on an X-ray charge-density analysis are 0.0032 (2) and 0.0140 (3) A 2 parallel to and perpendicular to the basal plane, respectively. Values for the parallel vibrations of 0.0031 (6) and 0.0032 A 2 were derived from temperature-dependent neutron measurements and a calculated phonon spectrum. The neutron measurements and the phonon spectrum both predict lower values [0.0090 (20) and 0.0098 A 2 ] for the out-of-plane vibrations. This small discrepancy may be caused by small changes in the core atomic scattering factors from the free-atom values or by a deficiency in the phonon-spectrum model. (Auth.)
Light scattering by photonic crystals with a dirac spectrum
Sepkhanov, Ruslan
2009-01-01
In this thesis we consider several effects of a Dirac spectrum in photonic crystals on the scattering and propagation of light. We calculate the effect of a Dirac point (a conical singularity in the band structure) on the transmission of radiation through a photonic crystal. We find that the
Spectrum of a one-atom laser in photonic crystals
International Nuclear Information System (INIS)
Florescu, Lucia
2006-01-01
The emission spectrum of a single-emitter laser in a photonic crystal is presented. We consider a coherently pumped two-level emitter strongly coupled to a high-quality microcavity engineered within a photonic crystal. We show that the cavity spectrum consists of both elastic and inelastic components, for which we derive analytical expressions. Our study reveals enhanced, spectrally narrower emission resulting from the radiation reservoir of the photonic crystal. The cavity field spectral characteristics are fundamentally distinct from those of a corresponding microcavity in ordinary vacuum. At high pump intensities and for large discontinuities in the photon density of states between Mollow spectral components of atomic resonance fluorescence, the emitted intensity originating from the elastic spectral component increases with the intensity of the pump and the elastic component dominates the spectrum. In the case of a vanishing photon density of states in the spectral range surrounding the lower Mollow sideband and no dipolar dephasing, the cavity spectrum is elastic
International Nuclear Information System (INIS)
Audzijonis, A.; Zigas, L.; Vinokurova, I.V.; Farberovic, O.V.; Zaltauskas, R.; Cijauskas, E.; Pauliukas, A.; Kvedaravicius, A.
2006-01-01
The force constants of SbSI crystal have been calculated by the pseudo-potential method. The frequencies and normal coordinates of SbSI vibration modes along the c (z) direction have been determined in harmonic approximation. The potential energies of SbSI normal modes dependence on normal coordinates along the c (z) direction V(z) have been determined in anharmonic approximation, taking into account the interaction between the phonons. It has been found, that in the range of 30-120 cm -1 , the vibrational spectrum is determined by a V(z) double-well normal mode, but in the range of 120-350 cm -1 , it is determined by a V(z) single-well normal mode
Ab initio calculation of electron–phonon coupling in monoclinic β-Ga2O3 crystal
International Nuclear Information System (INIS)
Ghosh, Krishnendu; Singisetti, Uttam
2016-01-01
The interaction between electrons and vibrational modes in monoclinic β-Ga 2 O 3 is theoretically investigated using ab-initio calculations. The large primitive cell of β-Ga 2 O 3 gives rise to 30 phonon modes all of which are taken into account in transport calculation. The electron-phonon interaction is calculated under density functional perturbation theory and then interpolated using Wannier–Fourier interpolation. The long-range interaction elements between electrons and polar optical phonon (POP) modes are calculated separately using the Born effective charge tensor. The direction dependence of the long-range POP coupling in a monoclinic crystal is explored and is included in the transport calculations. Scattering rate calculations are done using the Fermi golden rule followed by solving the Boltzmann transport equation using the Rode's method to estimate low field mobility. A room temperature mobility of 115 cm 2 /V s is observed. Comparison with recent experimentally reported mobility is done for a wide range of temperatures (30 K–650 K). It is also found that the POP interaction dominates the electron mobility under low electric field conditions. The relative contribution of the different POP modes is analyzed and the mode 21 meV POP is found to have the highest impact on low field electron mobility at room temperature.
Gorisse, M.; Benchabane, S.; Teissier, G.; Billard, C.; Reinhardt, A.; Laude, V.; Defaÿ, E.; Aïd, M.
2011-06-01
We report on the observation of elastic waves propagating in a two-dimensional phononic crystal composed of air holes drilled in an aluminum nitride membrane. The theoretical band structure indicates the existence of an acoustic band gap centered around 800 MHz with a relative bandwidth of 6.5% that is confirmed by gigahertz optical images of the surface displacement. Further electrical measurements and computation of the transmission reveal a much wider attenuation band that is explained by the deaf character of certain bands resulting from the orthogonality of their polarization with that of the source.
Oseev, Aleksandr; Lucklum, Ralf; Zubtsov, Mikhail; Schmidt, Marc-Peter; Mukhin, Nikolay V; Hirsch, Soeren
2017-09-23
The current work demonstrates a novel surface acoustic wave (SAW) based phononic crystal sensor approach that allows the integration of a velocimetry-based sensor concept into single chip integrated solutions, such as Lab-on-a-Chip devices. The introduced sensor platform merges advantages of ultrasonic velocimetry analytic systems and a microacoustic sensor approach. It is based on the analysis of structural resonances in a periodic composite arrangement of microfluidic channels confined within a liquid analyte. Completed theoretical and experimental investigations show the ability to utilize periodic structure localized modes for the detection of volumetric properties of liquids and prove the efficacy of the proposed sensor concept.
Calculation of energy relaxation rates of fast particles by phonons in crystals
Energy Technology Data Exchange (ETDEWEB)
Prange, Micah P.; Campbell, Luke W.; Wu, Dangxin; Gao, Fei; Kerisit, Sebastien N.
2015-03-01
We present ab initio calculations of the temperature-dependent exchange of energy between a classical charged point-particle and the phonons of a crystalline material. The phonons, which are computed using density functional perturbation theory (DFPT) methods, interact with the mov- ing particle via the Coulomb interaction between the density induced in the material by phonon excitation and the charge of the classical particle. Energy relaxation rates are computed using time- dependent perturbation theory. The method, which is applicable wherever DFPT is, is illustrated with results for CsI, an important scintillator whose performance is affected by electron thermal- ization. We discuss the influence of the form assumed for quasiparticle dispersion on theoretical estimates of electron cooling rates.
Gray, Kory Forrest
The goal of this project was to examine the possibility of creating a novel thermal infrared detector based on silicon CMOS technology that has been enhanced by the latest nano-engineering discoveries. Silicon typically is not thought as an efficient thermoelectric material. However recent advancements in nanotechnology have improved the potential for a highly sensitive infrared detector based on nano-structured silicon. The thermal conductivity of silicon has been shown to be reduced from 150 W/mK down to 60 W/mK just by decreasing the scale of the silicon from bulk down to the sub-micron scale. Further reduction of the thermal conductivity has been shown by patterning silicon with a phonon crystal structure which has been reported to have thermal conductivities down to 10 W/mK. The phonon crystal structure consists of a 2D array of holes that are etched into the silicon. The size and pitch of the holes are on the order of the mean free path of the phonons in silicon which is approximately 200-500nm. This particular device had 200nm holes on a 400nm pitch. The Seebeck coefficient of silicon can also be enhanced by the reduction of the material from the bulk to sub-micron scale and with degenerate level doping. The combination of decreased thermal conductivity and increased Seebeck coefficient allow silicon to be a promising material for thermoelectric infrared detectors. The highly doped silicon is desired to reduce the electrical resistance of the device. The low electrical resistance is required to reduce the Johnson noise of the device which is the dominant noise source for most thermal detectors. This project designed a MEMS thermopile using a silicon-on-insulator substrate, and a CMOS compatible process. The basic thermopile consists of a silicon dioxide membrane with phononic crystal patterned silicon thermocouples around the edges of the membrane. Vertical aligned, multi-walled, carbon nanotubes were used as the infrared absorption layer. A MEMS
Shcherbakov, A S; Arellanes, A O; Chavushyan, V
2016-12-01
We develop an advanced approach to the optical spectrometer with acousto-optical dynamic grating for the Guillermo Haro astrophysical observatory (Mexico). The progress consists of two principle novelties. First is the use of the acousto-optical nonlinearity of two-phonon light scattering in crystals with linear acoustic losses. This advanced regime of light scattering exhibits a recently revealed additional degree of freedom, which allows tuning of the frequency of elastic waves and admits the nonlinear apodization improving the dynamic range. The second novelty is the combination of the cross-disperser with acousto-optical processing. A similar pioneering step provides an opportunity to operate over all the visible range in a parallel regime with maximal achievable resolution. The observation window of the optical spectrometer in that observatory is ∼9 cm, so that the theoretical estimations of maximal performances for a low-loss LiNbO3 crystal for this optical aperture at λ=405 nm give spectral resolution of 0.0523 Å, resolving power of 77,400, and 57,500 spots. The illustrative proof-of-principle experiments with a 6 cm LiNbO3 crystal have been performed.
Guo, Xiao; Wei, Peijun
2016-03-01
The dispersion relations of elastic waves in a one-dimensional phononic crystal formed by periodically repeating of a pre-stressed piezoelectric slab and a pre-stressed piezomagnetic slab are studied in this paper. The influences of initial stress on the dispersive relation are considered based on the incremental stress theory. First, the incremental stress theory of elastic solid is extended to the magneto-electro-elasto solid. The governing equations, constitutive equations, and boundary conditions of the incremental stresses in a magneto-electro-elasto solid are derived with consideration of the existence of initial stresses. Then, the transfer matrices of a pre-stressed piezoelectric slab and a pre-stressed piezomagnetic slab are formulated, respectively. The total transfer matrix of a single cell in the phononic crystal is obtained by the multiplication of two transfer matrixes related with two adjacent slabs. Furthermore, the Bloch theorem is used to obtain the dispersive equations of in-plane and anti-plane Bloch waves. The dispersive equations are solved numerically and the numerical results are shown graphically. The oblique propagation and the normal propagation situations are both considered. In the case of normal propagation of elastic waves, the analytical expressions of the dispersion equation are derived and compared with other literatures. The influences of initial stresses, including the normal initial stresses and shear initial stresses, on the dispersive relations are both discussed based on the numerical results. Copyright © 2015 Elsevier B.V. All rights reserved.
International Nuclear Information System (INIS)
Yan Zhizhong; Zhang Chuanzeng; Wang Yuesheng
2011-01-01
The band structures of in-plane elastic waves propagating in two-dimensional phononic crystals with one-dimensional random disorder and aperiodicity are analyzed in this paper. The localization of wave propagation is discussed by introducing the concept of the localization factor, which is calculated by the plane-wave-based transfer-matrix method. By treating the random disorder and aperiodicity as the deviation from the periodicity in a special way, three kinds of aperiodic phononic crystals that have normally distributed random disorder, Thue-Morse and Rudin-Shapiro sequence in one direction and translational symmetry in the other direction are considered and the band structures are characterized using localization factors. Besides, as a special case, we analyze the band gap properties of a periodic planar layered composite containing a periodic array of square inclusions. The transmission coefficients based on eigen-mode matching theory are also calculated and the results show the same behaviors as the localization factor does. In the case of random disorders, the localization degree of the normally distributed random disorder is larger than that of the uniformly distributed random disorder although the eigenstates are both localized no matter what types of random disorders, whereas, for the case of Thue-Morse and Rudin-Shapiro structures, the band structures of Thue-Morse sequence exhibit similarities with the quasi-periodic (Fibonacci) sequence not present in the results of the Rudin-Shapiro sequence.
Energy Technology Data Exchange (ETDEWEB)
Zhang, Shunzu; Shi, Yang [Key Laboratory of Mechanics on Disaster and Environment in Western China attached to the Ministry of Education of China, Lanzhou University, Lanzhou, Gansu 730000 (China); Department of Mechanics and Engineering Sciences, College of Civil Engineering and Mechanics, Lanzhou University, Lanzhou, Gansu 730000 (China); Gao, Yuanwen, E-mail: ywgao@lzu.edu.cn [Key Laboratory of Mechanics on Disaster and Environment in Western China attached to the Ministry of Education of China, Lanzhou University, Lanzhou, Gansu 730000 (China); Department of Mechanics and Engineering Sciences, College of Civil Engineering and Mechanics, Lanzhou University, Lanzhou, Gansu 730000 (China)
2017-03-26
Considering the magneto-mechanical coupling of magnetostrictive material, the tunability of in-plane wave propagation in two-dimensional Terfenol-D/epoxy phononic crystal (PC) plate is investigated theoretically by the plane wave expansion method. Two Schemes, i.e. magnetic field is rotated in x–y plane and x–z plane, are studied, respectively. The effects of amplitude and direction of magnetic field, pre-stress and geometric parameters are discussed. For Scheme-I, band gap reaches the maximum at an optimal angle 45° of magnetic field. However, the optimal angle is 0° for Scheme-II, because band gap decreases monotonically until disappears with the increasing angle. For both cases, higher-order band gaps generate and become stronger as magnetic field amplitude increases, while increasing compressive pre-stress has the opposite effect. Meanwhile, filling fraction plays a key role in controlling band gaps. These results provide possibility for intelligent regulation and optimal design of PC plates. - Highlights: • The in-plane wave propagation in phononic crystal thin plate is tuned theoretically. • Magnetostrictive material is introduced in the study. • The effects of magnetic field and pre-stress are considered. • The variations of band gaps with external stimuli are discussed.
Hu, Jiaguang; Tang, Weiya
2018-01-01
This computational study focuses on a kind of two-dimensional steel cylinder/gas square lattice phononic crystal with an elliptical cylinder inserted into the primitive cell. The crystal's energy band structure is calculated using plane wave expansion (PWE) method. The irreducible Brillouin zone (IBZ) is found to have undergone significant changes with the insertion of elliptical cylinder: the energy band extrema deviated from their original positions, and the wave vector's scanning range needs to be expanded in order to obtain reliable energy band structure. Since the elliptical cylinder is less symmetrical than the cylinder, low frequency band gap is more readily formed with the insertion. Greater filling ratio yields wider band gap. The band gap can be tuned within a wide frequency range by varying the orientation of the inserted elliptical cylinder. The band gap can form at a relatively low filling ratio by moving the inserted elliptical cylinder along y-axis.
Yao, Mengliang; Zebarjadi, Mona; Opeil, Cyril P.
2017-10-01
We use a magnetothermal resistance method to measure lattice thermal conductivity of pure single crystal metals over the intermediate temperature range of 5-60 K. Large transverse magnetic fields are applied to suppress electronic thermal conduction. The total thermal conductivity and the electrical conductivity are measured as functions of applied magnetic field. The lattice thermal conductivity is then extracted by extrapolating the thermal conductivity versus electrical conductivity curve at zero electrical conductivity. We used this method to experimentally measure the lattice thermal conductivity and Lorenz number in single crystal Al (100), Cu (100), and Zn (001) in the intermediate temperature range. Our results show that the measured phonon thermal conductivity versus temperature plot has a peak around ΘD /10 , and the Lorenz number is found to deviate from the Sommerfeld value in the intermediate temperature range.
On the spectrum of facet crystallization waves at the smooth 4He crystal surface
International Nuclear Information System (INIS)
Burmistrov, S.N.
2011-01-01
The wavelike processes of crystallization and melting or crystallization waves are well known to exist at the 4 He crystal surface in the rough state. Much less is known about crystallization waves for the 4 He crystal surface in the smooth well-faceted state below the roughening transition temperature. To meet the lack, we analyze here the spectrum of facet crystallization waves and its dependence upon the wavelength, perturbation amplitude, and the number of possible facet steps distributed somehow over the wavelength. All the distinctive features of facet crystallization waves from conventional waves at the rough surface result from a nonanalytic cusplike behavior in the angle dependence for the surface tension of smooth crystal facets.
Phonon superradiance and phonon laser effect in nanomagnets.
Chudnovsky, E M; Garanin, D A
2004-12-17
We show that the theory of spin-phonon processes in paramagnetic solids must take into account the coherent generation of phonons by the magnetic centers. This effect should drastically enhance spin-phonon rates in nanoscale paramagnets and in crystals of molecular nanomagnets.
Ivanovski, V; Ivanovski, G
2010-05-01
The coupled-optical-phonon-mode theory of Barker and Hopfield of two mode interaction in isotropic crystals has been extended to monoclinic crystals. The analytical expressions for the calculation of the dielectric tensor elements in the ac crystal plane have been derived. It has been shown that the interaction dielectric model is a generalized expression of the dielectric tensor for monoclinic case when no interaction between modes is present. Also, the results of Barker and Hopfield are obtained from this more general theory, when an isotropic case is considered. In order to be able to investigate real crystals, meaning extending the interactions to a large number of pairs of modes, but at the same time to make the fitting procedure possible, a model dielectric function taking into account the interaction between modes with closest frequencies has been derived. The validity of the model obtained has been tested on a Tutton salt single crystal of K(2)Co(SO(4))(2).6H(2)O. The recorded spectra from the ac crystal plane were fitted in order to obtain best fit parameters. The comparison between the experimentally recorded spectra and the model reflectance function give good results and verify this model to be applicable. Copyright 2010 Elsevier B.V. All rights reserved.
A new class of tunable hypersonic phononic crystals based on polymer-tethered colloids.
Alonso-Redondo, E; Schmitt, M; Urbach, Z; Hui, C M; Sainidou, R; Rembert, P; Matyjaszewski, K; Bockstaller, M R; Fytas, G
2015-09-22
The design and engineering of hybrid materials exhibiting tailored phononic band gaps are fundamentally relevant to innovative material technologies in areas ranging from acoustics to thermo-optic devices. Phononic hybridization gaps, originating from the anti-crossing between local resonant and propagating modes, have attracted particular interest because of their relative robustness to structural disorder and the associated benefit to 'manufacturability'. Although hybridization gap materials are well known, their economic fabrication and efficient control of the gap frequency have remained elusive because of the limited property variability and expensive fabrication methodologies. Here we report a new strategy to realize hybridization gap materials by harnessing the 'anisotropic elasticity' across the particle-polymer interface in densely polymer-tethered colloidal particles. Theoretical and Brillouin scattering analysis confirm both the robustness to disorder and the tunability of the resulting hybridization gap and provide guidelines for the economic synthesis of new materials with deliberately controlled gap position and width frequencies.
Optical and acoustic sensing using Fano-like resonances in dual phononic and photonic crystal plate
International Nuclear Information System (INIS)
Amoudache, Samira; Moiseyenko, Rayisa; Pennec, Yan; Rouhani, Bahram Djafari; Khater, Antoine; Lucklum, Ralf; Tigrine, Rachid
2016-01-01
We perform a theoretical study based on the transmissions of optical and acoustic waves normally impinging to a periodic perforated silicon plate when the embedded medium is a liquid and show the existence of Fano-like resonances in both cases. The signature of the resonances appears as well-defined asymmetric peaks in the phononic and photonic transmission spectra. We show that the origin of the Fano-like resonances is different with respect to the nature of the wave. In photonic, the origin comes from guided modes in the photonic plate while in phononic we show that it comes from the excitation of standing waves confined inside the cavity coming from the deformation of the water/silicon edges of the cylindrical inclusion. We finally use these features for sensing and show ultra-sensitivity to the light and sound velocities for different concentrations of analytes.
Optical and acoustic sensing using Fano-like resonances in dual phononic and photonic crystal plate
DEFF Research Database (Denmark)
Amoudache, Samira; Moiseyenko, Rayisa; Pennec, Yan
2016-01-01
We perform a theoretical study based on the transmissions of optical and acoustic waves normally impinging to a periodic perforated silicon plate when the embedded medium is a liquid and show the existence of Fano-like resonances in both cases. The signature of the resonances appears as well......-defined asymmetric peaks in the phononic and photonic transmission spectra. We show that the origin of the Fano-like resonances is different with respect to the nature of the wave. In photonic, the origin comes from guided modes in the photonic plate while in phononic we show that it comes from the excitation...... of standing waves confined inside the cavity coming from the deformation of the water/silicon edges of the cylindrical inclusion. We finally use these features for sensing and show ultra-sensitivity to the light and sound velocities for different concentrations of analytes....
Optical and acoustic sensing using Fano-like resonances in dual phononic and photonic crystal plate
Energy Technology Data Exchange (ETDEWEB)
Amoudache, Samira [Institut d' Electronique, de Microélectronique et de Nanotechnologie, Université de Lille 1, 59655 Villeneuve d' Ascq (France); Laboratoire de Physique et Chimie Quantique, Université Mouloud Mammeri, B.P. 17 RP, 15000 Tizi-Ouzou (Algeria); Moiseyenko, Rayisa [Department of Physics, Technical University of Denmark, DTU Physics, Building 309, DK-2800 Kongens Lyngby (Denmark); Pennec, Yan, E-mail: yan.pennec@univ-lille1.fr; Rouhani, Bahram Djafari [Institut d' Electronique, de Microélectronique et de Nanotechnologie, Université de Lille 1, 59655 Villeneuve d' Ascq (France); Khater, Antoine [Institut des Molécules et Matériaux du Mans (IMMM), UMR CNRS 6283, l' UNAM, Université du Maine, 72085 Le Mans (France); Lucklum, Ralf [Institute of Micro and Sensor Systems (IMOS), Otto-von-Guericke-University, P.O. Box 4120, D-39016 Magdeburg (Germany); Tigrine, Rachid [Laboratoire de Physique et Chimie Quantique, Université Mouloud Mammeri, B.P. 17 RP, 15000 Tizi-Ouzou (Algeria)
2016-03-21
We perform a theoretical study based on the transmissions of optical and acoustic waves normally impinging to a periodic perforated silicon plate when the embedded medium is a liquid and show the existence of Fano-like resonances in both cases. The signature of the resonances appears as well-defined asymmetric peaks in the phononic and photonic transmission spectra. We show that the origin of the Fano-like resonances is different with respect to the nature of the wave. In photonic, the origin comes from guided modes in the photonic plate while in phononic we show that it comes from the excitation of standing waves confined inside the cavity coming from the deformation of the water/silicon edges of the cylindrical inclusion. We finally use these features for sensing and show ultra-sensitivity to the light and sound velocities for different concentrations of analytes.
International Nuclear Information System (INIS)
Dzyub, I.P.; Kochmarskij, V.Z.
1978-01-01
The specific features of coherent slow-neutron scattering in the neighbourhood of the quasilocal oscillation (QLO) frequency are investigated. By means of the calculation for a simple cubic crystal containing substitutional impurities it is demonstrated that the dispersion curves are discontinuous in the QLO frequency range. This dispersion curve discontinuity is associated with one-phonon peak in the neighbourhood of the QLO frequency. The results of neutron scattering experiments on Crsub(1-x)Wsub(x) and Cusub(1-x)Ausub(x) solutions are then considered from this standpoint. Selection rules for the phonon mass operator are established which allow to determine the symmetry of QLO which contribute to the broadening and shift of one-phonon peaks in the directions of high symmetry, depending on the transfer neutron-momentum orientation with respect to the principal axes of a crystal
Shcherbakov, Alexandre S; Arellanes, Adan Omar
2017-04-20
We present a principally new acousto-optical cell providing an advanced wideband spectrum analysis of ultra-high frequency radio-wave signals. For the first time, we apply a recently developed approach with the tilt angle to a one-phonon non-collinear anomalous light scattering. In contrast to earlier cases, now one can exploit a regime with the fixed optical wavelength for processing a great number of acoustic frequencies simultaneously in the linear regime. The chosen rutile-crystal combines a moderate acoustic velocity with low acoustic attenuation and allows us wide-band data processing within GHz-frequency acoustic waves. We have created and experimentally tested a 6-cm aperture rutile-made acousto-optical cell providing the central frequency 2.0 GHz, frequency bandwidth ∼0.52 GHz with the frequency resolution about 68.3 kHz, and ∼7620 resolvable spots. A similar cell permits designing an advanced ultra-high-frequency arm within a recently developed multi-band radio-wave acousto-optical spectrometer for astrophysical studies. This spectrometer is intended to operate with a few parallel optical arms for processing the multi-frequency data flows within astrophysical observations. Keeping all the instrument's advantages of the previous schematic arrangement, now one can create the highest-frequency arm using the developed rutile-based acousto-optical cell. It permits optimizing the performances inherent in that arm via regulation of both the central frequency and the frequency bandwidth for spectrum analysis.
Birefringent phononic structures
Directory of Open Access Journals (Sweden)
I. E. Psarobas
2014-12-01
Full Text Available Within the framework of elastic anisotropy, caused in a phononic crystal due to low crystallographic symmetry, we adopt a model structure, already introduced in the case of photonic metamaterials, and by analogy, we study the effect of birefringence and acoustical activity in a phononic crystal. In particular, we investigate its low-frequency behavior and comment on the factors which determine chirality by reference to this model.
Directory of Open Access Journals (Sweden)
Charles M. Reinke
2011-12-01
Full Text Available Recent work has demonstrated that nanostructuring of a semiconductor material to form a phononic crystal (PnC can significantly reduce its thermal conductivity. In this paper, we present a classical method that combines atomic-level information with the application of Bloch theory at the continuum level for the prediction of the thermal conductivity of finite-thickness PnCs with unit cells sized in the micron scale. Lattice dynamics calculations are done at the bulk material level, and the plane-wave expansion method is implemented at the macrosale PnC unit cell level. The combination of the lattice dynamics-based and continuum mechanics-based dispersion information is then used in the Callaway-Holland model to calculate the thermal transport properties of the PnC. We demonstrate that this hybrid approach provides both accurate and efficient predictions of the thermal conductivity.
High-frequency homogenization of zero frequency stop band photonic and phononic crystals
Antonakakis, Tryfon; Guenneau, Sebastien
2013-01-01
We present an accurate methodology for representing the physics of waves, for periodic structures, through effective properties for a replacement bulk medium: This is valid even for media with zero frequency stop-bands and where high frequency phenomena dominate. Since the work of Lord Rayleigh in 1892, low frequency (or quasi-static) behaviour has been neatly encapsulated in effective anisotropic media. However such classical homogenization theories break down in the high-frequency or stop band regime. Higher frequency phenomena are of significant importance in photonics (transverse magnetic waves propagating in infinite conducting parallel fibers), phononics (anti-plane shear waves propagating in isotropic elastic materials with inclusions), and platonics (flexural waves propagating in thin-elastic plates with holes). Fortunately, the recently proposed high-frequency homogenization (HFH) theory is only constrained by the knowledge of standing waves in order to asymptotically reconstruct dispersion curves an...
Disordered Zinc in Zn4Sb3 with Phonon-Glass and Electron-Crystal Thermoelectric Properties
Snyder, G. Jeffrey; Christensen, Mogens; Nishibori, Eiji; Caillat, Thierry; Brummerstedt Iversen, Bo
2004-01-01
By converting waste heat into electricity, thermoelectric generators could be an important part of the solution to today's energy challenges. The compound Zn4Sb3 is one of the most efficient thermoelectric materials known. Its high efficiency results from an extraordinarily low thermal conductivity in conjunction with the electronic structure of a heavily doped semiconductor. Previous structural studies have been unable to explain this unusual combination of properties. Here, we show through a comprehensive structural analysis using single-crystal X-ray and powder-synchrotron-radiation diffraction methods, that both the electronic and thermal properties of Zn4Sb3 can be understood in terms of unique structural features that have been previously overlooked. The identification of Sb3- ions and Sb-2(4-) dimers reveals that Zn4Sb3 is a valence semiconductor with the ideal stoichiometry Zn13Sb10. In addition, the structure contains significant disorder, with zinc atoms distributed over multiple positions. The discovery of glass-like interstitial sites uncovers a highly effective mechanism for reducing thermal conductivity. Thus Zn4Sb3 is in many ways an ideal 'phonon glass, electron crystal' thermoelectric material.
Czech Academy of Sciences Publication Activity Database
Rameš, Michal; Železný, Vladimír; Gregora, Ivan; Wolf, T.; Jirsa, Miloš
2015-01-01
Roč. 197, Jul (2015), 10-17 ISSN 0921-5107 R&D Projects: GA MŠk(CZ) ME10069 Institutional support: RVO:68378271 Keywords : cuprate superconductors * phonons * crystal field * vortex pinning Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 2.331, year: 2015
Phonon engineering for nanostructures.
Energy Technology Data Exchange (ETDEWEB)
Aubry, Sylvie (Stanford University); Friedmann, Thomas Aquinas; Sullivan, John Patrick; Peebles, Diane Elaine; Hurley, David H. (Idaho National Laboratory); Shinde, Subhash L.; Piekos, Edward Stanley; Emerson, John Allen
2010-01-01
Understanding the physics of phonon transport at small length scales is increasingly important for basic research in nanoelectronics, optoelectronics, nanomechanics, and thermoelectrics. We conducted several studies to develop an understanding of phonon behavior in very small structures. This report describes the modeling, experimental, and fabrication activities used to explore phonon transport across and along material interfaces and through nanopatterned structures. Toward the understanding of phonon transport across interfaces, we computed the Kapitza conductance for {Sigma}29(001) and {Sigma}3(111) interfaces in silicon, fabricated the interfaces in single-crystal silicon substrates, and used picosecond laser pulses to image the thermal waves crossing the interfaces. Toward the understanding of phonon transport along interfaces, we designed and fabricated a unique differential test structure that can measure the proportion of specular to diffuse thermal phonon scattering from silicon surfaces. Phonon-scale simulation of the test ligaments, as well as continuum scale modeling of the complete experiment, confirmed its sensitivity to surface scattering. To further our understanding of phonon transport through nanostructures, we fabricated microscale-patterned structures in diamond thin films.
Crystal excitations features in the photon emission spectrum of the quantum channeled particle
Energy Technology Data Exchange (ETDEWEB)
Mazur, E.A., E-mail: eugen_mazur@mail.ru
2015-07-15
The processes of generation of phonons and electron excitations with quantum oriented particle in crystal are considered. Expressions are obtained for the probability of emission of phonons and plasmons with channeled particle. The theory of the processes of the crystal excitation with the channeled particle, accompanied by the simultaneous emission of a photon is developed. It is proved that all the specific features of the electron and phonon crystal excitation structure appear as components of radiation of the oriented fast charged particle. The photon emission of a quantum channeled particle, accompanied by a plasmon excitation in a crystal target is considered. It is taken into account that the plasmon energy in the crystal is of the same order with the depth of the potential well in which the channeled particle moves. A weak dispersion of the plasmons in the crystal is taken into account, which leads to the selection of the fixed plasmon energy. It is shown that fast charged particle in the rest frame emits photons with an energy equal to the energy difference between two quantized levels of transverse motion with the deduction of the net plasmon energy. The characteristics of photon-plasmon radiation are investigated.
Disorder-induced broadening of transverse acoustic phonons in SixGe1-x mixed crystals
Czech Academy of Sciences Publication Activity Database
Beraud, A.; Kulda, Jiří; Yonenaga, I.; Foret, M.; Salce, B.; Courtens, E.
2004-01-01
Roč. 350, č. 1 (2004), s. 254-257 ISSN 0921-4526 R&D Projects: GA AV ČR KSK1010104 Keywords : disordered crystals * acoustic branches Subject RIV: BG - Nuclear, Atomic and Molecular Physics, Colliders Impact factor: 0.679, year: 2004
Merkel, A; Tournat, V; Gusev, V
2014-08-01
We report the experimental observation of the gravity-induced asymmetry for the nonlinear transformation of acoustic waves in a noncohesive granular phononic crystal. Because of the gravity, the contact precompression increases with depth inducing space variations of not only the linear and nonlinear elastic moduli but also of the acoustic wave dissipation. We show experimentally and explain theoretically that, in contrast to symmetric propagation of linear waves, the amplitude of the nonlinearly self-demodulated wave depends on whether the propagation of the waves is in the direction of the gravity or in the opposite direction. Among the observed nonlinear processes, we report frequency mixing of the two transverse-rotational modes belonging to the optical band of vibrations and propagating with negative phase velocities, which results in the excitation of a longitudinal wave belonging to the acoustic band of vibrations and propagating with positive phase velocity. We show that the measurements of the gravity-induced asymmetry in the nonlinear acoustic phenomena can be used to compare the in-depth distributions of the contact nonlinearity and of acoustic absorption.
Prasad, Neena; Balasubramanian, Karthikeyan
2017-02-01
We report, the enhanced photocatalytic behaviour of Cu doped ZnS micro crystals. ZnS and different concentrations of Cu doped ZnS microcrystals were prepared. X-ray diffraction confirms the crystalline and phase of the particles. Morphology and sizes were studied using Scanning Electron Microscopy (SEM). Recorded optical absorption spectra show a band for around 365 nm for pure ZnS, but there is a broad band in the near infrared regime for the Cu-doped ZnS microcrystals which are attributed to the d-d transitions of Cu2 + ions. Phonon properties of as-prepared samples were investigated using Raman spectroscopy. Present work we investigate the potential of ZnS and Cu doped ZnS as a photocatalyst. For this from the degradation of methylene blue dye in aqueous media the photocatalytic activity of pure and highest doped ZnS samples with the irradiation of white light and infrared, enhanced photocatalytic activity were observed. Mechanism of white light an IR light based photocatalytic activity is explained based on the electron-hole pair production.
Energy Technology Data Exchange (ETDEWEB)
Aliev, Gazi N., E-mail: g.aliev@bath.ac.uk; Goller, Bernhard [Department of Physics, University of Bath, Bath BA2 7AY (United Kingdom)
2014-09-07
A one-dimensional Fibonacci phononic crystal and a distributed Bragg reflector were constructed from porous silicon. The structures had the same number of layers and similar acoustic impedance mismatch, and were electrochemically etched in highly boron doped silicon wafers. The thickness of the individual layers in the stacks was approximately 2 μm. Both types of hypersonic band gap structure were studied by direct measurement of the transmittance of longitudinal acoustic waves in the 0.1–2.6 GHz range. Acoustic band gaps deeper than 50 dB were detected in both structures. The experimental results were compared with model calculations employing the transfer matrix method. The acoustic properties of periodic and quasi-periodic structures in which half-wave retarding bi-layers do not consist of two quarter-wave retarding layers are discussed. The strong correlation between width and depth of gaps in the transmission spectra is demonstrated. The dominant mechanisms of acoustic losses in porous multilayer structures are discussed. The elastic constants remain proportional over our range of porosity, and hence, the Grüneisen parameter is constant. This simplifies the expression for the porosity dependence of the Akhiezer damping.
Yao, Mengliang; Wilson, Stephen; Zebarjadi, Mona; Opeil, Cyril
2017-01-01
We use a magnetothermal resistance method to measure the lattice thermal conductivity of a single crystal of Bi$_2$Te$_3$ from 5 to 60 K. We apply a large transverse magnetic field to suppress the electronic thermal conduction while measuring thermal conductivity and electrical resistivity. The lattice thermal conductivity is then calculated by extrapolating the thermal conductivity versus electrical conductivity curve to a zero electrical conductivity value. Our results show that the measure...
Meskers, Stefan C. J.
2018-03-01
The reflection of infrared light by ionic crystals with cubic symmetry such as lithium fluoride, LiF, is analyzed in terms of phonon-polaritons. In contrast to the conventional view on phonon-polaritons that uses the Coulomb gauge and assumes a purely local dielectric response of the material, we here develop an alternative description making use of the Lorentz gauge. This involves retarded interactions between charges, implying a non-local response of the material to electromagnetic radiation. The resulting new phonon-polariton dispersion relation features polaritons with negative group velocity in the frequency range in between the transverse (ωT) and longitudinal frequency (ωL). By contrast, the conventional description predicts, in zero order, the absence of any propagating polaritons in the frequency interval between ωT and ωL. The new dispersion relation provides an efficient, zero-order description of the fine structure within the reststrahlen band of LiF. The local minimum near the middle of the reflectance band is due to excitation of a phonon-polariton whose energy and momentum matches that of the incoming photon. The Lorentz gauge description can also describe off-normal reflection and accounts for the experimentally observed widening of the reflection band with increasing angle of incidence.
Energy Technology Data Exchange (ETDEWEB)
Nazarov, M. [School of Materials and Mineral Resources Engineering, Universiti Sains Malaysia, Engineering Campus, 14300 Nibong Tebal, Pulau Pinang (Malaysia); Institute of Applied Physics, Academiei Street 5, Chisinau MD-2028 (Moldova, Republic of); Brik, M.G. [Institute of Physics, University of Tartu, Riia 142, Tartu 51014 (Estonia); Spassky, D. [Institute of Physics, University of Tartu, Riia 142, Tartu 51014 (Estonia); Skobeltsyn Institute of Nuclear Physics, M.V. Lomonosov Moscow State University, 119991 Moscow (Russian Federation); Tsukerblat, B., E-mail: tsuker@bgu.ac.il [Department of Chemistry, Ben-Gurion University of the Negev, Beer-Sheva 84105 (Israel); Palii, A. [Institute of Applied Physics, Academiei Street 5, Chisinau MD-2028 (Moldova, Republic of); Nazida, A. Nor [School of Materials and Mineral Resources Engineering, Universiti Sains Malaysia, Engineering Campus, 14300 Nibong Tebal, Pulau Pinang (Malaysia); Faculty of Art and Design, Universiti Teknologi MARA (Perak), Seri Iskandar 32610, Bandar Baru Seri Iskandar, Perak (Malaysia); Ahmad-Fauzi, M.N. [School of Materials and Mineral Resources Engineering, Universiti Sains Malaysia, Engineering Campus, 14300 Nibong Tebal, Pulau Pinang (Malaysia)
2013-12-09
A stoichiometric powder composed of nanosized grains of SrAl{sub 2}O{sub 4}:Eu{sup 2+} was synthesized by combustion method at 500 °C with the subsequent calcination at 1000 °C. The zero-phonon line position, parameter of the Stokes shift, heat release factor and effective phonon energy were studied experimentally and analyzed in the framework of the multimode Pekar–Huang–Rhys model. Experimental data show that the optical 4f–5d transitions in Eu{sup 2+} ion exhibit a broad asymmetric electron–vibrational bands with a pronounced structure near the maxima. The form-function of the absorption and luminescence bands are theoretically analyzed in the framework of the model of the linear electron–vibrational interaction assuming strong coupling with the local vibration (estimated Pekar–Huang–Rhys parameter a=2S=10 and frequency ℏω=509 cm{sup −1}) and relatively weak interaction with the crystal phonons. The last results in an effective temperature dependent broadening of the discrete lines corresponding to the local vibrations and to a specific shape of the whole phonon assisted band (multimode Pekarian). Providing specific interrelation between the key parameters the calculated absorption and luminescence bands exhibit peculiar temperature dependent structured peaks in a qualitative agreement with the experimental data.
Directory of Open Access Journals (Sweden)
Anne-Christine Hladky-Hennion
2011-12-01
Full Text Available Negative refraction properties of a two-dimensional phononic crystal (PC, made of a triangular lattice of steel rods embedded in epoxy are investigated both experimentally and numerically. First, experiments have been carried out on a prism shaped PC immersed in water. Then, for focusing purposes, a flat lens is considered and the construction of the image of a point source is analyzed in details, when indices are matched between the PC and the surrounding fluid medium, whereas acoustic impedances are mismatched. Optimal conditions for focusing longitudinal elastic waves by such PC flat lens are then discussed.
DEFF Research Database (Denmark)
Christensen, Finn Erland; Rasmussen, I.; Schnopper, Herbert W.
1992-01-01
The Objective Crystal Spectrometer (OXS) on the SPECTRUM-X-GAMMA satellite will carry these types of natural crystals LiF(220), Ge(111) and RAP(001). They will be used to study, among others, the H- and the He-like emission from the cosmically important elements Fe, S, Ar and O. More than 300 Li...
Li, Peng; Wang, Guan; Luo, Dong; Cao, Xiaoshan
2018-02-01
The band structure of a two-dimensional phononic crystal, which is composed of four homogenous steel quarter-cylinders immersed in rubber matrix, is investigated and compared with the traditional steel/rubber crystal by the finite element method (FEM). It is revealed that the frequency can then be tuned by changing the distance between adjacent quarter-cylinders. When the distance is relatively small, the integrality of scatterers makes the inner region inside them almost motionless, so that they can be viewed as a whole at high-frequencies. In the case of relatively larger distance, the interaction between each quarter-cylinder and rubber will introduce some new bandgaps at relatively low-frequencies. Lastly, the point defect states induced by the four quarter-cylinders are revealed. These results will be helpful in fabricating devices, such as vibration insulators and acoustic/elastic filters, whose band frequencies can be manipulated artificially.
Electron-phonon coupling in one dimension
International Nuclear Information System (INIS)
Apostol, M.; Baldea, I.
1981-08-01
The Ward identity is derived for the electron-phonon coupling in one dimension and the spectrum of elementary excitations is calculated by assuming that the Fermi distribution is not strongly distorted by interaction. The electron-phonon vertex is renormalized in the case of the forward scattering and Migdal's theorem is discussed. A model is proposed for the giant Kohn anomaly. The dip in the phonon spectrum is obtained and found to be in agreement with the experimental data for KCP. (author)
International Nuclear Information System (INIS)
Ivanov, A.S.; Rumiantsev, A.Yu.
1999-01-01
Complete text of publication follows. Phonon dispersion curves in Vanadium metal are investigated by neutron inelastic scattering using three-axis spectrometers. Due to extremely low coherent scattering amplitude of neutrons in natural isotope mixture of vanadium the phonon frequencies could be determined in the energy range below about 15 meV. Several phonon groups were measured with the polarised neutron scattering set-up. It is demonstrated that the intensity of coherent inelastic scattering observed in the non-spin-flip channel vanishes in the spin-flip channel. The phonon density of states is measured on a single crystal keeping the momentum transfer equal to a vector of reciprocal lattice where the coherent inelastic scattering is suppressed. Phonon dispersion curves in vanadium, as measured by neutron and earlier by X-ray scattering, are described in frames of a charge-fluctuation model involving monopolar and dipolar degrees of freedom. The model parameters are compared for different transition metals with body-centred cubic-structure. (author)
Quotane, Ilyasse; El Boudouti, El Houssaine; Djafari-Rouhani, Bahram
2018-01-01
of existence of Fano resonances that can be fitted following a Fano-type expression. The variation of the Fano parameter that describes the asymmetry of such resonances as well as their width versus θ is studied in detail. In the case of an asymmetric structure (i.e., different solid layers), we show the existence of an incidence angle that enables to squeeze a resonance between two transmission zeros induced by the two solid layers. This resonance behaves like an AIT resonance, its position and width depend on the nature of the fluid and solid layers as well as on the difference between the thicknesses of the solid layers. (iii) In the case of a periodic structure (phononic crystal), we show that trapped modes and Fano resonances give rise, respectively, to dispersionless flat bands with zero group velocity and nearly flat bands with negative or positive group velocities. The analytical results presented here are obtained by means of the Green's function method which enables to deduce in closed form: dispersion curves, transmission and reflection coefficients, DOS, as well as the displacement fields. The proposed solid-fluid layered structures should have important applications for designing acoustic mirrors and acoustic filters as well as supersonic and subsonic materials.
Energy Technology Data Exchange (ETDEWEB)
Khabibullin, R. A., E-mail: khabibullin@isvch.ru; Shchavruk, N. V.; Klochkov, A. N.; Glinskiy, I. A.; Zenchenko, N. V.; Ponomarev, D. S.; Maltsev, P. P. [Russian Academy of Sciences, Institute of Ultrahigh Frequency Semiconductor Electronics (Russian Federation); Zaycev, A. A. [National Research University of Electronic Technology (MIET) (Russian Federation); Zubov, F. I.; Zhukov, A. E.; Cirlin, G. E.; Alferov, Zh. I. [Russian Academy of Sciences, Saint Petersburg Academic University—Nanotechnology Research and Education Center (Russian Federation)
2017-04-15
The dependences of the electronic-level positions and transition oscillator strengths on an applied electric field are studied for a terahertz quantum-cascade laser (THz QCL) with the resonant-phonon depopulation scheme, based on a cascade consisting of three quantum wells. The electric-field strengths for two characteristic states of the THz QCL under study are calculated: (i) “parasitic” current flow in the structure when the lasing threshold has not yet been reached; (ii) the lasing threshold is reached. Heat-transfer processes in the THz QCL under study are simulated to determine the optimum supply and cooling conditions. The conditions of thermocompression bonding of the laser ridge stripe with an n{sup +}-GaAs conductive substrate based on Au–Au are selected to produce a mechanically stronger contact with a higher thermal conductivity.
Directory of Open Access Journals (Sweden)
Carmine Antonio Perroni
2014-03-01
Full Text Available Spectral and transport properties of small molecule single-crystal organic semiconductors have been theoretically analyzed focusing on oligoacenes, in particular on the series from naphthalene to rubrene and pentacene, aiming to show that the inclusion of different electron-phonon couplings is of paramount importance to interpret accurately the properties of prototype organic semiconductors. While in the case of rubrene, the coupling between charge carriers and low frequency inter-molecular modes is sufficient for a satisfactory description of spectral and transport properties, the inclusion of electron coupling to both low-frequency inter-molecular and high-frequency intra-molecular vibrational modes is needed to account for the temperature dependence of transport properties in smaller oligoacenes. For rubrene, a very accurate analysis in the relevant experimental configuration has allowed for the clarification of the origin of the temperature-dependent mobility observed in these organic semiconductors. With increasing temperature, the chemical potential moves into the tail of the density of states corresponding to localized states, but this is not enough to drive the system into an insulating state. The mobility along different crystallographic directions has been calculated, including vertex corrections that give rise to a transport lifetime one order of magnitude smaller than the spectral lifetime of the states involved in the transport mechanism. The mobility always exhibits a power-law behavior as a function of temperature, in agreement with experiments in rubrene. In systems gated with polarizable dielectrics, the electron coupling to interface vibrational modes of the gate has to be included in addition to the intrinsic electron-phonon interaction. While the intrinsic bulk electron-phonon interaction affects the behavior of mobility in the coherent regime below room temperature, the coupling with interface modes is dominant for the
Energy Technology Data Exchange (ETDEWEB)
Li, Suobin; Chen, Tianning [School of Mechanical Engineering and State Key Laboratory for Strength and Vibration of Mechanical Structures, Xi' an Jiaotong University, Xi' an, Shaanxi 710049 (China); Wang, Xiaopeng, E-mail: xpwang@mail.xjtu.edu.cn [School of Mechanical Engineering and State Key Laboratory for Strength and Vibration of Mechanical Structures, Xi' an Jiaotong University, Xi' an, Shaanxi 710049 (China); Li, Yinggang [Key Laboratory of High Performance Ship Technology of Ministry of Education, Wuhan University of Technology, Wuhan, 430070 (China); Chen, Weihua [School of Mechanical Engineering and State Key Laboratory for Strength and Vibration of Mechanical Structures, Xi' an Jiaotong University, Xi' an, Shaanxi 710049 (China)
2016-06-03
We studied the expansion of locally resonant complete band gaps in two-dimensional phononic crystals (PCs) using a double-sided stubbed composite PC plate with composite stubs. Results show that the introduction of the proposed structure gives rise to a significant expansion of the relative bandwidth by a factor of 1.5 and decreases the opening location of the first complete band gap by a factor of 3 compared to the classic double-sided stubbed PC plate with composite stubs. Furthermore, more band gaps appear in the lower-frequency range (0.006). These phenomena can be attributed to the strong coupling between the “analogous rigid mode” of the stub and the anti-symmetric Lamb modes of the plate. The “analogous rigid mode” of the stub is produced by strengthening the localized resonance effect of the composite plates through the double-sided stubs, and is further strengthened through the introduction of composite stubs. The “analogous rigid mode” of the stubs expands the out-of-plane band gap, which overlaps with in-plane band gap in the lower-frequency range. As a result, the complete band gap is expanded and more complete band gaps appear. - Highlights: • Expansion of lower-frequency locally resonant BGs using novel composite phononic crystals plates. • The proposed structure expands the relative bandwidth 1.5 times compared to classic doubled-sided stubbed PC plates. • The opening location of the first complete BG decreases 3 times compared to the classic doubled-sided stubbed PC plates. • The concept “analogous rigid mode” is put forward to explain the expansion of lower-frequency BGs.
Energy Technology Data Exchange (ETDEWEB)
Rakhymzhanov, A. M.; Utegulov, Z. N., E-mail: zhutegulov@nu.edu.kz, E-mail: fytas@mpip-mainz.mpg.de [Department of Physics, School of Science and Technology, Nazarbayev University, Astana 010000 (Kazakhstan); Optics Laboratory, National Laboratory Astana, Nazarbayev University, Astana 10000 (Kazakhstan); Gueddida, A. [Institut d' Electronique, Microélectronique et Nanotechnologie, 59650 Villeneuve d' Ascq (France); LPMR, Département de Physique, Faculté des Sciences, Université Mohamed I, 60000 Oujda (Morocco); Alonso-Redondo, E. [Max Planck Institute of Polymer Research, Ackermannweg 10, 55128 Mainz (Germany); Perevoznik, D.; Kurselis, K. [Laser Zentrum Hannover e.V., 30419 Hannover (Germany); Chichkov, B. N. [Laser Zentrum Hannover e.V., 30419 Hannover (Germany); Institute of Laser and Information Technologies RAS, Moscow, 142092 Troitsk (Russian Federation); El Boudouti, E. H. [LPMR, Département de Physique, Faculté des Sciences, Université Mohamed I, 60000 Oujda (Morocco); Djafari-Rouhani, B. [Institut d' Electronique, Microélectronique et Nanotechnologie, 59650 Villeneuve d' Ascq (France); Fytas, G., E-mail: zhutegulov@nu.edu.kz, E-mail: fytas@mpip-mainz.mpg.de [Max Planck Institute of Polymer Research, Ackermannweg 10, 55128 Mainz (Germany); Department of Materials Science, University of Crete and FORTH, 71110 Heraklion (Greece)
2016-05-16
The phononic band diagram of a periodic square structure fabricated by femtosecond laser pulse-induced two photon polymerization is recorded by Brillouin light scattering (BLS) at hypersonic (GHz) frequencies and computed by finite element method. The theoretical calculations along the two main symmetry directions quantitatively capture the band diagrams of the air- and liquid-filled structure and moreover represent the BLS intensities. The theory helps identify the observed modes, reveals the origin of the observed bandgaps at the Brillouin zone boundaries, and unravels direction dependent effective medium behavior.
International Nuclear Information System (INIS)
Audzijonis, A.; Klingshirn, C.; Zigas, L.; Goppert, M.; Pauliukas, A.; Zaltauskas, R.; Cerskus, A.; Kvedaravicius, A.
2007-01-01
The reflectivity spectrum R(ω) of SbSeI crystals was experimentally studied in the spectral range of 10-300cm -1 over a wide range of temperatures (10-297K) with light polarization E-c and E-c . The spectra of optical constants and optical functions were calculated using the Kramers-Kronig and optical parameter fitting methods. The dependence of the frequencies ω T and ω L of the low-frequency B 1u mode (for E-c) on temperature was obtained from the experiment. From spectra ll (ω) and Im( -1 )(ω) the frequencies ω L and ω T of B 1u normal modes were found at temperatures 10-297K. The frequencies of normal modes and amplitudes of normal coordinates were calculated by diagonalization of the dynamical matrix in harmonic approximation. The properties of the low-frequency B 1u mode are explained in anharmonic approximation by employing the average potential energy function V(z). The latter is strongly anharmonic and thus causes the frequency of this mode to show a quite strong temperature dependence. The interaction between phonons creates the anharmonicity of low-frequency B 1u vibrational mode
The objective crystal spectrometer OXS on the spectrum-X-gamma satellite crystal calibrations
DEFF Research Database (Denmark)
Abdali, S.; Christensen, Finn Erland; Schnopper, H.W.
1997-01-01
The four kinds of crystals; RAP(001), Si(111), LiF(220) and the Co/C multilayer on the super polished Si(111) crystals, together make up the objective crystal spectrometer OXS. They cover a wide energy range extending from 0.16 eV to 8 keV. A study of crystal reflectivity and energy resolution...
Wette, Frederik
1991-01-01
In recent years substantial progress has been made in the detection of surface phonons owing to considerable improvements in inelastic rare gas scattering tech niques and electron energy loss spectroscopy. With these methods it has become possible to measure surface vibrations in a wide energy range for all wave vectors in the two-dimensional Brillouin zone and thus to deduce the complete surface phonon dispersion curves. Inelastic atomic beam scattering and electron energy loss spectroscopy have started to play a role in the study of surface phonons similar to the one played by inelastic neutron scattering in the investigation of bulk phonons in the last thirty years. Detailed comparison between experimen tal results and theoretical studies of inelastic surface scattering and of surface phonons has now become feasible. It is therefore possible to test and to improve the details of interaction models which have been worked out theoretically in the last few decades. At this point we felt that a concise, co...
2D photonic crystal and its angular reflective azimuthal spectrum
Senderakova, Dagmar; Drzik, Milan; Tomekova, Juliana
2016-12-01
Contemporary, attention is paid to photonic crystals, which can strongly modify light propagation through them and enable a controllable light manipulation. The contribution is focused on a sub-wavelength 2D structure formed by Al2O3 layer on silicon substrate, patterned with periodic hexagonal lattice of deep air holes. Using various laser sources of light at single wavelength, azimuthal angle dependence of the mirror-like reflected light intensity was recorded photo-electrically. The results obtained can be used to sample the band-structure of leaky modes of the photonic crystal more reliably and help us to map the photonic dispersion diagram.
Perrin, Bernard
2007-06-01
presentations gave rise to 185 articles published in the present proceedings. The traditional topics of this conference series (phonons in superconductors and new materials, lattice dynamics, phonons in glasses and disordered materials, phase transitions, light, neutrons and x-ray inelastic scattering) were still very important in the scientific program but an increasing number of contributions occurred in the fields of coherent phonon generation, phonons in nanoscaled structures and nano/micro thermal phonon transport, expressing the growing involvement of condensed matter physicists in nanosciences. Areas like acoustic solitons and phononic crystals are now well established. Two noteworthy contributions have been brought in the long term quest for an operational SASER : one by Harold De Wijn's group from Utrecht in the classical ruby system and another one by Anthony Kent's group from Nottingham, who used semiconductor nanodevices to realize both an amplifying medium and a cavity. With these semiconductor devices the possibility for engineering, generation and detection of THz acoustic phonons are now imminent. By tradition, a prize is awarded every three years at the International Conference on Phonon Scattering in Condensed Matter to honour a scientist for his outstanding contributions to the field of phonon physics. For this twelfth edition, Humphrey Maris has been honoured for his numerous breakthroughs in the physics of phonons and quantum fluids. According to the words of James Wolfe 'Humphrey Maris has delighted and innovated the members of our phonon community with an entertaining style and challenging wit'. Prizes were also awarded for the best presentations during the poster sessions. The two winners were Peter van Capel from Utrecht, Netherlands, ('Simulations of acoustic soliton-induced chirping of exciton resonances') and Patrick Emery from Lille, France, ('Acoustic attenuation in silica in the 100-250 GHz range using coloured picosecond ultrasonics). Both prizes
International Nuclear Information System (INIS)
Peterson, J.R.
1992-01-01
Structural information is crucial to the study and understanding of the basic chemical properties of the f elements. X-ray diffraction (XRD) techniques are usually used to obtain crystal structure information. However, the transuranium (5f) elements, because of their radioactivity and limited availability, present problems for standard XRD analysis. For some time now we have been developing and using various spectroscopic probes of crystal structure; an overview of our research in this area is presented here
International Nuclear Information System (INIS)
2017-01-01
ForewordThis issue of J. Phys. Conf. Series contains the proceedings of the 23"r"d International Symposium on the Jahn-Teller Effect with the main title “Vibronic coupling and electron-phonon interaction in molecules and crystals”, which took place in Tartu (Estonia), August 27-September 1, 2016, bringing together over 70 participants from various fields of physics and chemistry. More information on the symposium program can be found at https://ttl.ut.ee/jt16/.The series of mostly biannual Jahn-Teller symposia started in 1976. It addresses topics involving the coupling between electronic and nuclear motions in molecules and solids in conditions of electronic degeneracy and pseudodegeneracy. The Jahn-Teller effect, pseudo Jahn-Teller effect, and related vibronic coupling and electron-phonon interactions are responsible for structural instabilities and non-trivial dynamics in polyatomic systems, including pseudo-rotations and non-adiabatic effects around conical intersections and seams, and play a key role in the explanation of seemingly diverse phenomena, such as spontaneous symmetry breakings, structural phase transitions, colossal magnetoresistance, exotic molecular magnetism, superconductivity in fullerides, giant permittivity and flexoelectricity, and chemical reactions after thermo- or photoexcitation. The meeting brings together theoreticians and experimentalists working in molecular physics and chemistry with researches working in solid state physics.A characteristic of these symposia is that they are devoted to discussion of a wide range of physical and chemical phenomena which, at first sight, are different in scope and nature, but in fact they are strongly entangled by vibronic coupling, and their joint presentation and discussion is deemed to mutually enrich the presenters from different fields with stimulating novel ideas.The 23"r"d Symposium included the following topics:• Fundamental theory, computation, and experimental observation of vibronic
Optimal design of tunable phononic bandgap plates under equibiaxial stretch
International Nuclear Information System (INIS)
Hedayatrasa, Saeid; Abhary, Kazem; Uddin, M S; Guest, James K
2016-01-01
Design and application of phononic crystal (PhCr) acoustic metamaterials has been a topic with tremendous growth of interest in the last decade due to their promising capabilities to manipulate acoustic and elastodynamic waves. Phononic controllability of waves through a particular PhCr is limited only to the spectrums located within its fixed bandgap frequency. Hence the ability to tune a PhCr is desired to add functionality over its variable bandgap frequency or for switchability. Deformation induced bandgap tunability of elastomeric PhCr solids and plates with prescribed topology have been studied by other researchers. Principally the internal stress state and distorted geometry of a deformed phononic crystal plate (PhP) changes its effective stiffness and leads to deformation induced tunability of resultant modal band structure. Thus the microstructural topology of a PhP can be altered so that specific tunability features are met through prescribed deformation. In the present study novel tunable PhPs of this kind with optimized bandgap efficiency-tunability of guided waves are computationally explored and evaluated. Low loss transmission of guided waves throughout thin walled structures makes them ideal for fabrication of low loss ultrasound devices and structural health monitoring purposes. Various tunability targets are defined to enhance or degrade complete bandgaps of plate waves through macroscopic tensile deformation. Elastomeric hyperelastic material is considered which enables recoverable micromechanical deformation under tuning finite stretch. Phononic tunability through stable deformation of phononic lattice is specifically required and so any topology showing buckling instability under assumed deformation is disregarded. Nondominated sorting genetic algorithm (GA) NSGA-II is adopted for evolutionary multiobjective topology optimization of hypothesized tunable PhP with square symmetric unit-cell and relevant topologies are analyzed through finite
Phonons from neutron powder diffraction
Dimitrov, D. A.; Louca, D.; Röder, H.
1999-09-01
The spherically averaged structure function S(\\|q\\|) obtained from pulsed neutron powder diffraction contains both elastic and inelastic scattering via an integral over energy. The Fourier transformation of S(\\|q\\|) to real space, as is done in the pair density function (PDF) analysis, regularizes the data, i.e., it accentuates the diffuse scattering. We present a technique which enables the extraction of off-center (\\|q\\|≠0) phonon information from powder diffraction experiments by comparing the experimental PDF with theoretical calculations based on standard interatomic potentials and the crystal symmetry. This procedure [dynamics from powder diffraction] has been successfully implemented as demonstrated here for two systems, a simple metal fcc Ni and an ionic crystal CaF2. Although computationally intensive, this data analysis allows for a phonon based modeling of the PDF, and additionally provides off-center phonon information from neutron powder diffraction.
Objective Crystal Spectrometer (OXS) for the Spectrum-X-γ satellite
DEFF Research Database (Denmark)
Christensen, Finn Erland; Byrnak, B.P.; Hornstrup, Allan
1990-01-01
The status of the Objective Crystal Spectrometer (OXS) to be flown on the Soviet Spectrum-X-Gamma satellite together with the X-ray investigation of two of the three natural crystals (LiF(220), Ge(111) and RAP(001) which are chosen as the baseline option are presented. An important result...... on the LiF(220) and Ge(111) surfaces is presented. This design allows simultaneous spectroscopy in two energy bands each centered on cosmically interesting line emission regions. X-ray reflectivity measurements demonstrate that the crystal surface can be made sufficiently smooth for the application...
Effects of elastic anisotropy in phononic band-gap plates with two-dimensional lattices
International Nuclear Information System (INIS)
Hsu, Jin-Chen
2013-01-01
This study presents the effects of elastic anisotropy of constituent materials in square-lattice phononic-crystal plates. Using general elastodynamic calculations and the finite element (FE) method, this study analyses phononic-crystal plates constituted by (1) anisotropic scatterers embedded in an epoxy plate and (2) air holes etched on an anisotropic plate. The full band gaps can be modulated, opened and closed by changing the orientation of the square lattice relative to the crystallographic coordinate system of the anisotropic materials, and the elastic anisotropy varies the dispersion curves of the phononic-crystal plate waves with the rotation of the square lattice. Acoustic power transmission calculations show incident plate mode-dependent spectral gaps, the appearances of which in the frequency spectrum can also be modulated and shifted using elastic anisotropy. The effects of elastic anisotropy demonstrated here enable tailoring frequency band gaps and dispersion curves for functional control of acoustic-wave energy flows in phononic-crystal plates. Applications include acoustic waveguiding, confining, self-collimating and perfect acoustic focusing.
International Nuclear Information System (INIS)
Nasonov, N.; Pokhil, G.; Zhukova, P.
2005-01-01
An emission from relativistic electrons crossing an aligned crystal is considered with account of coherent bremsstrahlung on atomic strings and transition radiation contributions. Some peculiarities in the low energy range of the emission spectrum caused by azimuthal scattering of emitting electrons on atomic strings and an interference between the transition radiation and coherent bremsstrahlung are predicted and analyzed theoretically
Energy Technology Data Exchange (ETDEWEB)
Wen-Chen, Zheng, E-mail: zhengwc1@163.com [Department of Material Science, Sichuan University, Chengdu 610064 (China); International Centre for Materials Physics, Chinese Academy of Sciences, Shenyang 110016 (China); Bang-Xing, Li; Guo-Ying, Feng [College of Electronic Information, Sichuan University, Chengdu 610064 (China); Hong-Gang, Liu [Department of Material Science, Sichuan University, Chengdu 610064 (China)
2013-06-15
The thermal shifts of R-line for isoelectronic 3d{sup 3} ions Cr{sup 3+} and Mn{sup 4+} in YAlO{sub 3} crystal are studied by using a new theoretical expression including both the static contribution due to lattice thermal expansion and the vibrational contribution due to electron–phonon interaction. The new expression in form is almost the same as that containing only the vibrational contribution (which is widely-used in the previous papers) except the change of coefficient from α to α′+A (where α, obtained from the old expression, and α′, obtained from the new expression, are the apparent and true electron–phonon coupling parameters, respectively. A is a parameter concerning the static contribution). By using the new expression and the analysis of pressure- and temperature-dependences of R-line, it is found that the static contribution to the thermal shift of R-line in sign is contrary to and in magnitude is about 36% of the vibrational one. Thus, the electron–phonon coupling parameters α′ increase about 36% compared with the corresponding parameters α for both Cr{sup 3+} and Mn{sup 4+} in YAlO{sub 3} crystal. So, for the reasonable explanation of thermal shifts of spectral lines and the determination of the true electron–phonon coupling parameter, both the static and vibrational contributions to thermal shift should be taken into account. The reason that the electron–phonon coupling parameter |α′| of Mn{sup 4+} is larger than that of Cr{sup 3+} in YAlO{sub 3} crystal is discussed. -- Highlights: ► Thermal shifts of R-line for 3d{sup 3} ions Cr{sup 3+} and Mn{sup 4+} in YAlO{sub 3} crystal are studied. ► Both the static and vibrational contributions are included in the studies. ► True electron–phonon coupling parameters α′ for both 3d{sup 3} ions in YAlO{sub 3} are obtained. ► Reason of the larger parameter α′ of Mn{sup 4+} than that of Cr{sup 3+} in YAlO{sub 3} is given.
Kinetic coefficients in isotopically disordered crystals
International Nuclear Information System (INIS)
Zhernov, Arkadii P; Inyushkin, Alexander V
2002-01-01
Peculiarities of the behavior of kinetic coefficients, like thermal conductivity, electric conductivity, and thermoelectric power, in isotopically disordered materials are reviewed in detail. New experimental and theoretical results on the isotope effects in the thermal conductivity of diamond, Ge, and Si semiconductors are presented. The suppression effect of phonon-drag thermopower in the isotopically disordered Ge crystals is discussed. The influence of dynamic and static crystal lattice deformations on the electric conductivity of metals as well as on the ordinary phonon spectrum deformations is considered. (reviews of topical problems)
Yao, Mengliang; Zebarjadi, Mona; Opeil, Cyril P.
2017-01-01
We use a magnetothermal resistance method to measure lattice thermal conductivity of pure single crystal metals over a wide range of temperatures. Large transverse magnetic fields are applied to suppress electronic thermal conduction. The total thermal conductivity and the electrical conductivity are measured as functions of applied magnetic field. The lattice thermal conductivity is then extracted by extrapolating the thermal conductivity versus electrical conductivity curve at zero electric...
Coherent phonon optics in a chip with an electrically controlled active device.
Poyser, Caroline L; Akimov, Andrey V; Campion, Richard P; Kent, Anthony J
2015-02-05
Phonon optics concerns operations with high-frequency acoustic waves in solid media in a similar way to how traditional optics operates with the light beams (i.e. photons). Phonon optics experiments with coherent terahertz and sub-terahertz phonons promise a revolution in various technical applications related to high-frequency acoustics, imaging, and heat transport. Previously, phonon optics used passive methods for manipulations with propagating phonon beams that did not enable their external control. Here we fabricate a phononic chip, which includes a generator of coherent monochromatic phonons with frequency 378 GHz, a sensitive coherent phonon detector, and an active layer: a doped semiconductor superlattice, with electrical contacts, inserted into the phonon propagation path. In the experiments, we demonstrate the modulation of the coherent phonon flux by an external electrical bias applied to the active layer. Phonon optics using external control broadens the spectrum of prospective applications of phononics on the nanometer scale.
Crystal and phonon structure of ZnSiP{sub 2}, a II-IV-V{sub 2} semiconducting compound
Energy Technology Data Exchange (ETDEWEB)
Pena-Pedraza, H., E-mail: heribertopp@ula.ve [Departamento de Fisica, Universidad de Pamplona, Pamplona 54518000 (Colombia); Lopez-Rivera, S.A.; Martin, J.M. [Laboratorio de Fisica Aplicada, ULA, Merida 5101 (Venezuela, Bolivarian Republic of); Delgado, J.M. [Laboratorio de Cristalografia, ULA, Merida 5101 (Venezuela, Bolivarian Republic of); Power, Ch. [Centro de Estudios en Semiconductores, ULA, Merida 5101 (Venezuela, Bolivarian Republic of)
2012-09-20
Using single-crystal X-ray diffraction and Raman spectroscopy, the characterization of a member of the II-IV-V{sub 2} family of semiconducting compounds, ZnSiP{sub 2}, is presented in this work. The diffraction experiment showed that ZnSiP{sub 2} crystallizes in a chalcopyrite-type of structure (space group: I4{sup Macron }2d) with unit cell parameters a = 5.407(9) Angstrom-Sign and c = 10.454(2) Angstrom-Sign . The structure is based on a cubic close-packed arrangement of phosphorus atoms with the two cations in an orderly way occupying one-half of the tetrahedral sites. In this structure, two Zn and two Si are bonded to each phosphorus atom and four phosphorus atoms are bonded to each cation. The results obtained are consistent with previous reports. Raman spectroscopy, Group Theory, and a modified correlation method allowed the assignment of the characteristics of the thirteen first-order Raman active optical vibrational modes observed for this material.
Isotopic effects on the phonon modes in boron carbide.
Werheit, H; Kuhlmann, U; Rotter, H W; Shalamberidze, S O
2010-10-06
The effect of isotopes ((10)B-(11)B; (12)C-(13)C) on the infrared- and Raman-active phonons of boron carbide has been investigated. For B isotopes, the contributions of the virtual crystal approximation, polarization vector and isotopical disorder are separated. Boron and carbon isotope effects are largely opposite to one another and indicate the share of the particular atoms in the atomic assemblies vibrating in specific phonon modes. Some infrared-active phonons behave as expected for monatomic boron crystals.
Enhancing of optic phonon contribution in hydrodynamic phonon transport
de Tomas, C.; Cantarero, A.; Lopeandia, A. F.; Alvarez, F. X.
2015-10-01
In the framework of the kinetic-collective model of phonon heat transport, we analyze how each range of the phonon frequency spectrum contributes to the total thermal conductivity both in the macro and the nanoscale. For this purpose, we use two case study samples: naturally occurring bulk silicon and a 115 nm of diameter silicon nanowire. We show that the contribution of high-energy phonons (optic branches) is non-negligible only when N-collisions are strongly present. This contribution increases when the effective size of the sample decreases, and it is found to be up to a 10% at room temperature for the 115 nm nanowire, corroborating preliminar ab-initio predictions.
Environment spectrum and coherence behaviours in a rare-earth doped crystal for quantum memory.
Gong, Bo; Tu, Tao; Zhou, Zhong-Quan; Zhu, Xing-Yu; Li, Chuan-Feng; Guo, Guang-Can
2017-12-21
We theoretically investigate the dynamics of environment and coherence behaviours of the central ion in a quantum memory based on a rare-earth doped crystal. The interactions between the central ion and the bath spins suppress the flip-flop rate of the neighbour bath spins and yield a specific environment spectral density S(ω). Under dynamical decoupling pulses, this spectrum provides a general scaling for the coherence envelope and coherence time, which significantly extend over a range on an hour-long time scale. The characterized environment spectrum with ultra-long coherence time can be used to implement various quantum communication and information processing protocols.
Directory of Open Access Journals (Sweden)
Thi Dep Ha
2016-04-01
Full Text Available Phononic crystals (PnCs and n-type doped silicon technique have been widely employed in silicon-based MEMS resonators to obtain high quality factor (Q as well as temperature-induced frequency stability. For the PnCs, their band gaps play an important role in the acoustic wave propagation. Also, the temperature and dopant doped into silicon can cause the change in its material properties such as elastic constants, Young’s modulus. Therefore, in order to design the simultaneous high Q and frequency stability silicon-based MEMS resonators by two these techniques, a careful design should study effects of temperature and dopant on the band gap characteristics to examine the acoustic wave propagation in the PnC. Based on these, this paper presents (1 a proposed silicon-based PnC strip structure for support tether applications in low frequency silicon-based MEMS resonators, (2 influences of temperature and dopant on band gap characteristics of the PnC strips. The simulation results show that the largest band gap can achieve up to 33.56 at 57.59 MHz and increase 1280.13 % (also increase 131.89 % for ratio of the widest gaps compared with the counterpart without hole. The band gap properties of the PnC strips is insignificantly effected by temperature and electron doping concentration. Also, the quality factor of two designed length extensional mode MEMS resonators with proposed PnC strip based support tethers is up to 1084.59% and 43846.36% over the same resonators with PnC strip without hole and circled corners, respectively. This theoretical study uses the finite element analysis in COMSOL Multiphysics and MATLAB softwares as simulation tools. This findings provides a background in combination of PnC and dopant techniques for high performance silicon-based MEMS resonators as well as PnC-based MEMS devices.
DEFF Research Database (Denmark)
Halm, I.; Wiebicke, H.-J.; Geppert, U.R.M.E.
1993-01-01
The Objective Crystal Spectrometer on the SPECTRUM-X-GAMMA satellite will use three types of natural crystals LiF(220), Si(111), RAP(001), and a multilayer structure providing high-resolution X- ray spectroscopy of Fe, S, O, and C line regions of bright cosmic X-ray sources. 330 - 360 LiF(220...
DEFF Research Database (Denmark)
Louis, E.; Spiller, E.; Abdali, S.
1995-01-01
with Kr+- and Ar+- ions of 300, 500, and 1000 eV. We examined the effect of different polishing parameters on the smoothening of the Co- and Ni-layers. The in-situ reflectivity of lambda equals 3.16 nm during deposition and the ex-situ grazing incidence reflectivity of Cu-K(alpha ) radiation (lambda...... multiplied by 6 cm2 Si (111) crystals for the Objective Crystal Spectrometer on the Russian Spectrum Rontgen Gamma satellite. The coatings on the flight crystals have a period Lambda of 3.95 plus or minus 0.02 nm and a reflectivity of more than 8% averaged over s- and p-polarization over the entire...
Phonon mechanism in the most dilute superconductor n-type SrTiO3.
Gor'kov, Lev P
2016-04-26
Superconductivity of n-doped SrTiO3, which remained enigmatic for half a century, is treated as a particular case of nonadiabatic phonon pairing. Motivated by experiment, we suggest the existence of the mobility edge at some dopant concentration. The itinerant part of the spectrum consists of three conduction bands filling by electrons successively. Each subband contributes to the superconducting instability and exhibits a gap in its energy spectrum at low temperatures. We argue that superconductivity of n-doped SrTiO3 results from the interaction of electrons with several longitudinal (LO) optical phonons with frequencies much larger than the Fermi energy. Immobile charges under the mobility edge threshold increase the "optical" dielectric constant far above that in clean SrTiO3 placing control on the electron-LO phonon interaction. TC initially grows as density of states at the Fermi surface increases with doping, but the accumulating charges reduce the electrons-polar-phonon interaction by screening the longitudinal electric fields. The theory predicts maxima in the TC-concentration dependence indeed observed experimentally. Having reached a maximum in the third band, the transition temperature finally decreases, rounding out the TC (n) dome, the three maxima with accompanying superconducting gaps emerging consecutively as electrons fill successive bands. This arises from attributes of the LO optical phonon pairing of electrons. The mechanism of LO phonons opens the path to increasing superconducting transition temperature in bulk transition-metal oxides and other polar crystals, and in charged 2D layers at the LaAaO3/SrTiO3 interfaces and on the SrTiO3 substrates.
International Nuclear Information System (INIS)
Swenson, C.A.
1996-01-01
Linear thermal expansivity (α) measurements from 1 to 300 K and heat capacity (C p ) measurements from 1 to 110 K are reported for single crystals of the hexagonal scandium and lutetium metals; the C p data were combined with previous data to obtain smooth representations to 305 K for Lu and 350 K for Sc. The Θ 0 close-quote s (352 and 190 K, respectively, for Sc and Lu) and γ close-quote s (10.38 and 8.30 mJ/molK 2 , respectively for Sc and Lu) are in reasonable agreement with previous data of various kinds. Electronic contributions are much larger for the α close-quote s than for the C p close-quote s, with the large anisotropies of the α close-quote s primarily electronic in origin. The equivalent Debye Θ close-quote s for the lattice C p close-quote s and the Grueneisen parameters Γ for the lattice α close-quote s both show an unexpected T dependence at open-quote open-quote high close-quote close-quote T (T approx-gt Θ 0 /2), which can be associated with the disappearance of spin-fluctuation and electron-phonon enhancements to the electronic properties; this effect has been reported previously for Sc C ν close-quote s by Pleschiutschnig et al. [Phys. Rev. B 44, 6794 (1991)]. While the resulting high-temperature open-quote open-quote bare close-quote close-quote or open-quote open-quote density of states close-quote close-quote γ for Sc, γ b =5.75(25) mJ/molK 2 , is slightly larger than that calculated recently by Goetz and Winter [J. Phys. Condens. Matter 5, 1721 (1993)], the magnitude of the sum (γ spin +γep) agrees well. For Lu, for which no recent calculations exist, γ b =5.50(25) mJ/molK 2 . (Abstract Truncated)
Energy Technology Data Exchange (ETDEWEB)
Swenson, C.A. [Ames Laboratory and Department of Physics and Astronomy, Iowa State University, Ames, Iowa 50011 (United States)
1996-02-01
Linear thermal expansivity ({alpha}) measurements from 1 to 300 K and heat capacity ({ital C}{sub {ital p}}) measurements from 1 to 110 K are reported for single crystals of the hexagonal scandium and lutetium metals; the {ital C}{sub {ital p}} data were combined with previous data to obtain smooth representations to 305 K for Lu and 350 K for Sc. The {Theta}{sub 0}{close_quote}s (352 and 190 K, respectively, for Sc and Lu) and {gamma}{close_quote}s (10.38 and 8.30 mJ/molK{sup 2}, respectively for Sc and Lu) are in reasonable agreement with previous data of various kinds. Electronic contributions are much larger for the {alpha}{close_quote}s than for the {ital C}{sub {ital p}}{close_quote}s, with the large anisotropies of the {alpha}{close_quote}s primarily electronic in origin. The equivalent Debye {Theta}{close_quote}s for the lattice {ital C}{sub {ital p}}{close_quote}s and the Gr{umlt u}neisen parameters {Gamma} for the lattice {alpha}{close_quote}s both show an unexpected {ital T} dependence at {open_quote}{open_quote}high{close_quote}{close_quote} {ital T} ({ital T}{approx_gt}{Theta}{sub 0}/2), which can be associated with the disappearance of spin-fluctuation and electron-phonon enhancements to the electronic properties; this effect has been reported previously for Sc {ital C}{sub {nu}}{close_quote}s by Pleschiutschnig {ital et} {ital al}. [Phys. Rev. B {bold 44}, 6794 (1991)]. While the resulting high-temperature {open_quote}{open_quote}bare{close_quote}{close_quote} or {open_quote}{open_quote}density of states{close_quote}{close_quote} {gamma} for Sc, {gamma}{sub {ital b}}=5.75(25) mJ/molK{sup 2}, is slightly larger than that calculated recently by G{umlt o}tz and Winter [J. Phys. Condens. Matter {bold 5}, 1721 (1993)], the magnitude of the sum ({gamma}{sub spin}+{gamma}{ital ep}) agrees well. For Lu, for which no recent calculations exist, {gamma}{sub {ital b}}=5.50(25) mJ/molK{sup 2}. (Abstract Truncated)
Vengelis, Julius; Jarutis, Vygandas; Sirutkaitis, Valdas
2018-01-01
We present results of experimental and numerical investigation of supercontinuum (SC) generation in polarization-maintaining photonic crystal fiber (PCF) using chirped femtosecond pulses. The initial unchirped pump pulse source was a mode-locked Yb:KGW laser generating 52-nJ energy, 110-fs duration pulses at 1030 nm with a 76-MHz repetition rate. The nonlinear medium was a 32-cm-long polarization-maintaining PCF manufactured by NKT Photonics A/S. We demonstrated the influence of pump pulse chirp on spectral characteristics of a SC. We showed that by chirping pump pulses positively or negatively one can obtain a broader SC spectrum than in the case of unchirped pump pulses at the same peak power. Moreover, the extension can be controlled by changing the amount of pump pulse chirp. Numerical simulation results also indicated that pump pulse chirp yields an extension of SC spectrum.
Full Spectrum Visible LED Light Activated Antibacterial System Realized by Optimized Cu2O Crystals.
Shi, Xiaotong; Xue, Chaowen; Fang, Fang; Song, Xiangwei; Yu, Fen; Liu, Miaoxing; Wei, Zhipeng; Fang, Xuan; Zhao, Dongxu; Xin, Hongbo; Wang, Xiaolei
2016-04-06
Assisted by three-dimensional printing technology, we proposed and demonstrated a full spectrum visible light activated antibacterial system by using a combination of 500 nm sized Cu2O crystals and light-emitting diode (LED) lamps. Further improved antibacterial ratios were achieved, for the first time, with pure Cu2O for both Gram-positive bacteria and Gram-negative bacteria among all of the six different color LED lamps. For practical antibacterial applications, we revealed that the nonwoven fabric could act as excellent carrier for Cu2O crystals and provide impressive antibacterial performance. Furthermore, integrated with our self-developed app, the poly(ethylene terephthalate) film loaded with Cu2O crystals also showed significant antibacterial property, thus making it possible to be applied in field of touch screen. The present research not only provided a healthier alternative to traditional ultraviolet-based sterilization but also opened an auto-response manner to decrease the rate of microbial contamination on billions of touch screen devices.
Zhu, Hanyu
2018-02-01
Chirality reveals symmetry breaking of the fundamental interaction of elementary particles. In condensed matter, for example, the chirality of electrons governs many unconventional transport phenomena such as the quantum Hall effect. Here we show that phonons can exhibit intrinsic chirality in monolayer tungsten diselenide. The broken inversion symmetry of the lattice lifts the degeneracy of clockwise and counterclockwise phonon modes at the corners of the Brillouin zone. We identified the phonons by the intervalley transfer of holes through hole-phonon interactions during the indirect infrared absorption, and we confirmed their chirality by the infrared circular dichroism arising from pseudoangular momentum conservation. The chiral phonons are important for electron-phonon coupling in solids, phonon-driven topological states, and energy-efficient information processing.
Strong Carrier-Phonon Coupling in Lead Halide Perovskite Nanocrystals
Iaru, Claudiu M; Geuchies, Jaco J|info:eu-repo/dai/nl/370526090; Koenraad, Paul M; Vanmaekelbergh, Daniël|info:eu-repo/dai/nl/304829137; Silov, Andrei Yu
2017-01-01
We highlight the importance of carrier-phonon coupling in inorganic lead halide perovskite nanocrystals. The low-temperature photoluminescence (PL) spectrum of CsPbBr3 has been investigated under a nonresonant and a nonstandard, quasi-resonant excitation scheme, and phonon replicas of the main PL
Electron-phonon heat exchange in quasi-two-dimensional nanolayers
Anghel, Dragos-Victor; Cojocaru, Sergiu
2017-12-01
We study the heat power P transferred between electrons and phonons in thin metallic films deposited on free-standing dielectric membranes. The temperature range is typically below 1 K, such that the wavelengths of the excited phonon modes in the system is large enough so that the picture of a quasi-two-dimensional phonon gas is applicable. Moreover, due to the quantization of the components of the electron wavevectors perpendicular to the metal film's surface, the electrons spectrum forms also quasi two-dimensional sub-bands, as in a quantum well (QW). We describe in detail the contribution to the electron-phonon energy exchange of different electron scattering channels, as well as of different types of phonon modes. We find that heat flux oscillates strongly with thickness of the film d while having a much smoother variation with temperature (Te for the electrons temperature and Tph for the phonons temperature), so that one obtains a ridge-like landscape in the two coordinates, (d, Te) or (d, Tph), with crests and valleys aligned roughly parallel to the temperature axis. For the valley regions we find P ∝ Te3.5 - Tph3.5. From valley to crest, P increases by more than one order of magnitude and on the crests P cannot be represented by a simple power law. The strong dependence of P on d is indicative of the formation of the QW state and can be useful in controlling the heat transfer between electrons and crystal lattice in nano-electronic devices. Nevertheless, due to the small value of the Fermi wavelength in metals, the surface imperfections of the metallic films can reduce the magnitude of the oscillations of P vs. d, so this effect might be easier to observe experimentally in doped semiconductors.
Directory of Open Access Journals (Sweden)
Qicheng Zhang
2017-05-01
Full Text Available Active piezoelectric materials are applied to one-dimensional phononic crystals, for the control of longitudinal vibration propagation both in active and passive modes. Based on the electromechanical coupling between the acoustical vibration and electric field, the electromechanical equivalent method is taken to theoretically predict the transmission spectrum of the longitudinal vibration. It is shown that the phononic rod can suppress the vibration efficiently at the frequencies of interest, by actively optimizing the motions of piezoelectric elements. In an illustrated phononic rod of 11.2cm long, active tunable isolations of more than 20dB at low frequencies (500Hz-14kHz are generated by controlling the excitation voltages of piezoelectric elements. Meanwhile, passive fixed isolation at high frequencies (14k-63kHz are presented by its periodicity characteristics. Finite element simulations and vibration experiments on the rod demonstrate the effectiveness of the approach in terms of its vibration isolation capabilities and tunable characteristics. This phononic rod can be manufactured easily and provides numerous potential applications in designing isolation mounts and platforms.
Luo, Chengtao; Bansal, Dipanshu; Li, Jiefang; Viehland, Dwight; Winn, Barry; Ren, Yang; Li, Xiaobing; Luo, Haosu; Delaire, Olivier
2017-11-01
Neutron and x-ray scattering measurements were performed on (N a1 /2B i1 /2 ) Ti O3-x at %BaTi O3 (NBT-x BT ) single crystals (x =4 , 5, 6.5, and 7.5) across the morphotropic phase boundary (MPB), as a function of both composition and temperature, and probing both structural and dynamical aspects. In addition to the known diffuse scattering pattern near the Γ points, our measurements revealed new, faint superlattice peaks, as well as an extensive diffuse scattering network, revealing a short-range ordering of polar nanoregions (PNR) with a static stacking morphology. In samples with compositions closest to the MPB, our inelastic neutron scattering investigations of the phonon dynamics showed two unusual features in the acoustic phonon branches, between the superlattice points, and between the superlattice points and Γ points, respectively. These critical elements are not present in the other compositions away from the MPB, which suggests that these features may be related to the tilt modes coupling behavior near the MPB.
Charge Transport Properties of Durene Crystals from First-Principles.
Motta, Carlo; Sanvito, Stefano
2014-10-14
We establish a rigorous computational scheme for constructing an effective Hamiltonian to be used for the determination of the charge carrier mobility of pure organic crystals at finite temperature, which accounts for van der Waals interactions, and it includes vibrational contributions from the entire phonon spectrum of the crystal. Such an approach is based on the ab initio framework provided by density functional theory and the construction of a tight-binding effective model via Wannier transformation. The final Hamiltonian includes coupling of the electrons to the crystals phonons, which are also calculated from density functional theory. We apply this methodology to the case of durene, a small π-conjugated molecule, which forms a high-mobility herringbone-stacked crystal. We show that accounting correctly for dispersive forces is fundamental for obtaining a high-quality phonon spectrum, in agreement with experiments. Then, the mobility as a function of temperature is calculated along different crystallographic directions and the phonons most responsible for the scattering are identified.
DEFF Research Database (Denmark)
Høgfeldt Hansen, Leif
2016-01-01
The publication functions as a proces description of the development and construction of an urban furniture SPECTRUM in the city of Gwangju, Republic of Korea. It is used as the cataloque for the exhibition of Spectrum.......The publication functions as a proces description of the development and construction of an urban furniture SPECTRUM in the city of Gwangju, Republic of Korea. It is used as the cataloque for the exhibition of Spectrum....
Zhernov, A P
2001-01-01
The problem on solving the kinetic equation through the moments method for the dielectric and semiconductor thermal conductivity is discussed. The evaluations of the isotopic disorder effect on the germanium crystals heat resistance in the multimoment approximation are obtained on the basis of the microscopic models. The contributions of the acoustic and optical phonons to the thermal conductivity are accounted for. The DELTA W surplus heat resistance in comparison with highly-enriched samples was determined for the natural composition samples. Good agreement between the theory and experiment for DELTA W is observed in the case of germanium. The theoretical value in the case of silicon is essentially lower as compared to the DELTA W experimental value
Vengelis, Julius; Jarutis, Vygandas; Sirutkaitis, Valdas
2017-08-01
We present results of experimental and numerical investigation of supercontinuum generation in polarization maintaining photonic crystal fiber (PCF) using chirped femtosecond pulses. The initial unchirped pump pulse source was a mode-locked Yb:KGW laser generating 52 nJ energy 110 fs duration pulses at 1030 nm with 76 MHz repetition rate. The nonlinear medium was a 32 cm long polarization maintaining PCF manufactured by NKT Photonics A/S. We demonstrated the influence of pump pulse chirp on spectral characteristics of supercontinuum. We showed that by chirping pump pulses positively or negatively one can obtain broader supercontinuum spectrum than in case of unchirped pump pulses at the same peak power. Moreover, the extension can be controlled by changing the amount of pump pulse chirp. In our case the supercontinuum spectrum width was extended by up to 115 nm (at maximum chirp value of +10500 fs2 that we could achieve in our setup) compared to the case of unchirped pump at the same peak power.
Phonon broadening in high entropy alloys
Körmann, Fritz; Ikeda, Yuji; Grabowski, Blazej; Sluiter, Marcel H. F.
2017-09-01
Refractory high entropy alloys feature outstanding properties making them a promising materials class for next-generation high-temperature applications. At high temperatures, materials properties are strongly affected by lattice vibrations (phonons). Phonons critically influence thermal stability, thermodynamic and elastic properties, as well as thermal conductivity. In contrast to perfect crystals and ordered alloys, the inherently present mass and force constant fluctuations in multi-component random alloys (high entropy alloys) can induce significant phonon scattering and broadening. Despite their importance, phonon scattering and broadening have so far only scarcely been investigated for high entropy alloys. We tackle this challenge from a theoretical perspective and employ ab initio calculations to systematically study the impact of force constant and mass fluctuations on the phonon spectral functions of 12 body-centered cubic random alloys, from binaries up to 5-component high entropy alloys, addressing the key question of how chemical complexity impacts phonons. We find that it is crucial to include both mass and force constant fluctuations. If one or the other is neglected, qualitatively wrong results can be obtained such as artificial phonon band gaps. We analyze how the results obtained for the phonons translate into thermodynamically integrated quantities, specifically the vibrational entropy. Changes in the vibrational entropy with increasing the number of elements can be as large as changes in the configurational entropy and are thus important for phase stability considerations. The set of studied alloys includes MoTa, MoTaNb, MoTaNbW, MoTaNbWV, VW, VWNb, VWTa, VWNbTa, VTaNbTi, VWNbTaTi, HfZrNb, HfMoTaTiZr.
Phonon properties of β-FeSi2 and photoluminescence
Maeda, Y.; Nakajima, T.; Matsukura, B.; Ikeda, T.; Hiraiwa, Y.
We have investigated phonon properties of some β-FeSi2 crystals with characteristic light emission properties by using measurements of far-infrared absorption and photoluminescence in order to discuss a correlation between them. It has been found that there is a systematic correlation between phonon states and light emission efficiency and that the phonons above the energy of more than ∼44 meV may be effectively coupled to the optical indirect transition for the IR light emission from β-FeSi2 crystals.
Theory and experimental evidence of phonon domains and their roles in pre-martensitic phenomena
Jin, Yongmei M.; Wang, Yu U.; Ren, Yang
2015-12-01
Pre-martensitic phenomena, also called martensite precursor effects, have been known for decades while yet remain outstanding issues. This paper addresses pre-martensitic phenomena from new theoretical and experimental perspectives. A statistical mechanics-based Grüneisen-type phonon theory is developed. On the basis of deformation-dependent incompletely softened low-energy phonons, the theory predicts a lattice instability and pre-martensitic transition into elastic-phonon domains via 'phonon spinodal decomposition.' The phase transition lifts phonon degeneracy in cubic crystal and has a nature of phonon pseudo-Jahn-Teller lattice instability. The theory and notion of phonon domains consistently explain the ubiquitous pre-martensitic anomalies as natural consequences of incomplete phonon softening. The phonon domains are characterised by broken dynamic symmetry of lattice vibrations and deform through internal phonon relaxation in response to stress (a particular case of Le Chatelier's principle), leading to previously unexplored new domain phenomenon. Experimental evidence of phonon domains is obtained by in situ three-dimensional phonon diffuse scattering and Bragg reflection using high-energy synchrotron X-ray single-crystal diffraction, which observes exotic domain phenomenon fundamentally different from usual ferroelastic domain switching phenomenon. In light of the theory and experimental evidence of phonon domains and their roles in pre-martensitic phenomena, currently existing alternative opinions on martensitic precursor phenomena are revisited.
Toward quantitative modeling of silicon phononic thermocrystals
Energy Technology Data Exchange (ETDEWEB)
Lacatena, V. [STMicroelectronics, 850, rue Jean Monnet, F-38926 Crolles (France); IEMN UMR CNRS 8520, Institut d' Electronique, de Microélectronique et de Nanotechnologie, Avenue Poincaré, F-59652 Villeneuve d' Ascq (France); Haras, M.; Robillard, J.-F., E-mail: jean-francois.robillard@isen.iemn.univ-lille1.fr; Dubois, E. [IEMN UMR CNRS 8520, Institut d' Electronique, de Microélectronique et de Nanotechnologie, Avenue Poincaré, F-59652 Villeneuve d' Ascq (France); Monfray, S.; Skotnicki, T. [STMicroelectronics, 850, rue Jean Monnet, F-38926 Crolles (France)
2015-03-16
The wealth of technological patterning technologies of deca-nanometer resolution brings opportunities to artificially modulate thermal transport properties. A promising example is given by the recent concepts of 'thermocrystals' or 'nanophononic crystals' that introduce regular nano-scale inclusions using a pitch scale in between the thermal phonons mean free path and the electron mean free path. In such structures, the lattice thermal conductivity is reduced down to two orders of magnitude with respect to its bulk value. Beyond the promise held by these materials to overcome the well-known “electron crystal-phonon glass” dilemma faced in thermoelectrics, the quantitative prediction of their thermal conductivity poses a challenge. This work paves the way toward understanding and designing silicon nanophononic membranes by means of molecular dynamics simulation. Several systems are studied in order to distinguish the shape contribution from bulk, ultra-thin membranes (8 to 15 nm), 2D phononic crystals, and finally 2D phononic membranes. After having discussed the equilibrium properties of these structures from 300 K to 400 K, the Green-Kubo methodology is used to quantify the thermal conductivity. The results account for several experimental trends and models. It is confirmed that the thin-film geometry as well as the phononic structure act towards a reduction of the thermal conductivity. The further decrease in the phononic engineered membrane clearly demonstrates that both phenomena are cumulative. Finally, limitations of the model and further perspectives are discussed.
Directory of Open Access Journals (Sweden)
Tadashi Kawazoe
2014-01-01
Full Text Available We fabricated a high-efficiency infrared light emitting diode (LED via dressed-photon-phonon (DPP assisted annealing of a p-n homojunctioned bulk Si crystal. The center wavelength in the electroluminescence (EL spectrum of this LED was determined by the wavelength of a CW laser used in the DPP-assisted annealing. We have proposed a novel method of controlling the EL spectral shape by additionally using a pulsed light source in order to control the number of phonons for the DPP-assisted annealing. In this method, the Si crystal is irradiated with a pair of pulses having an arrival time difference between them. The number of coherent phonons created is increased (reduced by tuning (detuning this time difference. A Si-LED was subjected to DPP-assisted annealing using a 1.3 μm (hν=0.94 eV CW laser and a mode-locked pulsed laser with a pulse width of 17 fs. When the number of phonons was increased, the EL emission spectrum broadened toward the high-energy side by 200 meV or more. The broadening towards the low-energy side was reduced to 120 meV.
Designing broad phononic band gaps for in-plane modes
Li, Yang Fan; Meng, Fei; Li, Shuo; Jia, Baohua; Zhou, Shiwei; Huang, Xiaodong
2018-03-01
Phononic crystals are known as artificial materials that can manipulate the propagation of elastic waves, and one essential feature of phononic crystals is the existence of forbidden frequency range of traveling waves called band gaps. In this paper, we have proposed an easy way to design phononic crystals with large in-plane band gaps. We demonstrated that the gap between two arbitrarily appointed bands of in-plane mode can be formed by employing a certain number of solid or hollow circular rods embedded in a matrix material. Topology optimization has been applied to find the best material distributions within the primitive unit cell with maximal band gap width. Our results reveal that the centroids of optimized rods coincide with the point positions generated by Lloyd's algorithm, which deepens our understandings on the formation mechanism of phononic in-plane band gaps.
Sensing coherent phonons with two-photon interference
Ding, Ding; Yin, Xiaobo; Li, Baowen
2018-02-01
Detecting coherent phonons pose different challenges compared to coherent photons due to the much stronger interaction between phonons and matter. This is especially true for high frequency heat carrying phonons, which are intrinsic lattice vibrations experiencing many decoherence events with the environment, and are thus generally assumed to be incoherent. Two photon interference techniques, especially coherent population trapping (CPT) and electromagnetically induced transparency (EIT), have led to extremely sensitive detection, spectroscopy and metrology. Here, we propose the use of two photon interference in a three-level system to sense coherent phonons. Unlike prior works which have treated phonon coupling as damping, we account for coherent phonon coupling using a full quantum-mechanical treatment. We observe strong asymmetry in absorption spectrum in CPT and negative dispersion in EIT susceptibility in the presence of coherent phonon coupling which cannot be accounted for if only pure phonon damping is considered. Our proposal has application in sensing heat carrying coherent phonons effects and understanding coherent bosonic multi-pathway interference effects in three coupled oscillator systems.
International Nuclear Information System (INIS)
Wong, Joe; Krisch, M.; Farber, D.; Occelli, F.; Schwartz, A.; Chiang, T.C.; Wall, M.; Boro, C.; Xu, Ruqing
2010-01-01
Plutonium (Pu) is well known to have complex and unique physico-chemical properties. Notably, the pure metal exhibits six solid-state phase transformations with large volume expansions and contractions along the way to the liquid state: α → β → γ → (delta) → (delta)(prime) → (var e psilon) → liquid. Unalloyed Pu melts at a relatively low temperature ∼640 C to yield a higher density liquid than that of the solid from which it melts, (Figure 1). Detailed understanding of the properties of plutonium and plutonium-based alloys is critical for the safe handling, utilization, and long-term storage of these important, but highly toxic materials. However, both technical and and safety issues have made experimental observations extremely difficult. Phonon dispersion curves (PDCs) are key experimenta l data to the understanding of the basic properties of Pu materials such as: force constants, sound velocities, elastic constants, thermodynamics, phase stability, electron-phonon coupling, structural relaxation, etc. However, phonon dispersion curves (PDCs) in plutonium (Pu) and its alloys have defied measurement for the past few decades since the discovery of this element in 1941. This is due to a combination of the high thermal-neutron absorption cross section of plutonium and the inability to grow the large single crystals (with dimensions of a few millimeters) necessary for inelastic neutron scattering. Theoretical simulations of the Pu PDC continue to be hampered by the lack of suitable inter -atomic potentials. Thus, until recently the PDCs for Pu and its alloys have remained unknown experimentally and theoretically. The experimental limitations have recently been overcome by using a tightly focused undulator x-ray micro-beam scattered from single -grain domains in polycrystalline specimens. This experimental approach has been applied successfully to map the complete PDCs of an fcc d-Pu-Ga alloy using the high resolution inelastic x-ray scattering (HRIXS
Energy Technology Data Exchange (ETDEWEB)
Wong, Joe; Krisch, M.; Farber, D.; Occelli, F.; Schwartz, A.; Chiang, T.C.; Wall, M.; Boro, C.; Xu, Ruqing (UIUC); (LLNL); (ESRF); (LANL)
2010-11-16
Plutonium (Pu) is well known to have complex and unique physico-chemical properties. Notably, the pure metal exhibits six solid-state phase transformations with large volume expansions and contractions along the way to the liquid state: {alpha} {yields} {beta} {yields} {gamma} {yields} {delta} {yields} {delta}{prime} {yields} {var_epsilon} {yields} liquid. Unalloyed Pu melts at a relatively low temperature {approx}640 C to yield a higher density liquid than that of the solid from which it melts, (Figure 1). Detailed understanding of the properties of plutonium and plutonium-based alloys is critical for the safe handling, utilization, and long-term storage of these important, but highly toxic materials. However, both technical and and safety issues have made experimental observations extremely difficult. Phonon dispersion curves (PDCs) are key experimenta l data to the understanding of the basic properties of Pu materials such as: force constants, sound velocities, elastic constants, thermodynamics, phase stability, electron-phonon coupling, structural relaxation, etc. However, phonon dispersion curves (PDCs) in plutonium (Pu) and its alloys have defied measurement for the past few decades since the discovery of this element in 1941. This is due to a combination of the high thermal-neutron absorption cross section of plutonium and the inability to grow the large single crystals (with dimensions of a few millimeters) necessary for inelastic neutron scattering. Theoretical simulations of the Pu PDC continue to be hampered by the lack of suitable inter -atomic potentials. Thus, until recently the PDCs for Pu and its alloys have remained unknown experimentally and theoretically. The experimental limitations have recently been overcome by using a tightly focused undulator x-ray micro-beam scattered from single -grain domains in polycrystalline specimens. This experimental approach has been applied successfully to map the complete PDCs of an fcc d-Pu-Ga alloy using the
Zhao, Xuanke; Zhao, Qingwu; Zhang, Qinghua; Wang, Lianfen
2010-10-01
Compatible stealth of laser and infrared is an urgent demand of modern battlefield, but the demand is ambivalent for conventional materials. As a new type of artificial structure function material, photonic crystals can realize broadband thermal infrared stealth based on its high-reflection photon forbidden band. By forming a "hole-digging" reflection spectrum of doped photonic crystals, high transmittance at military laser wavelength of 1.06μm and 10.6μm can be achieved, so compatible stealth of laser and infrared can be achieved too. In this paper, we selected middle and far infrared-transparent materials, PbTe and Na3AlF6 as high refractive index and low refractive index material respectively, and designed a one-dimensional two-defect-mode photonic crystal based on principles of distributed Bragg reflector microcavity. And then its photon forbidden band was broaden to 1~20μm by constructing two heterojunction photonic crystals. The reflection spectrum and transmission spectrum of the photonic crystals were calculated by characteristic matrix method of thin-film optical theory. The calculation results show that the designed multi-cycle dual-heterojunction photonic crystal has a high spectral reflectance in the near, middle and far infrared band, whose spectral reflectivity is greater than 99% in 1~5μm and 8~14μm infrared bands, and spectral transmittance at 1.06μm and 10.6μm is greater than 96%. This will satisfy the laser and infrared compatible stealth in the near, middle and far infrared bands.
Study of the low-frequency Raman scattering in NaNbO sub 3 crystal
Bouziane, E; Ayadi, M
2003-01-01
The Raman scattering spectrum of the sodium niobate crystal, in both P and R phases, has been investigated from room temperature up to 440 sup d eg C. The dependence of the low-frequency (LF) spectrum clearly reveals, for the first time, over a wide temperature range, the presence of a strong quasi-elastic scattering below a LF zone centre phonon. The phase transition mechanism is discussed, considering an order-disorder process induced by the relaxation of the Nb ions.
National Research Council Canada - National Science Library
Giles, N. C; Xu, Chunchuan; Callahan, M. J; Wang, Buguo; Neal, J. S; Boatner, L. A
2008-01-01
Room-temperature photoluminescence has been studied in II-type bulk ZnO crystals representing three different growth methods and having free-carrier concentrations (n) ranging from 10(exp 13) to 10(exp 18) /cu cm...
Phonon squeezed states: quantum noise reduction in solids
Hu, Xuedong; Nori, Franco
1999-03-01
This article discusses quantum fluctuation properties of a crystal lattice, and in particular, phonon squeezed states. Squeezed states of phonons allow a reduction in the quantum fluctuations of the atomic displacements to below the zero-point quantum noise level of coherent phonon states. Here we discuss our studies of both continuous-wave and impulsive second-order Raman scattering mechanisms. The later approach was used to experimentally suppress (by one part in a million) fluctuations in phonons. We calculate the expectation values and fluctuations of both the atomic displacement and the lattice amplitude operators, as well as the effects of the phonon squeezed states on macroscopically measurable quantities, such as changes in the dielectric constant. These results are compared with recent experiments. Further information, including preprints and animations, are available in http://www-personal.engin.umich.edu/∼nori/squeezed.html.
Kutsenko, A. A.; Shuvalov, A. L.; Poncelet, O.
2018-01-01
A one-dimensional piezoelectric crystal coupled through periodically embedded electrodes with a two-dimensional semi-infinite periodic network of capacitors is considered. The unit cell of the network contains two capacitors with capacitances C1 and C2 which are in parallel and in series, respectively, with the electrodes. The dispersion spectrum of the longitudinal acoustoelectric wave in the piezoelectric crystal coupled with the electric wave of potentials and charges in the network of capacitors is investigated. It is shown that when C1 and C2 are of the same sign, the dispersion spectrum consists of a discrete set of curves, for which the electric wave exponentially decays into the depth of the network of capacitors. In contrast, if C1 and C2 are of the opposite sign and |C1/C2|capacitors.
He, Ping; Li, Zhijian
2001-03-01
In this work we present the new relaxation time expressions considering the detailed information of the phonon dispersion. For the three-phonon processes, it is found that only limited types of three-phonon processes are allowed to occur and the attenuation of phonon that conduct heat varies roughly with the fifth power of frequency. By using these expressions, the data of thermal conductivity of bulk silicon is well fitted. And further, the data for thin films of single crystal silicon which cannot be well fitted by the widely used model that proposed by Holland is also well fitted using the new expressions for three-phonon processes and parameters got at the previous step.
Phonon Modes and the Maintenance Condition of a Crystalline Beam
Wei, Jie; Li, Xiao-Ping; Okamoto, Hiromi; Sessler, Andrew M; Yuri, Yosuke
2005-01-01
Previously it has been shown that the maintenance condition for a crystalline beam requires that there not be a resonance between the crystal phonon frequencies and the frequency associated with a beam moving through a lattice of N periods. This resonance can be avoided provided the phonon frequencies are all below half of the lattice frequency. Here we make a detailed study of the phonon modes of a crystalline beam. Analytic results obtained in a smooth approximation using the ground-state crystalline beam structure is compared with numerical evaluation employing Fourier transform of Molecular Dynamic (MD) modes. The MD also determines when a crystalline beam is stable. The maintenance condition, when combined with either the simple analytic theory or the numerical evaluation of phonon modes, is shown to be in excellent agreement with the MD calculations of crystal stability.
International Nuclear Information System (INIS)
Russell, F.M.
1989-05-01
Energetic particles moving with a solid, either from nuclear reactions or externally injected, deposit energy by inelastic scattering processes which eventually appears as thermal energy. If the transfer of energy occurs in a crystalline solid then it is possible to couple some of the energy directly to the nuclei forming the lattice by generating phonons. In this paper the transfer of energy from a compound excited nucleus to the lattice is examined by introducing a virtual particle Π. It is shown that by including a Π in the nuclear reaction a substantial amount of energy can be coupled directly to the lattice. In the lattice this particle behaves as a spatially localized phonon of high energy, the so-called supra-ballistic phonon. By multiple inelastic scattering the supra-ballistic phonon eventually thermalizes. Because both the virtual particle Π and the equivalent supra-ballistic phonon have no charge or spin and can only exist within a lattice it is difficult to detect other than by its decay into thermal phonons. The possibility of a Π removing excess energy from a compound nucleus formed by the cold fusion of deuterium is examined. (Author)
International Nuclear Information System (INIS)
Fenske, D.; Shihada, A.F.; Schwab, H.; Dehnicke, K.
1980-01-01
The title compound was obtained from VO 2 Cl and [Ph 3 PMe]Cl in CH 2 Cl 2 solution in form of orange crystals. Its crystal structure was determined with X-ray diffraction data and was refined to a residual index of R = 5.6% (2124 observed, independent reflexions). [Ph 3 PMe][VO 2 Cl 2 ] crystallizes in the rhombic space group P2 1 2 1 2 1 = D 2 4 with four formula units in the unit cell. The low symmetry of the space group causes chirality of the cation. The complex anion is in good agreement with Csub(2v) symmetry; it is isoelectronic with CrO 2 Cl 2 . The vibrational spectrum (IR, Raman) was recorded and assigned. (author)
On-chip photonic-phononic emitter-receiver apparatus
Cox, Jonathan Albert; Jarecki, Jr., Robert L.; Rakich, Peter Thomas; Wang, Zheng; Shin, Heedeuk; Siddiqui, Aleem; Starbuck, Andrew Lea
2017-07-04
A radio-frequency photonic devices employs photon-phonon coupling for information transfer. The device includes a membrane in which a two-dimensionally periodic phononic crystal (PnC) structure is patterned. The device also includes at least a first optical waveguide embedded in the membrane. At least a first line-defect region interrupts the PnC structure. The first optical waveguide is embedded within the line-defect region.
Raman active phonon and crystal-field studies of Yb.sup.3+./sup. doped NdVO.sub.4./sub..
Czech Academy of Sciences Publication Activity Database
Jandl, S.; Lévesque, Y.; Nekvasil, Vladimír; Bettinelli, M.
2010-01-01
Roč. 32, č. 11 (2010), s. 1549-1552 ISSN 0925- 3467 R&D Projects: GA AV ČR IAA100100803 Institutional research plan: CEZ:AV0Z10100520 Keywords : crystal-field * laser materials * infrared * Raman * interacting ion pair Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 1.679, year: 2010
Raman spectrum analysis on the solid-liquid boundary layer of BGO crystal growth
International Nuclear Information System (INIS)
Zhang Xia; Yin Shaotang; Wan Songming; Zhang Qingli; You Jinglin; Chen Hui; Zhao Sijie
2007-01-01
We study the Raman spectra of Bi 4 Ge 3 O 12 crystal at different temperatures, as well as its melt. The structure characters of the single crystal, melt and growth solid-liquid boundary layer of BGO are investigated by their high-temperature Raman spectra for the first time. The rule of structure change of BGO crystal with increasing temperature is analysed. The results show that there exists [GeO 4 ] polyhedral structure and Bi ion independently in BGO melt. The bridge bonds Bi-O-Bi and Bi-O-Ge appear in the crystal and at the boundary layer, but disappear in the melt. The structure of the growth solid-liquid boundary layer is similar to that of BGO crystal. In the melt, the long-range order structure of the crystal disappears. The thickness of the growth solid-liquid boundary layer of BGO crystal is about 50 μm. (authors)
Theory of generation of angular momentum of phonons by heat current and its conversion to spins
Hamada, Masato; Murakami, Shuichi
Spin-rotation coupling in crystals will enable us to convert between spin current and mechanical rotations, as has been studied in surface acoustic waves, in liquid metals, and in carbon nanotubes. In this presentation we focus on angular momentum of phonons. In nonmagnetic crystals without inversion symmetry, we theoretically demonstrate that phonon modes generally have angular momenta depending on their wave vectors. In equilibrium the sum of the angular momenta is zero. On the other hand, if a heat current flows in the crystal, nonequilibrium phonon distribution leads to nonzero total angular momentum of phonons. It can be observed as a rotation of crystal itself, and as a spin current induced by these phonons via the spin-rotation coupling.
Aghanejad, Iman; Markley, Loïc
2017-11-01
We present spatial frequency maps of power flow in metamaterials and photonic crystals in order to provide insights into their electromagnetic responses and further our understanding of backward power in periodic structures. Since 2001, many different structures across the electromagnetic spectrum have been presented in the literature as exhibiting an isotropic negative effective index. Although these structures all exhibit circular or spherical equifrequency contours that resemble those of left-handed media, here we show through k -space diagrams that the distribution of power in the spatial frequency domain can vary considerably across these structures. In particular, we show that backward power arises from high-order right-handed harmonics in photonic crystals, magnetodielectric crystals, and across the layers of coupled-plasmonic-waveguide metamaterials, while arising from left-handed harmonic pairs in split-ring resonator and wire composites, plasmonic crystals, and along the layers of coupled-plasmonic-waveguide metamaterials. We also show that the fishnet structure exhibits the same left-handed harmonic pairs as the latter group. These observations allow us to categorize different metamaterials according to their spatial spectral source of backward power and identify the mechanism behind negative refraction at a given interface. Finally, we discuss how k -space maps of power flow can be used to explain the high or low transmittance of power into different metamaterial or photonic crystal structures.
Enantiotopic discrimination in the NMR spectrum of prochiral solutes in chiral liquid crystals.
Lesot, Philippe; Aroulanda, Christie; Zimmermann, Herbert; Luz, Zeev
2015-04-21
The splitting of signals in the NMR spectra originating from enantiotopic sites in prochiral molecules when dissolved in chiral solvents is referred to as spectral enantiotopic discrimination. This phenomenon is particularly noticeable in chiral liquid crystals (CLCs) due to the combined effect of the anisotropic magnetic interactions and the ordering of the solute in the mesophase. The enantiorecognition mechanisms are different for rigid and flexible solutes. For the former, discrimination results from symmetry breaking and is restricted to solutes whose point groups belong to one of the following four ("allowed") symmetries, Cs, C2v, D2d and S4. The nature of the symmetry breaking for each one of these groups is discussed and experimental examples, using mainly (2)H 1D/2D-NMR in chiral polypeptide lyotropic mesophases, are presented and analyzed. When flexible optically active solutes undergo fast racemization (on the NMR timescale) their spectrum corresponds to that of an average prochiral molecule and may exhibit enantiotopic sites. In CLCs, such sites will become discriminated, irrespective of their average (improper) symmetry. This enantiodiscrimination results mainly from the different ordering of the interchanging enantiomers. Several examples of such flexible molecules, including solutes with average axial and planar symmetries, are commented. Dynamic processes in solution that are not accompanied by the modulation of magnetic interactions remain "NMR blind". This is sometimes the case for interconversion of enantiomers (racemization) or exchange of enantiotopic sites in isotropic solvents. The limitation can be lifted by using CLCs. In such solvents, non-equivalence between enantiomers or between enantiotopic sites is induced by the chiral environment, thus providing the necessary interactions to be modulated by the dynamic processes. Illustrative examples involving exchange of both, enantiotopic sites and enantiomers are examined. In this comprehensive
Effect of yttrium on electron–phonon coupling strength of 5d state of Ce3+ ion in LYSO:Ce crystals
International Nuclear Information System (INIS)
Ding, Dongzhou; Liu, Bo; Wu, Yuntao; Yang, Jianhua; Ren, Guohao; Chen, Junfeng
2014-01-01
This paper aims at an improved understanding of luminescence properties of (Lu 1−x Y x ) 2 SiO 5 :Ce (x=0 at%, 26 at%, 45 at%, 66 at% and 100 at%). Photoluminescence emission and excitation spectra as well as Raman spectra of (Lu 1−x Y x ) 2 SiO 5 :Ce were investigated as a function of yttrium (shortened as Y) content in it. Obtained Huang–Rhys factor S indicates that the coupling between Ce1 (7-oxygen-coordinated), Ce2 (6-oxygen-coordinated) and LYSO lattice is intermediate and strong, respectively. Besides, it was found that: with the increase of Y content, crystal field strength around Ce1 and Ce2 decreases, Stokes shift of Ce1 and Ce2 presents an increase trend, and S of Ce2 tends to decrease. These phenomena were explained by geometrical influence of Y 3+ /Lu 3+ on the crystal field splitting of the 5d levels of Ce 3+ and coupling strength. With the increase of Y content, the evolution of S and coupling energy ħω of Ce1 present a slight increase and decrease trend respectively, while S and coupling energy ħω of Ce2 present an obvious decrease and increase trend, respectively. - Highlights: • Crystal field strength around Ce1 decreases with increase of Y content in LYSO:Ce. • A diagram of Huang–Rhys factor S against Y content in LYSO:Ce was constructed. • A diagram of coupling energy ħω against Y content in LYSO:Ce was constructed. • A diagram of Stokes shift against Y content in LYSO:Ce was constructed
Phononic fluidics: acoustically activated droplet manipulations
Reboud, Julien; Wilson, Rab; Bourquin, Yannyk; Zhang, Yi; Neale, Steven L.; Cooper, Jonathan M.
2011-02-01
Microfluidic systems have faced challenges in handling real samples and the chip interconnection to other instruments. Here we present a simple interface, where surface acoustic waves (SAWs) from a piezoelectric device are coupled into a disposable acoustically responsive microfluidic chip. By manipulating droplets, SAW technologies have already shown their potential in microfluidics, but it has been limited by the need to rely upon mixed signal generation at multiple interdigitated electrode transducers (IDTs) and the problematic resulting reflections, to allow complex fluid operations. Here, a silicon chip was patterned with phononic structures, engineering the acoustic field by using a full band-gap. It was simply coupled to a piezoelectric LiNbO3 wafer, propagating the SAW, via a thin film of water. Contrary to the use of unstructured superstrates, phononic metamaterials allowed precise spatial control of the acoustic energy and hence its interaction with the liquids placed on the surface of the chip, as demonstrated by simulations. We further show that the acoustic frequency influences the interaction between the SAW and the phononic lattice, providing a route to programme complex fluidic manipulation onto the disposable chip. The centrifugation of cells from a blood sample is presented as a more practical demonstration of the potential of phononic crystals to realize diagnostic systems.
Hydrodynamic states of phonons in insulators
Directory of Open Access Journals (Sweden)
S.A. Sokolovsky
2012-12-01
Full Text Available The Chapman-Enskog method is generalized for accounting the effect of kinetic modes on hydrodynamic evolution. Hydrodynamic states of phonon system of insulators have been studied in a small drift velocity approximation. For simplicity, the investigation was carried out for crystals of the cubic class symmetry. It has been found that in phonon hydrodynamics, local equilibrium is violated even in the approximation linear in velocity. This is due to the absence of phonon momentum conservation law that leads to a drift velocity relaxation. Phonon hydrodynamic equations which take dissipative processes into account have been obtained. The results were compared with the standard theory based on the local equilibrium validity. Integral equations have been obtained for calculating the objects of the theory (including viscosity and heat conductivity. It has been shown that in low temperature limit, these equations are solvable by iterations. Steady states of the system have been considered and an expression for steady state heat conductivity has been obtained. It coincides with the famous result by Akhiezer in the leading low temperature approximation. It has been established that temperature distribution in the steady state of insulator satisfies a condition of heat source absence.
Raman selection rule of surface optical phonon in ZnS nanobelts
Ho, Chih-Hsiang
2016-02-18
We report Raman scattering results of high-quality wurtzite ZnS nanobelts (NBs) grown by chemical vapor deposition. In Raman spectrum, the ensembles of ZnS NBs exhibit first order phonon modes at 274 cm-1 and 350 cm-1, corresponding to A1/E1 transverse optical and A1/E1 longitudinal optical phonons, in addition with strong surface optical (SO) phonon mode at 329 cm-1. The existence of SO band is confirmed by its shift with different surrounding dielectric media. Polarization dependent Raman spectrum was performed on a single ZnS NB and for the first time SO phonon band has been detected on a single nanobelt. Different selection rules of SO phonon modeshown from their corresponding E1/A1 phonon modeswere attributed to the anisotropic translational symmetry breaking on the NB surface.
Anharmonic phonons and magnons in BiFeO3
Energy Technology Data Exchange (ETDEWEB)
Delaire, Olivier A [ORNL; Ma, Jie [ORNL; Stone, Matthew B [ORNL; Huq, Ashfia [ORNL; Gout, Delphine J [ORNL; Brown, Craig [National Institute of Standards and Technology (NIST); Wang, Kefeng [Nanjing National Laboratory of Microstructures, Nanjing University, Nanjing; Ren, Zhifeng [Boston College, Chestnut Hill
2012-01-01
The phonon density of states (DOS) and magnetic excitation spectrum of polycrystalline BiFeO3 were measured for temperatures 200 < T < 750K , using inelastic neutron scattering (INS). Our results indicate that the magnetic spectrum of BiFeO3 closely resembles that of similar Fe perovskites, such as LaFeO3, despite the cycloid modulation in BiFeO3. We do not find any evidence for a spin gap. A strong T-dependence of the phonon DOS was found, with a marked broadening of the whole spectrum, providing evidence of strong anharmonicity. This anharmonicity is corroborated by large amplitude motions of Bi and O ions observed with neutron diffraction. These results highlight the importance of spin-phonon coupling in this material.
Infrared Peak Splitting from Phonon Localization in Solid Hydrogen.
Magdău, Ioan B; Ackland, Graeme J
2017-04-07
We show that the isotope effect leads to a completely different spectroscopic signal in hydrogen-deuterium mixtures, compared to pure elements that have the same crystal structure. This is particularly true for molecular vibrations, which are the main source of information about the structure of high-pressure hydrogen. Mass disorder breaks translational symmetry, meaning that vibrations are localized almost to single molecules, and are not zone-center phonons. In mixtures, each observable infrared (IR) peak corresponds to a collection of many such molecular vibrations, which have a distribution of frequencies depending on local environment. Furthermore discrete groups of environments cause the peaks to split. We illustrate this issue by considering the IR spectrum of the high-pressure phase III structure of hydrogen, recently interpreted as showing novel phases in isotopic mixtures. We calculate the IR spectrum of hydrogen-deuterium mixtures in the C2/c and Cmca-12 structures, showing that isotopic disorder gives rise to mode localization of the high-frequency vibrons. The local coordination of the molecules leads to discrete IR peaks. The spread of frequencies is strongly enhanced with pressure, such that more peaks become resolvable at higher pressures, in agreement with the recent measurements.
Topological phononic insulator with robust pseudospin-dependent transport
Xia, Bai-Zhan; Liu, Ting-Ting; Huang, Guo-Liang; Dai, Hong-Qing; Jiao, Jun-Rui; Zang, Xian-Guo; Yu, De-Jie; Zheng, Sheng-Jie; Liu, Jian
2017-09-01
Topological phononic states, which facilitate unique acoustic transport around defects and disorders, have significantly revolutionized our scientific cognition of acoustic systems. Here, by introducing a zone folding mechanism, we realize the topological phase transition in a double Dirac cone of the rotatable triangular phononic crystal with C3 v symmetry. We then investigate the distinct topological edge states on two types of interfaces of our phononic insulators. The first one is a zigzag interface which simultaneously possesses a symmetric mode and an antisymmetric mode. Hybridization of the two modes leads to a robust pseudospin-dependent one-way propagation. The second one is a linear interface with a symmetric mode or an antisymmetric mode. The type of mode is dependent on the topological phase transition of the phononic insulators. Based on the rotatability of triangular phononic crystals, we consider several complicated contours defined by the topological zigzag interfaces. Along these contours, the acoustic waves can unimpededly transmit without backscattering. Our research develops a route for the exploration of the topological phenomena in experiments and provides an excellent framework for freely steering the acoustic backscattering-immune propagation within topological phononic structures.
Temperature dependence of the dynamics of zone boundary phonons in ZnO:Li
Yadav, Harish Kumar; Sreenivas, K.; Gupta, Vinay; Katiyar, R. S.
2008-12-01
Investigations of zone boundary phonons in ZnO:Li system (Li concentration: 10%) and their dynamics with temperature are reported. Additional modes at 127, 157, and 194 cm-1 are observed and assigned to zone boundary phonons at critical point M in the Brillouin zone [J. M. Calleja and M. Cardona, Phys. Rev. B 16, 3753 (1977)] due to breakdown of crystal translational symmetry with Li incorporation in ZnO. Anharmonicity in peak frequency and linewidth of the zone boundary phonons in a temperature range from 100 to 1000 K is also analyzed taking into account the decay of zone boundary phonons into three- and four-phonon modes (cubic and quadratic anharmonicities). The anharmonic behavior of peak frequency is found to be feebly dependent on three-phonon decay process but thermal expansion of lattice together with four-phonon decay process appropriately defines the temperature dependence. Linewidths, however, follow the simple four-phonon decay mechanism. E2(low) mode, on the other hand, shows a linear temperature dependency and therefore follows a three-phonon decay channel. The calculated values of phonon lifetimes at 100 K for the 127, 157, 194 cm-1, and E2(low) modes are 8.23, 6.54, 5.32, and 11.39 ps. Decay of the zone boundary phonon modes compared to E2(low) mode reveals that dopant induced disorder has a strong temperature dependency.
Phonon band structures of the three dimensional latticed pentamode metamaterials
Directory of Open Access Journals (Sweden)
Guan Wang
2017-02-01
Full Text Available The artificially designed three-dimensional (3D pentamode metamaterials have such an extraordinary characteristic that the solid materials behave like liquids. Meanwhile, the ideal structure of the pentamode metamaterials arranges in the same way as that of the diamond crystals. In the present research, we regard three types of pentamode metamaterials derived from the 3D crystal lattices as research objects. The phonon band structures of the candidate pentamode structures are calculated by using the finite element method (FEM. We illustrate the relation between the ratio of the bulk modulus B and the shear modulus G of different combinations of D and d. Finally, we find out the relationship between the phonon band structure and the structure parameters. It is useful for generating the phonon band structure and controlling elastic wave propagation.
Sound and dissipation coefficients in the phonon-impurity system of 3He-4He solutions
International Nuclear Information System (INIS)
Adamenko, I.N.; Rudavskii, E.Y.; Tsyganok, V.I.; Chagovets, V.K.
1988-01-01
The phonon-impurity system of dilute solutions of 3 He in 4 He is studied experimentally and theoretically using an acoustic technique. The sound velocity and absorption measurements make it possible to identify the theoretically predicted new mechanism of phonon relaxation with anomalous dispersion in the presence of impurities. A kinetic problem for arbitrary frequencies is solved, which also enables the authors to obtain all the dissipation coefficients of the solutions and to explain the experimental data on second-sound absorption, thermal conductivity, and heat pulse propagation. The relation is considered between relaxation processes in a phonon-impurity system and the phonon spectrum dispersion in 3 He- 4 solutions
Transmission spectrum of a double quantum-dot-nanocavity system in photonic crystals
International Nuclear Information System (INIS)
Qian Jun; Jin Shiqi; Gong Shangqing; Qian Yong; Feng Xunli
2008-01-01
We investigate the optical transmission properties of a combined system which consists of two quantum-dot-nanocavity subsystems indirectly coupled to a waveguide in a planar photonic crystal. A Mollow-like triplet and the growth of sidebands are found, reflecting intrinsic optical responses in the complex microstructure
Page 1 Mgo Crystal Structure and Its Infra-Red Absorption Spectrum ...
Indian Academy of Sciences (India)
Mgo Crystal Structure and Its Infra-Red Absorption Spectrum–II 227 for each of the possible modes of vibration deduced from the geometry of º the structure. Their solution would give us the frequencies of those modes of vibration. -. The forces acting on an atom which determine its movements are those arising from the ...
International Nuclear Information System (INIS)
Sharma, R.P.; Sharma, A.K.; Sharma, S.; Sinha, H.P.
1979-01-01
In a study of the lattice dynamics of Be a simple scheme has been developed in which the pairwise and long range forces are accounted on the lines of nonlocal theory and the short range three-body forces are included. This procedure of calculations has been applied to compute the phonon dispersion in Be and the results of investigation have been compared with the experimental data. (author)
Phonon Measurements and Model Calculations for Naphtalene-d8
DEFF Research Database (Denmark)
Mackenzie, Gordon A.; Pawley, G. S.; Dietrich, O. W.
1977-01-01
Measurements of the phonon dispersion curves in naphthalene-d8, (deuteration >99%), taken at 77K are presented. The experiments were done on two crystals, using the triple-axis neutron spectrometers at the medium flux reactor, DR3 at Riso. Most of the external or lattice modes have been measured...
Quantum Phonon Optics: Squeezing Quantum Noise in the Atomic Displacements.
Hu, X.; Nori, F.
1996-03-01
We have investigated(X. Hu and F. Nori, Physical Review B, in press; preprints.) coherent and squeezed quantum states of phonons. Squeezed states are interesting because they allow the possibility of modulating the quantum fluctuations of atomic displacements below the zero-point quantum noise level of phonon vacuum states. We have studiedfootnotemark[1] the possibility of squeezing quantum noise in the atomic displacement using a polariton-based approach and also a method based on the three-phonon anharmonic interaction. Our focus here is on the first approach. We have diagonalized the polariton Hamiltonian and calculated the corresponding expectation values and fluctuations of both the atomic displacement and the lattice amplitude operators (the later is the phonon analog of the electric field operator for photons). Our results shows that squeezing of quantum fluctuations in the atomic displacements can be achieved with appropriate initial states of both photon and phonon fields. The degree of squeezing is directly related to the crystal susceptibility, which is indicative of the interaction strength between the incident light and the crystal.
Energy Technology Data Exchange (ETDEWEB)
Ismayilova, N. A., E-mail: ismayilova-narmin-84@mail.ru; Orudjev, H. S.; Jabarov, S. H. [Azerbaijan National Academy of Sciences, Institute of Physics (Azerbaijan)
2017-04-15
The results of ab initio calculations of the electron spectrum of TlFeS{sub 2} and TlFeSe{sub 2} crystals in the antiferromagnetic phase are reported. Calculations are carried out in the context of the density functional theory. The origin of the bands of s, p, and d electron states of Tl, Fe, S, and Se atoms is studied. It is established that, in the antiferromagnetic phase, the crystals possess semiconductor properties. The band gaps are found to be 0.05 and 0.34 eV for TlFeS{sub 2} and TlFeSe{sub 2} crystals, respectively.
Large scale phononic metamaterials for seismic isolation
Energy Technology Data Exchange (ETDEWEB)
Aravantinos-Zafiris, N. [Department of Sound and Musical Instruments Technology, Ionian Islands Technological Educational Institute, Stylianou Typaldou ave., Lixouri 28200 (Greece); Sigalas, M. M. [Department of Materials Science, University of Patras, Patras 26504 (Greece)
2015-08-14
In this work, we numerically examine structures that could be characterized as large scale phononic metamaterials. These novel structures could have band gaps in the frequency spectrum of seismic waves when their dimensions are chosen appropriately, thus raising the belief that they could be serious candidates for seismic isolation structures. Different and easy to fabricate structures were examined made from construction materials such as concrete and steel. The well-known finite difference time domain method is used in our calculations in order to calculate the band structures of the proposed metamaterials.
Large scale phononic metamaterials for seismic isolation
International Nuclear Information System (INIS)
Aravantinos-Zafiris, N.; Sigalas, M. M.
2015-01-01
In this work, we numerically examine structures that could be characterized as large scale phononic metamaterials. These novel structures could have band gaps in the frequency spectrum of seismic waves when their dimensions are chosen appropriately, thus raising the belief that they could be serious candidates for seismic isolation structures. Different and easy to fabricate structures were examined made from construction materials such as concrete and steel. The well-known finite difference time domain method is used in our calculations in order to calculate the band structures of the proposed metamaterials
Phonon density of states and anharmonicity of UO2
Pang, Judy W. L.; Chernatynskiy, Aleksandr; Larson, Bennett C.; Buyers, William J. L.; Abernathy, Douglas L.; McClellan, Kenneth J.; Phillpot, Simon R.
2014-03-01
Phonon density of states (PDOS) measurements have been performed on polycrystalline UO2 at 295 and 1200 K using time-of-flight inelastic neutron scattering to investigate the impact of anharmonicity on the vibrational spectra and to benchmark ab initio PDOS simulations performed on this strongly correlated Mott insulator. Time-of-flight PDOS measurements include anharmonic linewidth broadening, inherently, and the factor of ˜7 enhancement of the oxygen spectrum relative to the uranium component by the increased neutron sensitivity to the oxygen-dominated optical phonon modes. The first-principles simulations of quasiharmonic PDOS spectra were neutron weighted and anharmonicity was introduced in an approximate way by convolution with wave-vector-weighted averages over our previously measured phonon linewidths for UO2, which are provided in numerical form. Comparisons between the PDOS measurements and the simulations show reasonable agreement overall, but they also reveal important areas of disagreement for both high and low temperatures. The discrepancies stem largely from a ˜10 meV compression in the overall bandwidth (energy range) of the oxygen-dominated optical phonons in the simulations. A similar linewidth-convoluted comparison performed with the PDOS spectrum of Dolling et al. obtained by shell-model fitting to their historical phonon dispersion measurements shows excellent agreement with the time-of-flight PDOS measurements reported here. In contrast, we show by comparisons of spectra in linewidth-convoluted form that recent first-principles simulations for UO2 fail to account for the PDOS spectrum determined from the measurements of Dolling et al. These results demonstrate PDOS measurements to be stringent tests for ab inito simulations of phonon physics in UO2 and they indicate further the need for advances in theory to address the lattice dynamics of UO2.
Phonon-induced optical superlattice.
de Lima, M M; Hey, R; Santos, P V; Cantarero, A
2005-04-01
We demonstrate the formation of a dynamic optical superlattice through the modulation of a semiconductor microcavity by stimulated acoustic phonons. The high coherent phonon population produces a folded optical dispersion relation with well-defined energy gaps and renormalized energy levels, which are accessed using reflection and diffraction experiments.
Quasiparticle-phonon nuclear model
International Nuclear Information System (INIS)
Soloviev, V.G.
1977-01-01
The general assumptions of the quasiparticle-phonon model of complex nuclei are given. The choice of the model hamiltonian as an average field and residual forces is discussed. The phonon description and quasiparticle-phonon interaction are presented. The system of basic equations and their approximate solutions are obtained. The approximation is chosen so as to obtain the most correct description of few-quasiparticle components rather than of the whole wave function. The method of strenght functions is presented, which plays a decisive role in practical realization of the quasiparticle-phonon model for the description of some properties of complex nuclei. The range of applicability of the quasiparticle-phonon nuclear model is determined as few-quasiparticle components of the wave functions at low, intermediate and high excitation energies averaged in a certain energy interval
Far infrared spectroscopy of Ge film deposited on a piece of Si wafer and single crystal Ge
International Nuclear Information System (INIS)
Roslan, M.; Ibrahim, K.; Wan Abdullah, A.K.
1991-01-01
The far infrared spectrum of thin polycrystalline film of Ge of approximately 10 μm deposited on a piece of Si wafer (99.99% purity) has been obtained using the far infrared Fourier transform spectroscopy system developed recently in our laboratory. The spectrum of Ge film from 180 to 480 cm -1 obtained after rationing against Si wafer spectrum at a resolution of about 1 cm -1 has been obtained. It is interesting to note that this thin film of Ge is extremely transparent to radiation in this region and phonon absorption processes as reported previously could not be observed due to thinness of the film. The spectrum of a single crystal of Ge (99.9% purity) and Ge-doped Li have revealed several absorption bands which we have assigned as due to 2-phonon and 3-phonon processes in Ge. The bands at 195, 273 and 287 cm -1 could not be assigned as phonon processes and at present we do not know the causes of these absorption bands
Czech Academy of Sciences Publication Activity Database
Buixaderas, Elena; Gregora, Ivan; Hlinka, Jiří; Dec, J.; Lukasiewicz, T.
2013-01-01
Roč. 86, 2-3 (2013), s. 217-229 ISSN 0141-1594 R&D Projects: GA ČR GAP204/10/0616 Institutional research plan: CEZ:AV0Z10100520 Keywords : ferroelectrics * Raman spectroscopy * IR spectroscopy * phonons * relaxors * tungsten-bronze materials Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 1.044, year: 2013
Experimental determination of the berilium phonon spectra using inelastic neutro scattering
International Nuclear Information System (INIS)
Sirota, N.N.; Bulat, I.A.
1976-01-01
A study has been made of in elastic scattering of cold neutrons with energies between 0.0022 and 0.00523 eV by polycrystalline beryllium and restoration of its phonon spectrum. The specimen studied is a block of polycrystalline beryllium. In the case of beryllium the averaging of coherent effects upon scattering on a thick specimen takes place as a result of multiple internal Bragg-type reflections of neutrons which undergo inelastic scattering with absorption of phonons. The thickness of the spheric averaging layer for Esub(6) = 0.00523 eV is almost equal to the maximum dimension of the Brillouin band. The phonon spectrum of beryllium for three mean energies used of incident neutrons has been demonstrated. The phonon spectrum of beryllium, measured for the first time, is of interest for quantitative calculations of a number of its physical properties
Electrical switch to the resonant magneto-phonon effect in graphene.
Leszczynski, Przemyslaw; Han, Zheng; Nicolet, Aurelien A L; Piot, Benjamin A; Kossacki, Piotr; Orlita, Milan; Bouchiat, Vincent; Basko, Denis M; Potemski, Marek; Faugeras, Clement
2014-03-12
We report a comprehensive study of the tuning with electric fields of the resonant magneto-exciton optical phonon coupling in gated graphene. For magnetic fields around B ∼ 25 T that correspond to the range of the fundamental magneto-phonon resonance, the electron-phonon coupling can be switched on and off by tuning the position of the Fermi level in order to Pauli block the two fundamental inter-Landau level excitations. The effects of such a profound change in the electronic excitation spectrum are traced through investigations of the optical phonon response in polarization resolved magneto-Raman scattering experiments. We report on the observation of a splitting of the phonon feature with satellite peaks developing at particular values of the Landau level filling factor on the low or on the high energy side of the phonon, depending on the relative energy of the discrete electronic excitation and of the optical phonon. Shifts of the phonon energy as large as ±60 cm(-1) are observed close to the resonance. The intraband electronic excitation, the cyclotron resonance, is shown to play a relevant role in the observed spectral evolution of the phonon response.
Yu, Yi; Huang, Yisheng; Zhang, Lizhen; Lin, Zhoubin; Sun, Shijia; Wang, Guofu
2014-07-01
A Nd3+:Na2La4(WO4)7 crystal with dimensions of ϕ 17 × 30 mm3 was grown by the Czochralski method. The thermal expansion coefficients of Nd3+:Na2La4(WO4)7 crystal are 1.32 × 10-5 K-1 along c-axis and 1.23 × 10-5 K-1 along a-axis, respectively. The spectroscopic characteristics of Nd3+:Na2La4(WO4)7 crystal were investigated. The Judd-Ofelt theory was applied to calculate the spectral parameters. The absorption cross sections at 805 nm are 2.17 × 10-20 cm2 with a full width at half maximum (FWHM) of 15 nm for π-polarization, and 2.29 × 10-20 cm2 with a FWHM of 14 nm for σ-polarization. The emission cross sections are 3.19 × 10-20 cm2 for σ-polarization and 2.67 × 10-20 cm2 for π-polarization at 1,064 nm. The fluorescence quantum efficiency is 67 %. The quasi-cw laser of Nd3+:Na2La4(WO4)7 crystal was performed. The maximum output power is 80 mW. The slope efficiency is 7.12 %. The results suggest Nd3+:Na2La4(WO4)7 crystal as a promising laser crystal fit for laser diode pumping.
Classification of topological phonons in linear mechanical metamaterials.
Süsstrunk, Roman; Huber, Sebastian D
2016-08-16
Topological phononic crystals, alike their electronic counterparts, are characterized by a bulk-edge correspondence where the interior of a material dictates the existence of stable surface or boundary modes. In the mechanical setup, such surface modes can be used for various applications such as wave guiding, vibration isolation, or the design of static properties such as stable floppy modes where parts of a system move freely. Here, we provide a classification scheme of topological phonons based on local symmetries. We import and adapt the classification of noninteracting electron systems and embed it into the mechanical setup. Moreover, we provide an extensive set of examples that illustrate our scheme and can be used to generate models in unexplored symmetry classes. Our work unifies the vast recent literature on topological phonons and paves the way to future applications of topological surface modes in mechanical metamaterials.
Classification of topological phonons in linear mechanical metamaterials
Süsstrunk, Roman
2016-01-01
Topological phononic crystals, alike their electronic counterparts, are characterized by a bulk–edge correspondence where the interior of a material dictates the existence of stable surface or boundary modes. In the mechanical setup, such surface modes can be used for various applications such as wave guiding, vibration isolation, or the design of static properties such as stable floppy modes where parts of a system move freely. Here, we provide a classification scheme of topological phonons based on local symmetries. We import and adapt the classification of noninteracting electron systems and embed it into the mechanical setup. Moreover, we provide an extensive set of examples that illustrate our scheme and can be used to generate models in unexplored symmetry classes. Our work unifies the vast recent literature on topological phonons and paves the way to future applications of topological surface modes in mechanical metamaterials. PMID:27482105
Coherent Phonons Spectroscopy in Si/SiGe superlattices
Michel, Helene; Ezzahri, Younes; Shakouri, Ali; Pernot, Gilles; Rampnoux, Jean-Michel; Dilhaire, Stefan
2010-03-01
Ultrafast pump-probe experiments have been extensively used for coherent zone-folded acoustic phonon spectroscopy in semiconductor superlattices (SL). Most of the spectroscopy studies have been realized via impulsive stimulated Raman scattering (ISRS). More recently some studies, focused on Si/SixGe1-x SL, have combined the spectroscopy via ISRS with the spectroscopy of phonons Bragg reflected via picosecond acoustic experiment. In the latter case, sample needs to be covered by a metallic film which serves as a transducer to convert the optical energy into an impulse heating and thermal expansion. This launches coherent acoustic phonons into the SL structure. Here we present a systematic study of coherent phonons in different Si/SixGe1-x SL structures with two different superlattice periods and transducer thicknesses. The measured acoustic spectrums show that the thickness of the transducer should be chosen as function as the SL period to be able to generate and detect both phonons Bragg reflected and excited by ISRS.
Energy Technology Data Exchange (ETDEWEB)
Flach, B.
2000-01-01
This thesis has two topics: One is the investigation of an adsorbate induced phonon anomaly on W(110) and Mo{sub 1-x}Re{sub x}(110) (x = 5, 15, 25%) with inelastic helium atom scattering (HAS). The other one is the study of the growth, morphology and dynamics of ultra-thin lithium films deposited on W(110). In 1992 a giant phonon anomaly was found by J. Luedecke on the hydrogen saturated W(110) and Mo(110) surfaces. The anomaly consists of a deep and sharp indentation in the phonon dispersion curves in which the phonon energy nearly drops to zero ({omega}{sub 1}). In addition, a small and broad dip in the surface Rayleigh mode is observed ({omega}{sub 2}). The anomaly appears in the anti {gamma}-H- as well as in the anti {gamma}-S-direction of the surface Brillouin zone (SBZ). Since its first discovery, numerous other experimental and theoretical studies have followed. In the present work the effects is reinvestigated and experimental parameters, such as the crystal temperature and the incident energy, were changed in order to study their influence on the anomalous phonon behavior. In the case of H/Mo(110) the substrate was changed as well by alloying with small amounts of rhenium. In the present experiments a strong crystal temperature dependence of the {omega}{sub 2}-branch was found which leads to lower energies at the 'dip' for smaller temperatures, while the {omega}{sub 1}-anomaly remains unchanged. Such behavior agrees well with the picture that the {omega}{sub 2}-branch is due to a Kohn anomaly. (orig.)
Strong electron-phonon interaction in the high-Tc superconductors: Evidence from the infrared
International Nuclear Information System (INIS)
Timusk, T.; Porter, C.D.; Tanner, D.B.
1991-01-01
We show that low-frequency structure in the infrared reflectance of the high-temperature superconductor YBa 2 Cu 3 O 7 results from the electron-phonon interaction. Characteristic antiresonant line shapes are seen in the phonon region of the spectrum and the frequency-dependent scattering rate of the mid-infrared electronic continuum has peaks at 150 cm -1 (19 meV) and at 360 cm -1 (45 meV) in good agreement with phonon density-of-states peaks in neutron time-of-flight spectra that develop in superconducting samples. The interaction between the phonons and the charge carriers can be understood in terms of a charged-phonon model
First-principles prediction of phononic thermal conductivity of silicene: A comparison with graphene
International Nuclear Information System (INIS)
Gu, Xiaokun; Yang, Ronggui
2015-01-01
There has been great interest in two-dimensional materials, beyond graphene, for both fundamental sciences and technological applications. Silicene, a silicon counterpart of graphene, has been shown to possess some better electronic properties than graphene. However, its thermal transport properties have not been fully studied. In this paper, we apply the first-principles-based phonon Boltzmann transport equation to investigate the thermal conductivity of silicene as well as the phonon scattering mechanisms. Although both graphene and silicene are two-dimensional crystals with similar crystal structure, we find that phonon transport in silicene is quite different from that in graphene. The thermal conductivity of silicene shows a logarithmic increase with respect to the sample size due to the small scattering rates of acoustic in-plane phonon modes, while that of graphene is finite. Detailed analysis of phonon scattering channels shows that the linear dispersion of the acoustic out-of-plane (ZA) phonon modes, which is induced by the buckled structure, makes the long-wavelength longitudinal acoustic phonon modes in silicene not as efficiently scattered as that in graphene. Compared with graphene, where most of the heat is carried by the acoustic out-of-plane (ZA) phonon modes, the ZA phonon modes in silicene only have ∼10% contribution to the total thermal conductivity, which can also be attributed to the buckled structure. This systematic comparison of phonon transport and thermal conductivity of silicene and graphene using the first-principle-based calculations shed some light on other two-dimensional materials, such as two-dimensional transition metal dichalcogenides
Synthesis, crystal structure and Raman spectrum of K2[(Pt2(HPO44(H2O2] containing (Pt26+ ions
Directory of Open Access Journals (Sweden)
2009-03-01
Full Text Available In the crystal structure of the acid platinum phosphate dipotassium di-μ-hydrogenphosphato-bis[aquaplatinum(III](Pt—Pt, K2[Pt2(HPO44(H2O2], the (Pt26+ dumbbells within the paddle-wheel complex show Pt—Pt distances of 2.4944 (5 and 2.4892 (5 Å. The pottassium ions are seven-fold coordinated by hydrogenphosphate groups. In the crystal, O—H...O hydrogen bonds help to establish the packing. The Raman spectrum was recorded.
Phonons with orbital angular momentum
International Nuclear Information System (INIS)
Ayub, M. K.; Ali, S.; Mendonca, J. T.
2011-01-01
Ion accoustic waves or phonon modes are studied with orbital angular momentum (OAM) in an unmagnetized collissionless uniform plasma, whose constituents are the Boltzmann electrons and inertial ions. For this purpose, we have employed the fluid equations to obtain a paraxial equation in terms of ion density perturbations and discussed its Gaussian beam and Laguerre-Gauss (LG) beam solutions. Furthermore, an approximate solution for the electrostatic potential problem is presented, allowing to express the components of the electric field in terms of LG potential perturbations. The energy flux due to phonons is also calculated and the corresponding OAM is derived. Numerically, it is shown that the parameters such as azimuthal angle, radial and angular mode numbers, and beam waist, strongly modify the profiles of the phonon LG potential. The present results should be helpful in understanding the phonon mode excitations produced by Brillouin backscattering of laser beams in a uniform plasma.
Study of the low-frequency Raman scattering in NaNbO{sub 3} crystal
Energy Technology Data Exchange (ETDEWEB)
Bouziane, E [Laboratoire Materiaux Optiques, Photonique et Systemes, FRE CNRS 2304, Universite de Metz et Supelec, 2 Rue E Belin, 57070 Metz Cedex (France); Fontana, M D [Laboratoire Materiaux Optiques, Photonique et Systemes, FRE CNRS 2304, Universite de Metz et Supelec, 2 Rue E Belin, 57070 Metz Cedex (France); Ayadi, M [Laboratoire de Physique des Materiaux et d' Electronique, Faculte des Sciences I, Ain Chock, Universite Hassan II, Casablanca (Morocco)
2003-03-12
The Raman scattering spectrum of the sodium niobate crystal, in both P and R phases, has been investigated from room temperature up to 440{sup d}eg C. The dependence of the low-frequency (LF) spectrum clearly reveals, for the first time, over a wide temperature range, the presence of a strong quasi-elastic scattering below a LF zone centre phonon. The phase transition mechanism is discussed, considering an order-disorder process induced by the relaxation of the Nb ions.
Isotopic phonon effects in β-rhombohedral boron--non-statistical isotope distribution.
Werheit, H; Filipov, V; Kuhlmann, U; Schwarz, U; Armbrüster, M; Antadze, M
2012-05-02
On the basis of the spectra of IR- and Raman-active phonons, the isotopic phonon effects in β-rhombohedral boron are analysed for polycrystalline (10)B- and (11)B-enriched samples of different origin and high-purity (nat)B single crystals. Intra- and inter-icosahedral B-B vibrations are harmonic, hence meeting the virtual crystal approximation (VCA) requirements. Deviations from the phonon shift expected according to the VCA are attributed to the anharmonic share of the lattice vibrations. In the case of icosahedral vibrations, the agreement with calculations on α-rhombohedral boron by Shirai and Katayama-Yoshida is quite satisfactory. Phonon shifts due to isotopic disorder in (nat)B are separated and determined. Some phonon frequencies are sensitive to impurities. The isotopic phonon effects yield valuable specific information on the nature of the different phonon modes. The occupation of regular boron sites by isotopes deviates significantly from the random distribution. © 2012 IOP Publishing Ltd
Theoretical study of the transverse acoustic phonons of GaSb at ...
Indian Academy of Sciences (India)
Gallium antimonide (GaSb), like many III–V semiconductor compounds crystallizes in the cubic zinc-blende crystal ... and a structural phase transition to a high coordination phase appears. For GaSb the phase ... the changes in different phonon modes due to the change in the interatomic forces after the applications of ...
Sato, Akihiro; Pennec, Yan; Shingne, Nitin; Thurn-Albrecht, Thomas; Knoll, Wolfgang; Steinhart, Martin; Djafari-Rouhani, Bahram; Fytas, George
2010-06-22
Anodic aluminum oxide (AAO) containing arrays of aligned cylindrical nanopores infiltrated with polymers is a well-defined model system for the study of hypersound propagation in polymer nanocomposites. Hypersonic phononic properties of AAO/polymer nanocomposites such as phonon localization and anisotropic sound propagation can be tailored by adjusting elastic contrast and density contrast between the components. Changes in density and elastic properties of the component located in the nanopores induced by phase transitions allow reversible modification of the phononic band structure and mode switching. As example in case, the crystallization and melting of poly(vinylidene difluoride) inside AAO was investigated.
Evidence of a Love wave bandgap in a quartz substrate coated with a phononic thin layer
International Nuclear Information System (INIS)
Liu, Ting-Wei; Wu, Tsung-Tsong; Lin, Yu-Ching; Tsai, Yao-Chuan; Ono, Takahito; Tanaka, Shuji
2014-01-01
This paper presents a numerical and experimental study of Love wave propagation in a micro-fabricated phononic crystal (PC) structure consisting of a 2D, periodically etched silica film deposited on a quartz substrate. The dispersion characteristics of Love waves in such a phononic structure were analyzed with various geometric parameters by using complex band structure calculations. For the experiment, we adopted reactive-ion etching with electron-beam lithography to fabricate a submicrometer phononic structure. The measured results exhibited consistency with the numerical prediction. The results of this study may serve as a basis for developing PC-based Love wave devices
Optical phonon features of triclinic montebrasite : dispersion analysis and non-polar Raman modes.
Almeida, Rafael M.; Höfer, Sonja; Mayerhöfer, Thomas G.; Popp, Jürgen; Krambrock, Klaus; Lobo, Ricardo P. S. M.; Dias, Anderson; Moreira, Roberto Luiz
2015-01-01
Polarized infrared and Raman spectra of triclinic LiAl(PO4)(OH) [montebrasite] single crystal were recorded for appropriate optical configurations. Dispersion analysis was applied on the infrared reflectivity spectra taken at low incidence angle (11 ) to determine the oscillator parameters and the dipole directions of the polar phonons. In particular, all the 27 polar phonons, predicted by group theory for triclinic P1 structure,were determined. The obtained dielectric tensor para...
Soft and Isotropic Phonons in PrFeAsO_{1-y}
Fukuda, T.; Baron, A. Q. R.; Nakamura, H.; Shamoto, S.; Ishikado, M.; Machida, M.; Uchiyama, H.; Iyo, A.; Kito, H.; Mizuki, J.; Arai, M.; Eisaki, H.
2011-01-01
Phonons in single crystals of PrFeAsO_{1-y} are investigated using high-resolution inelastic x-ray scattering and ab initio pseudopotential calculations. Extensive measurements of several samples at temperatures spanning the magnetic ordering temperature and the superconducting transition temperature show that there are some changes in phonon spectra with temperature and/or doping. We compare our measurements with several ab initio pseudopotential models (nonmagnetic tetragonal, oxygen-defici...
A Numerical Analysis of Phononic-Assisted Control of Ultrasound Waves in Acoustofluidic Device
DEFF Research Database (Denmark)
Moiseyenko, Rayisa; Bruus, Henrik
2015-01-01
and streaming has received much attention, since it relies solely on mechanical properties such as particle size and contrast in density and compressibility. We present a theoretical study of phononic-assisted control of ultrasound waves in acoustofluidic devices. We propose the use of phononic crystal...... can be made configurable, by embedding the diffractors, all working at the same excitation frequency but with different resulting diffraction patterns, in exchangeable membranes on top of the device....
Features of electron-phonon interactions in nanotubes with chiral symmetry in magnetic field
Kibis, O V
2001-01-01
Interaction of the electrons with acoustic phonons in the nanotube with chiral symmetry by availability of the magnetic field, parallel to the nanotube axis, is considered. It is shown that the electron energy spectrum is asymmetric relative to the electron wave vector inversion and for that reason the electron-phonon interaction appears to be different for similar phonons with mutually contrary directions of the wave vector. This phenomenon leads to origination of the electromotive force by the spatially uniform electron gas heating and to appearance of the quadrupole component in the nanotube volt-ampere characteristics
Observation of a phononic quadrupole topological insulator
Serra-Garcia, Marc; Peri, Valerio; Süsstrunk, Roman; Bilal, Osama R.; Larsen, Tom; Villanueva, Luis Guillermo; Huber, Sebastian D.
2018-03-01
The modern theory of charge polarization in solids is based on a generalization of Berry’s phase. The possibility of the quantization of this phase arising from parallel transport in momentum space is essential to our understanding of systems with topological band structures. Although based on the concept of charge polarization, this same theory can also be used to characterize the Bloch bands of neutral bosonic systems such as photonic or phononic crystals. The theory of this quantized polarization has recently been extended from the dipole moment to higher multipole moments. In particular, a two-dimensional quantized quadrupole insulator is predicted to have gapped yet topological one-dimensional edge modes, which stabilize zero-dimensional in-gap corner states. However, such a state of matter has not previously been observed experimentally. Here we report measurements of a phononic quadrupole topological insulator. We experimentally characterize the bulk, edge and corner physics of a mechanical metamaterial (a material with tailored mechanical properties) and find the predicted gapped edge and in-gap corner states. We corroborate our findings by comparing the mechanical properties of a topologically non-trivial system to samples in other phases that are predicted by the quadrupole theory. These topological corner states are an important stepping stone to the experimental realization of topologically protected wave guides in higher dimensions, and thereby open up a new path for the design of metamaterials.
International Nuclear Information System (INIS)
Lee, J. H.; Sohn, S. G.; Jung, H. I.; An, Y. J.; Lee, S. H.
2013-01-01
OXA-17, an extended-spectrum β-lactamase (ESBL) conferring severe antibiotic resistance, hydrolytically inactivates β-lactam antibiotics, inducing a lack of eradication of pathogenic bacteria by oxyimino β-lactams and not helping hospital infection control. Thus, the enzyme is a potential target for developing antimicrobial agents against pathogens producing ESBLs. OXA-17 was purified and crystallized at 298 K. X-ray diffraction data from OXA-17 crystal have been collected to 1.85 Å resolution using synchrotron radiation. The crystal of OXA-17 belongs to space group P2 1 2 1 2 1 , with unit-cell parameters a = 48.37, b = 101.12, and c = 126.07 Å. Analysis of the packing density shows that the asymmetric unit probably contains two molecules with a solvent content of 54.6%
Energy Technology Data Exchange (ETDEWEB)
Lee, J. H., E-mail: msgjhlee@mju.ac.kr; Sohn, S. G., E-mail: sgsohn@mju.ac.kr; Jung, H. I., E-mail: jhinumber1@hanmail.net; An, Y. J., E-mail: anyj0120@hanmail.net; Lee, S. H., E-mail: sangheelee@mju.ac.kr [Myongji University, Drug Resistance Proteomics Laboratory, Department of Biological Sciences (Korea, Republic of)
2013-07-15
OXA-17, an extended-spectrum {beta}-lactamase (ESBL) conferring severe antibiotic resistance, hydrolytically inactivates {beta}-lactam antibiotics, inducing a lack of eradication of pathogenic bacteria by oxyimino {beta}-lactams and not helping hospital infection control. Thus, the enzyme is a potential target for developing antimicrobial agents against pathogens producing ESBLs. OXA-17 was purified and crystallized at 298 K. X-ray diffraction data from OXA-17 crystal have been collected to 1.85 A resolution using synchrotron radiation. The crystal of OXA-17 belongs to space group P2{sub 1}2{sub 1}2{sub 1}, with unit-cell parameters a = 48.37, b = 101.12, and c = 126.07 A. Analysis of the packing density shows that the asymmetric unit probably contains two molecules with a solvent content of 54.6%.
The vibrational spectrum of alpha-AlOOH diaspore: an ab initio study with the CRYSTAL code.
Demichelis, R; Noel, Y; Civalleri, B; Roetti, C; Ferrero, M; Dovesi, R
2007-08-09
The vibrational spectrum of alpha-AlOOH diaspore has been calculated at the B3LYP level of theory with a double-zeta quality Gaussian-type basis set by using the periodic ab initio CRYSTAL code. Harmonic frequencies at the Gamma point and the corresponding 48 normal modes are analyzed and classified in terms of simple models (octahedra modes, hydrogen stretching, bending, rotations) by direct inspection of eigenvectors, graphical representation, and isotopic substitution. Hydrogen modes are fully separated from the octahedra modes appearing under 800 cm(-1); bending modes are located in the range of 1040-1290 cm(-1), whereas stretching modes appear at 3130-3170 cm(-1). The available experimental IR and Raman spectra are characterized by broad bands, in some cases as large as 800 cm(-1), and individual peaks are obtained by decomposing these bands in terms of Lorentz-Gauss product functions; such a fitting procedure is affected by a relatively large degree of arbitrariness. The comparison of our calculated data with the most complete sets of experimental data shows, nevertheless, a relatively good agreement for all but the H modes; the mean absolute differences for modes not involving H are 10.9 and 7.2 cm(-1) for the IR and the Raman spectra, respectively, the maximum differences being 15.5 and 18.2 cm(-1). For the H bending modes, differences increase to 30 and 37 cm(-1), and for the stretching modes, the calculated frequencies are about 200 cm(-1) higher than the experimental ones; this is not surprising, as anharmonicity is expected to red shift the OH stretching by about 150 cm(-1) in isolated OH groups and even more when the latter is involved in strong hydrogen bonds, as is the case here.
Three-dimensional phonon population anisotropy in silicon nanomembranes
Energy Technology Data Exchange (ETDEWEB)
McElhinny, Kyle M.; Gopalakrishnan, Gokul; Holt, Martin V.; Czaplewski, David A.; Evans, Paul G.
2017-07-01
Nanoscale single crystals possess modified phonon dispersions due to the truncation of the crystal. The introduction of surfaces alters the population of phonons relative to the bulk and introduces anisotropy arising from the breaking of translational symmetry. Such modifications exist throughout the Brillouin zone, even in structures with dimensions of several nanometers, posing a challenge to the characterization of vibrational properties and leading to uncertainty in predicting the thermal, optical, and electronic properties of nanomaterials. Synchrotron x-ray thermal diffuse scattering studies find that freestanding Si nanomembranes with thicknesses as large as 21 nm exhibit a higher scattering intensity per unit thickness than bulk silicon. In addition, the anisotropy arising from the finite thickness of these membranes produces particularly intense scattering along reciprocal-space directions normal to the membrane surface compared to corresponding in-plane directions. These results reveal the dimensions at which calculations of materials properties and device characteristics based on bulk phonon dispersions require consideration of the nanoscale size of the crystal.
First principles phonon calculations in materials science
Togo, Atsushi; Tanaka, Isao
2015-01-01
Phonon plays essential roles in dynamical behaviors and thermal properties, which are central topics in fundamental issues of materials science. The importance of first principles phonon calculations cannot be overly emphasized. Phonopy is an open source code for such calculations launched by the present authors, which has been world-widely used. Here we demonstrate phonon properties with fundamental equations and show examples how the phonon calculations are applied in materials science.
Microwave dielectric tangent losses in KDP and DKDP crystals
Indian Academy of Sciences (India)
properties of KDP-type crystals. In the present work, we shall consider the third- and fourth-order phonon anharmonic interaction terms [12,13] into pseudospin lattice coupled mode (PLCM) model of KH2PO4 crystal. The phonon anharmonic interactions are found to be very important in explaining dielectric, thermal and ...
Directory of Open Access Journals (Sweden)
J. Flores Méndez
Full Text Available In this paper, we shall propose an elastic metamaterial based on a specific rubber/aluminum superlattice. We will calculate the frequency-dependent effective mass density and transverse elastic constant in the Local and Nonlocal homogenization regimes. Using the effective dynamic parameters, the phononic dispersion calculations of the homogenized elastic crystal show a second pass band for transverse modes where the superlattice behaves as a double-negative elastic metamaterial having simultaneously negative effective mass density and shear modulus. Which is very useful for designing resonant elastic metamaterials. Keywords: Metamaterial, Phononic crystal, Homogenization theory, Effective parameters, Dispersion relation
Ab initio phonon point defect scattering and thermal transport in graphene
Polanco, Carlos A.; Lindsay, Lucas
2018-01-01
We study the scattering of phonons from point defects and their effect on lattice thermal conductivity κ using a parameter-free ab initio Green's function methodology. Specifically, we focus on the scattering of phonons by boron (B), nitrogen (N), and phosphorus substitutions as well as single- and double-carbon vacancies in graphene. We show that changes of the atomic structure and harmonic interatomic force constants locally near defects govern the strength and frequency trends of the scattering of out-of-plane acoustic (ZA) phonons, the dominant heat carriers in graphene. ZA scattering rates due to N substitutions are nearly an order of magnitude smaller than those for B defects despite having similar mass perturbations. Furthermore, ZA phonon scattering rates from N defects decrease with increasing frequency in the lower-frequency spectrum in stark contrast to expected trends from simple models. ZA phonon-vacancy scattering rates are found to have a significantly softer frequency dependence (˜ω0 ) in graphene than typically employed in phenomenological models. The rigorous Green's function calculations demonstrate that typical mass-defect models do not adequately describe ZA phonon-defect scattering rates. Our ab initio calculations capture well the trend of κ vs vacancy density from experiments, though not the magnitudes. This work elucidates important insights into phonon-defect scattering and thermal transport in graphene, and demonstrates the applicability of first-principles methods toward describing these properties in imperfect materials.
Phonons in Solid Hydrogen and Deuterium Studied by Inelastic Coherent Neutron Scattering
DEFF Research Database (Denmark)
Nielsen, Mourits
1973-01-01
Phonon dispersion relations have been measured by coherent neutron scattering in solid para-hydrogen and ortho-deuterium. The phonon energies are found to be nearly equal in the two solids, the highest energy in each case lying close to 10 meV. The pressure and temperature dependence of the phonon...... energies have been measured in ortho-deuterium and the lattice change determined by neutron diffraction. When a pressure of 275 bar is applied, the phonon energies are increased by about 10%, and heating the crystal to near the melting point decreases them by about 7%. The densities of states, the specific...... heats, and the Debye temperatures have been deduced and found to be in agreement with the published experimental results. The Debye temperatures are 118 K for hydrogen and 114 K for deuterium. For hydrogen the Debye-Waller factor has been measured by incoherent neutron scattering and it corresponds...
Microscopic modeling of the effect of phonons on the optical properties of solid-state emitters
Norambuena, Ariel; Reyes, Sebastián A.; Mejía-Lopéz, José; Gali, Adam; Maze, Jerónimo R.
2016-10-01
Understanding the effect of vibrations in optically active nanosystems is crucial for successfully implementing applications in molecular-based electro-optical devices, quantum information communications, single photon sources, and fluorescent markers for biological measurements. Here, we present a first-principles microscopic description of the role of phonons on the isotopic shift presented in the optical emission spectrum associated to the negatively charged silicon-vacancy color center in diamond. We use the spin-boson model and estimate the electron-phonon interactions using a symmetrized molecular description of the electronic states and a force-constant model to describe molecular vibrations. Group theoretical arguments and dynamical symmetry breaking are presented in order to explain the optical properties of the zero-phonon line and the isotopic shift of the phonon sideband.
Heat flux induced blueshift of dominant phonon wavelength and its impact on thermal conductivity
Directory of Open Access Journals (Sweden)
Aymeric Ramiere
2017-01-01
Full Text Available The concept of dominant phonon wavelength is investigated in systems submitted to a heat flux at low temperatures. Using spectral energy distributions, a treatment of two-dimensional and three-dimensional structures is conducted in parallel. We demonstrate a significant reduction of the dominant phonon wavelength, up to 62%, due to a displacement of the phonon spectrum towards higher frequencies in presence of a heat flux. We name this phenomenon blueshift effect. A formula is provided to directly calculate the corrected dominant phonon wavelength. We illustrate the impact of the blueshift effect by showing that a temperature gradient of 10% at 4K yields a 20% reduction in the thermal conductivity. Therefore, ignoring the blueshift effect in a thermal model can notably alter the physical interpretation of measurements. The results suggest that an appropriate heat flux environment can improve thermoelectric device performances.
Steele, A
2000-01-01
this thesis data from phonon experiments are used to directly determine values for the parameters of an STJ such as the quasiparticle loss and tunnel rates in its electrodes. It is also shown how the input energy, in the form of phonons capable of breaking Cooper pairs, and the corresponding charge output from the device can be determined. These values are then compared with those obtained from x-ray absorption data. This thesis is concerned with the use of nanosecond phonon pulses to study quasiparticle behaviour in the electrodes of high-quality niobium superconducting tunnel junctions (STJs). This work is part of a collaboration with the Astrophysics Research and Development Division of the European Space Agency (ESA) at ESTEC. STJs are being widely investigated as photon detectors over a broad range of the electromagnetic spectrum. They potentially offer excellent energy resolution, time response and photon counting capabilities. The primary aim of this research was to use phonon pulses to investigate qua...
Light-induced nonthermal population of optical phonons in nanocrystals
Falcão, Bruno P.; Leitão, Joaquim P.; Correia, Maria R.; Soares, Maria R.; Wiggers, Hartmut; Cantarero, Andrés; Pereira, Rui N.
2017-03-01
Raman spectroscopy is widely used to study bulk and nanomaterials, where information is frequently obtained from spectral line positions and intensities. In this study, we monitored the Raman spectrum of ensembles of semiconductor nanocrystals (NCs) as a function of optical excitation intensity (optical excitation experiments). We observe that in NCs the red-shift of the Raman peak position with increasing light power density is much steeper than that recorded for the corresponding bulk material. The increase in optical excitation intensity results also in an increasingly higher temperature of the NCs as obtained with Raman thermometry through the commonly used Stokes/anti-Stokes intensity ratio. More significantly, the obtained dependence of the Raman peak position on temperature in optical excitation experiments is markedly different from that observed when the same NCs are excited only thermally (thermal excitation experiments). This difference is not observed for the control bulk material. The inefficient diffusion of photogenerated charges in nanoparticulate systems, due to their inherently low electrical conductivity, results in a higher steady-state density of photoexcited charges and, consequently, also in a stronger excitation of optical phonons that cannot decay quickly enough into acoustic phonons. This results in a nonthermal population of optical phonons and thus the Raman spectrum deviates from that expected for the temperature of the system. Our study has major consequences to the general application of Raman spectroscopy to nanomaterials.
Simple model for phonon dispersion of nonstoichiometric transition metal carbides
International Nuclear Information System (INIS)
Splettstoesser, B.
1977-09-01
The simple shell model for the acoustic dispersion curves of ideal and nonstoichiometric Niobium Carbide is presented. The main emphasis is put on a qualitative understanding of the rather sharp dips, observed in some of the branches, and, in particular, their extreme sensitivity to C-vacancies. For comparison the 'normal' acoustic dispersion curves of TiC - which can be described with the same model - and their weak stoichiometry dependence are investigated. For both materials the one phonon cross section of the defect crystal is calculated in various approximations. The obtained phonon shifts and broadenings are small for TiC, but large for NbC in the dip regions - in good agreement with experimental results. Both, the dip structure observed for TaC and the 'normal' acoustic dispersion curves of HfC, ZrC can be described with our model as well. (orig.) [de
International Nuclear Information System (INIS)
Lim, Ae Ran
2007-01-01
Me 3 H(SeO 4 ) 2 (Me = Na, K, and Rb) single crystals were grown by the slow evaporation method, and the relaxation times of the 1 H and Me nuclei in these crystals were investigated using FT NMR spectrometry. The 1 H T 1 NMR results for K 3 H(SeO 4 ) 2 and Rb 3 H(SeO 4 ) 2 single crystals were very different from those for Na 3 H(SeO 4 ) 2 crystals. Short 1 H relaxation times were found for K 3 H(SeO 4 ) 2 and Rb 3 H(SeO 4 ) 2 at high temperatures, but not for Na 3 H(SeO 4 ) 2 , which are attributed to the destruction and reconstruction of hydrogen bonds; thus K 3 H(SeO 4 ) 2 and Rb 3 H(SeO 4 ) 2 have superionic phases, whereas Na 3 H(SeO 4 ) 2 does not. The temperature dependence of the relaxation rate for the 23 Na nucleus in Na 3 H(SeO 4 ) 2 crystals was in accord with a Raman process for nuclear spin-lattice relaxation (T 1 -1 ∝T 2 . In contrast, the spin-lattice relaxation rates for the 39 K and 87 Rb nuclei in K 3 H(SeO 4 ) 2 and Rb 3 H(SeO 4 ) 2 single crystals exhibited a very strong temperature dependence, T 1 -1 ∝T 7 . The motions giving rise to this strong temperature dependence may be related to the high electrical conductivities of these crystals at high temperatures
Lee, Jun Hee; Rabe, Karin M.
2011-09-01
First-principles calculations reveal large zone-center spin-phonon coupling and magnetically-driven phonon anisotropy in cubic perovskites SrMO3 (M=V,Cr,Mn,Fe,Co). In particular, the frequency and splitting of the polar Slater mode is found to depend strongly upon magnetic ordering. The coupling is parameterized in a crystal-structure-dependent Heisenberg model, and its main features seen to arise from the Goodenough-Kanamori rules. This coupling can be expected to produce distinct low-energy alternative phases, resulting in a rich variety of coupled magnetic, structural, and electronic phase transitions driven by temperature, stress, electric field, and cation substitution.
Ozaki, Ryotaro; Nishi, Koji; Kan, Takayuki; Kadowaki, Kazunori
2016-10-01
An improved interference method is proposed to determine ordinary and extraordinary refractive index dispersions of nematic liquid crystals (LCs). In this method, an LC cell coated with a thin metal layer is used as a Fabry-Perot interferometer, which shows us a sharp transmission fringe. To ensure high reliability, the wavelength dispersion of the refractive index of the metal is taken into account in fitting calculation. In spite of measuring ordinary and extraordinary components, the LC cell, polarizers, and other equipment are not rotated during the experiment. The index evaluation from a single spectrum avoids errors depending on the measurement position owing to non-uniformities of molecular orientation and cell thickness because we can obtain the two indices at exactly the same position. This system can adapt to a wide frequency range and does not require any specific wavelength light source or laser. We demonstrate the determination of ordinary and extraordinary refractive index dispersions of a nematic liquid crystal in the visible and near-infrared regions. Furthermore, we quantitatively reproduce the measured spectrum by calculation using the measured refractive indices.
Phonon dispersion in the ferromagnetic shape memory alloy Ni2MnGa studied by neutron spectroscopy
International Nuclear Information System (INIS)
Vorderwisch, P.; Shapiro, S.M.
2006-01-01
Neutron spectroscopy is an ideal technique to study the structure and dynamics of crystals. For the ferromagnetic shape memory alloy Ni 2 MnGa, all previously obtained information from inelastic neutron scattering experiments is restricted to the phonon dispersion in the austenitic (fcc) phase of alloys with different compositions. For the (tetragonally distorted) martensitic phase recent inelastic neutron scattering data are presented. These new data were taken on a single crystal with stoichiometric composition. A single-variant martensitic phase of the sample has been obtained by the application of magnetic fields in horizontal or vertical direction with respect to the scattering plane used in the experiments. The measured phonon-dispersion curves are compared with recently published ab initio (zero-temperature) phonon-dispersion calculations. The anomalous phonon behavior observed in both, the austenitic and martensitic phase is discussed
International Nuclear Information System (INIS)
Sharma, Amita; Rathore, R.P.S.
1992-01-01
Born-Mayer potential has been modified to account for the unpaired (three body) forces among the common nearest neighbours of the ordered binary fcc alloys i.e. Ni 3 Fe 7 , Ni 5 Fe 5 and Ni 75 Fe 25 . The three body potential is added to the two body form of Morse to formalize the total interaction potential. Measured inverse ionic compressibility, cohesive energy, lattice constant and one measured phonon frequency are used to evaluate the defining parameters of the potential. The potential seeks to bring about the binding among 140 and 132 atoms though pair wise (two body) and non-pair wise (three body) forces respectively. The phonon-dispersion relations obtained by solving the secular equation are compared with the experimental findings on the aforesaid alloys. (author). 19 refs., 3 figs
The broad Brillouin doublet and CP of KTaO3, second sound vs. Two-phonon difference scattering
International Nuclear Information System (INIS)
Farhi, E.; Tagantsev, A.K.; Hehlen, B.; Courtens, E.; Boatner, L.A.
1999-01-01
Complete text of publication follows. Low-T Brillouin spectra of the incipient ferroelectric KTaO 3 exhibit a broad central peak (CP) (1), and some additional broad Brillouin doublet (BD) (2), that can both relate to phonon-density fluctuations (3). Starting from extensive new high resolution neutron scattering measurements in pure crystals, low lying phonon sheets were modelled in the central part of Brillouin zone. Such a parameterisation was then used in order to analyse those up-mentioned unusual features in teens of two-phonon mechanisms (4). Numerical evaluations show that transverse acoustic (TA) phonons whose normal damping is faster than the BD frequency (Γ DB > ω DB ) may produce hydrodynamic second sound (propagation of heat). Moreover, two-phonon difference scattering from low damping thermal TA phonons ((Γ DB DB ) can contribute to the spectra with either a sharp or a broader BD, depending on the phonon group velocity and phonon-sheet anisotropy. The position of the doublet is consistent with both mechanisms, but comparing the computed anisotropies with experimental Brillouin and neutron scattering data, one favours the second process. (author)
Spin-phonon coupling in Gd(Co1/2Mn1/2)O3 perovskite
International Nuclear Information System (INIS)
Silva, R. X.; Reichlova, H.; Marti, X.; Barbosa, D. A. B.; Lufaso, M. W.; Araujo, B. S.; Ayala, A. P.
2013-01-01
We have investigated the temperature-dependent Raman-active phonons and the magnetic properties of Gd(Co 1/2 Mn 1/2 )O 3 perovskite ceramics in the temperature range from 40 K to 300 K. The samples crystallized in an orthorhombic distorted simple perovskite, whose symmetry belongs to the Pnma space group. The data reveal spin-phonon coupling near the ferromagnetic transition occurring at around 120 K. The correlation of the Raman and magnetization data suggests that the structural order influences the magnitude of the spin-phonon coupling
Phonon lineshapes in atom-surface scattering
Energy Technology Data Exchange (ETDEWEB)
MartInez-Casado, R [Department of Chemistry, Imperial College London, South Kensington, London SW7 2AZ (United Kingdom); Sanz, A S; Miret-Artes, S [Instituto de Fisica Fundamental, Consejo Superior de Investigaciones CientIficas, Serrano 123, E-28006 Madrid (Spain)
2010-08-04
Phonon lineshapes in atom-surface scattering are obtained from a simple stochastic model based on the so-called Caldeira-Leggett Hamiltonian. In this single-bath model, the excited phonon resulting from a creation or annihilation event is coupled to a thermal bath consisting of an infinite number of harmonic oscillators, namely the bath phonons. The diagonalization of the corresponding Hamiltonian leads to a renormalization of the phonon frequencies in terms of the phonon friction or damping coefficient. Moreover, when there are adsorbates on the surface, this single-bath model can be extended to a two-bath model accounting for the effect induced by the adsorbates on the phonon lineshapes as well as their corresponding lineshapes.
Coherent Phonon Rabi Oscillations with a High-Frequency Carbon Nanotube Phonon Cavity.
Zhu, Dong; Wang, Xin-He; Kong, Wei-Cheng; Deng, Guang-Wei; Wang, Jiang-Tao; Li, Hai-Ou; Cao, Gang; Xiao, Ming; Jiang, Kai-Li; Dai, Xing-Can; Guo, Guang-Can; Nori, Franco; Guo, Guo-Ping
2017-02-08
Phonon-cavity electromechanics allows the manipulation of mechanical oscillations similar to photon-cavity systems. Many advances on this subject have been achieved in various materials. In addition, the coherent phonon transfer (phonon Rabi oscillations) between the phonon cavity mode and another oscillation mode has attracted many interest in nanoscience. Here, we demonstrate coherent phonon transfer in a carbon nanotube phonon-cavity system with two mechanical modes exhibiting strong dynamical coupling. The gate-tunable phonon oscillation modes are manipulated and detected by extending the red-detuned pump idea of photonic cavity electromechanics. The first- and second-order coherent phonon transfers are observed with Rabi frequencies 591 and 125 kHz, respectively. The frequency quality factor product fQ m ∼ 2 × 10 12 Hz achieved here is larger than k B T base /h, which may enable the future realization of Rabi oscillations in the quantum regime.
Radiation- and phonon-bottleneck--induced tunneling in the Fe8 single-molecule magnet
Bal, M.; Friedman, Jonathan R.; Chen, W.; Tuominen, M. T.; Beedle, C. C.; Rumberger, E. M.; Hendrickson, D. N.
2008-04-01
We measure magnetization changes in a single crystal of the single-molecule magnet Fe8 when exposed to intense, short (spin dynamics, allowing observation of thermally assisted resonant tunneling between spin states at the 100 ns time scale. Detailed numerical simulations quantitatively reproduce the data and yield a spin-phonon relaxation time T1~40 ns.
Crystal-field excitations in the visible spectrum of Nd.sub.2./sub.CuO.sub.4./sub..
Czech Academy of Sciences Publication Activity Database
Richard, P.; Jandl, S.; Hölsä, J.; Nekvasil, Vladimír
2004-01-01
Roč. 374, - (2004), s. 14-17 ISSN 0925-8388 R&D Projects: GA ČR GA202/03/0552 Institutional research plan: CEZ:AV0Z1010914 Keywords : crystal-field excitation * optical absorption * cuprate superconductors Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 1.562, year: 2004
On the possibility of laser cooling of Cr3+ ions doped crystals
Feofilov, S. P.; Kulinkin, A. B.
2018-01-01
The fluorescence of Cr3+ ions doped insulating crystals was studied under the excitation in the long-wavelength tail of the absorption spectrum ("laser cooling regime"). The 4T2 - 4A2 and 2E - 4A2 fluorescence spectra with a dominant anti-Stokes component were observed. Though no optical refrigeration was detected in the presented experiments, the spectroscopic results suggest that electron-phonon bands of Cr3+ ions are of interest for further investigations from the point of view of achieving optical refrigeration.
Temperature dependence of phonons in pyrolitic graphite
International Nuclear Information System (INIS)
Brockhouse, B.N.; Shirane, G.
1977-01-01
Dispersion curves for longitudinal and transverse phonons propagating along and near the c-axis in pyrolitic graphite at temperatures between 4 0 K and 1500 0 C have been measured by neutron spectroscopy. The observed frequencies decrease markedly with increasing temperature (except for the transverse optical ''rippling'' modes in the hexagonal planes). The neutron groups show interesting asymmetrical broadening ascribed to interference between one phonon and many phonon processes
Tunable infrared reflectance by phonon modulation
Energy Technology Data Exchange (ETDEWEB)
Ihlefeld, Jon F.; Sinclair, Michael B.; Beechem, III, Thomas E.
2018-03-06
The present invention pertains to the use of mobile coherent interfaces in a ferroelectric material to interact with optical phonons and, ultimately, to affect the material's optical properties. In altering the optical phonon properties, the optical properties of the ferroelectric material in the spectral range near-to the phonon mode frequency can dramatically change. This can result in a facile means to change to the optical response of the ferroelectric material in the infrared.
Tunable infrared reflectance by phonon modulation
Ihlefeld, Jon F.; Sinclair, Michael B.; Beechem, III, Thomas E.
2018-03-06
The present invention pertains to the use of mobile coherent interfaces in a ferroelectric material to interact with optical phonons and, ultimately, to affect the material's optical properties. In altering the optical phonon properties, the optical properties of the ferroelectric material in the spectral range near-to the phonon mode frequency can dramatically change. This can result in a facile means to change to the optical response of the ferroelectric material in the infrared.
Carbon nanowires: Phonon and π -electron confinement
Milani, Alberto; Tommasini, Matteo; Del Zoppo, Mirella; Castiglioni, Chiara; Zerbi, Giuseppe
2006-10-01
The phonon dispersion of an isolated linear chain of carbon atoms is studied by density functional theory. It is shown that the longitudinal optical phonon at the Γ point is affected by Kohn anomaly. Moreover the slope of this phonon branch is modulated by the degree of bond length alternation of the chain and reaches its maximum value in the case of the cumulenic structure (equalized bonds). Phonon dispersion curves of the infinite system computed for different values of the bond length alternation can be put in correspondence with the Raman active modes of finite carbon chains.
Electron-phonon interactions from first principles
Giustino, Feliciano
2017-01-01
This article reviews the theory of electron-phonon interactions in solids from the point of view of ab initio calculations. While the electron-phonon interaction has been studied for almost a century, predictive nonempirical calculations have become feasible only during the past two decades. Today it is possible to calculate from first principles many materials properties related to the electron-phonon interaction, including the critical temperature of conventional superconductors, the carrier mobility in semiconductors, the temperature dependence of optical spectra in direct and indirect-gap semiconductors, the relaxation rates of photoexcited carriers, the electron mass renormalization in angle-resolved photoelectron spectra, and the nonadiabatic corrections to phonon dispersion relations. In this article a review of the theoretical and computational framework underlying modern electron-phonon calculations from first principles as well as landmark investigations of the electron-phonon interaction in real materials is given. The first part of the article summarizes the elementary theory of electron-phonon interactions and their calculations based on density-functional theory. The second part discusses a general field-theoretic formulation of the electron-phonon problem and establishes the connection with practical first-principles calculations. The third part reviews a number of recent investigations of electron-phonon interactions in the areas of vibrational spectroscopy, photoelectron spectroscopy, optical spectroscopy, transport, and superconductivity.
Realization of phonon laser with femtosecond technology
Sun, Chi-Kuang; Huang, Yue-Kai; Chern, Gia-Wei
2002-06-01
One of the most desirable properties of phonon system is sound amplification by stimulated emission of phonon radiation, coined as SASER or called phonon laser or acoustic laser, which is the acoustic counterpart of LASER. Phonon stimulated emission, or sound amplification, has been previously observed fro several occasions in extremely low temperatures, however a lasing behavior of the phonon oscillators has never been established. It is also desirable to build a phonon laser operating at room temperature. Here we present an optically pumped nano-sized phonon laser with an output acoustic wavelength of 9.3 nm, operating at room temperature. The nano phonon laser is composed by InGaN/GaN multiple-quantum-wells (MQWs). By using femtosecond ultraviolet pulses as pumping sources, coherent acoustic phonon amplification with large acoustic gain was observed. When the induced acoustic gain is higher than the acoustic loss due to its traveling nature, a clear laser-like threshold behavior was observed, which resembles a pulsed optical laser. This demonstration will open a new way toward nano-ultrasonics.
Influence of the electron-phonon iinteraction on phonon heat conduction in a molecular nanowire
Directory of Open Access Journals (Sweden)
Galović Slobodanka P.
2006-01-01
Full Text Available A model for phonon heat conduction in a molecular nanowire is developed. The calculation takes into account modification of the acoustic phonon dispersion relation due to the electron-phonon interaction. The results obtained are compared with models based upon a simpler, Callaway formula.
Electron hopping and optic phonons in Eu3S4
International Nuclear Information System (INIS)
Guentherodt, G.
1981-01-01
Raman scattering on single crystals of Eu 3 S 4 does not show the allowed q=o phonon modes in the cubic phase and exhibits no new modes in the distorted low temperature phase (T 2- ions. This mode does not show any anomaly near the charge order -disorder phase transition Tsub(t)=186 K. Temperature tunable spin fluctuations associated with the temperature activated Eu 2+ → Eu 3+ electron hopping are detected in the scattering intensity, superimposed on the usual thermal spin disorder. (author)
Metals: Phonon states, electron states and Fermi surfaces. Subvolume a
International Nuclear Information System (INIS)
Dederichs, P.H.; Schober, H.; Sellmyer, D.J.
1981-01-01
This collection of tables and diagrams is the first contribution to a larger programme aiming at a complete and critical tabulation of reliable data relevant to metal physics. No such complete collection exists at present, and these tables should fill a long felt need of both experimentalists and theoreticians. Group III in the New Series of the Landolt-Boernstein tables deals with Crystal and Solid State Physics. Volume III/13 to which this subvolume 13a belongs will cover all data published up to 1980 on phonon and electron states and Fermi surfaces in metals. Both experimental and theoretical results are included. (orig./WL)
Electron-phonon coupling in quasi free-standing graphene
DEFF Research Database (Denmark)
Christian Johannsen, Jens; Ulstrup, Søren; Bianchi, Marco
2013-01-01
Quasi free-standing monolayer graphene can be produced by intercalating species like oxygen or hydrogen between epitaxial graphene and the substrate crystal. If the graphene is indeed decoupled from the substrate, one would expect the observation of a similar electronic dispersion and many......-body effects, irrespective of the substrate and the material used to achieve the decoupling. Here we investigate the electron-phonon coupling in two different types of quasi free-standing monolayer graphene: decoupled from SiC via hydrogen intercalation and decoupled from Ir via oxygen intercalation. Both...
Effects of Vacancy Cluster Defects on Electrical and Thermodynamic Properties of Silicon Crystals
Directory of Open Access Journals (Sweden)
Pei-Hsing Huang
2014-01-01
Full Text Available A first-principle plane-wave pseudopotential method based on the density function theory (DFT was employed to investigate the effects of vacancy cluster (VC defects on the band structure and thermoelectric properties of silicon (Si crystals. Simulation results showed that various VC defects changed the energy band and localized electron density distribution of Si crystals and caused the band gap to decrease with increasing VC size. The results can be ascribed to the formation of a defect level produced by the dangling bonds, floating bonds, or high-strain atoms surrounding the VC defects. The appearance of imaginary frequencies in the phonon spectrum of defective Si crystals indicates that the defect-region structure is dynamically unstable and demonstrates phase changes. The phonon dispersion relation and phonon density of state were also investigated using density functional perturbation theory. The obtained Debye temperature θD for a perfect Si crystal had a minimum value of 448 K at T = 42 K and a maximum value of 671 K at the high-temperature limit, which is consistent with the experimental results reported by Flubacher. Moreover, the Debye temperature decreased with increases in the VC size. VC defects had minimal effects on the heat capacity (Cv value when temperatures were below 150 K. As the temperature was higher than 150 K, the heat capacity gradually increased with increasing temperature until it achieved a constant value of 11.8 cal/cell·K. The heat capacity significantly decreased as the VC size increased. For a 2 × 2 × 2 superlattice Si crystal containing a hexagonal ring VC (HRVC10, the heat capacity decreased by approximately 17%.
Electron paramagnetic resonance and luminescence of chromium in calcium germanate crystals
Gorshkov, O N; Tyurin, S A; Chigineva, A B; Chigirinskij, Y I
2002-01-01
One observed luminescence of Cr sup 4 sup + :Ca sub 2 GeO sub 4 single crystals near 1.3 mu m wave length at excitation by a semiconducting laser up to 573 K. At T < 110 K one detected the EPR spectrum identified as one belonging to Cr sup 4 sup + ions substituting for germanium. One determined the components of g-tensor and its basic axes. In calcium germanate this impurity centre slightly violates crystal symmetry. Detected deviation from the Curie law in EPR temperature dependence is explained by transition into the excited state with activation low energy. The giant efficient multiplicity of degeneration of the excited state is explained by induction of soft phonon modes of crystal at excitation of a defect
Exciton spectra of mixed LiH1-xDx crystals
International Nuclear Information System (INIS)
Plekhanov, V.G.
1989-01-01
The results of low-tempertaure experimental investigation of exciton spectra of pure surface of mixed crystals LiH 1-x d x forming the continuous series of a solved solution are presented. The long-wave reflection spectra is formed, as in pure crystals, by excitons of a large radius. The developed structure of spectra of exciton luminiscence consisting mainly of LO-lines, testifies to the intraband Frelich mechanism of free exciton scattering by LO-phonos, playing the considerable role in renormalization of the exciton Rydberg and the energy of interband transitions. Increase of the concentration of deuterium in mixed crystals causes a short-wave shift in the reflection spectrum and luminescence and continuous decrease of LO-phonon energy together with the increase of Rydberg exciton
Splash, pop, sizzle: Information processing with phononic computing
International Nuclear Information System (INIS)
Sklan, Sophia R.
2015-01-01
Phonons, the quanta of mechanical vibration, are important to the transport of heat and sound in solid materials. Recent advances in the fundamental control of phonons (phononics) have brought into prominence the potential role of phonons in information processing. In this review, the many directions of realizing phononic computing and information processing are examined. Given the relative similarity of vibrational transport at different length scales, the related fields of acoustic, phononic, and thermal information processing are all included, as are quantum and classical computer implementations. Connections are made between the fundamental questions in phonon transport and phononic control and the device level approach to diodes, transistors, memory, and logic.
Room temperature single-crystal diffuse scattering and ab initio lattice dynamics in CaTiSiO5.
Gutmann, M J; Refson, K; Zimmermann, M V; Swainson, I P; Dabkowski, A; Dabkowska, H
2013-08-07
Single-crystal diffuse scattering data have been collected at room temperature on synthetic titanite using both neutrons and high-energy x-rays. A simple ball-and-springs model reproduces the observed diffuse scattering well, confirming its origin to be primarily due to thermal motion of the atoms. Ab initio phonons are calculated using density-functional perturbation theory and are shown to reproduce the experimental diffuse scattering. The observed diffuse x-ray and neutron scattering patterns are consistent with a summation of mode frequencies and displacement eigenvectors associated with the entire phonon spectrum, rather than with a simple, short-range static displacement. A band gap is observed between 600 and 700 cm(-1) with only two modes crossing this region, both associated with antiferroelectric Ti-O motion along a. One of these modes (of Bu symmetry), displays a large LO-TO mode-splitting (562-701.4 cm(-1)) and has a dominant component coming from Ti-O bond-stretching and, thus, the mode-splitting is related to the polarizability of the Ti-O bonds along the chain direction. Similar mode-splitting is observed in piezo- and ferroelectric materials. The calculated phonon dispersion model may be of use to others in future to understand the phase transition at higher temperatures, as well as in the interpretation of measured phonon dispersion curves.
Pressure measurements of TO-phonon anharmonicity in isotopic ZnS
Energy Technology Data Exchange (ETDEWEB)
Tallman, R.E.; Weinstein, B.A. [SUNY at Buffalo, Department of Physics, Buffalo, NY 14260 (United States); Ritter, T.M. [Dept. of Chemistry and Physics, UNC Pembroke, NC 28372 (United States); Cantarero, A. [Dept. of Physics and Institute of Materials Science, University of Valencia (Spain); Serrano, J.; Lauck, R.; Cardona, M. [Max-Planck-Institut fuer Festkoerperforschung, 70569 Stuttgart (Germany)
2004-03-01
We have measured the dependence on pressure of the line-widths of the TO and LO Raman phonons of {beta}-ZnS. In order to enhance the phenomena observed, and to eliminate possible effects of isotopic disorder, we have measured a nearly isotopically pure crystal, {sup 68}Zn{sup 32}S. The strongly structured pressure effects observed are interpreted on the basis of anharmonic decay and the corresponding two-phonon density of states. (copyright 2004 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)
Antropov, A. S.; Fidanyan, K. S.; Stegailov, V. V.
2018-01-01
An accurate computation of the vibrational properties of a crystal lattice, such as phonon density of states and dispersion curves, is necessary for the description of thermodynamic properties of the solid state as well as defect migration rates. In this work, we use a simple embedded atom model classical interatomic potential. The phonon density of states for the α and γ phases of uranium at different temperatures was calculated by three methods: the lattice dynamics approach, the Fourier transformation of the velocity autocorrelation function and the Green’s function method for lattice dynamics.
Structure factors and phonon dispersion in liquid
Indian Academy of Sciences (India)
2Electronics Department, Narmada College of Science and Commerce, Bharuch 392 011,. India. E-mail: apratapmsu@yahoo.com. Abstract. The phonon spectra for .... Structure factors and phonon dispersion in liquid Li0.61Na0.39 alloy. [5] U Balucani and M Zoppi, Dynamics of the liquid state (Clarendon, Oxford, 1994).
Resonant tunneling in a pulsed phonon field
DEFF Research Database (Denmark)
Kral, P.; Jauho, Antti-Pekka
1999-01-01
, The nonequilibrium spectral function for the resonance displays the formation and decay of the phonon sidebands on ultrashort time scales. The time-dependent tunneling current through the individual phonon satellites reflects this quasiparticle formation by oscillations, whose time scale is set by the frequency...
Brennan, Ciaran Joseph
Impulse Stimulated Raman Scattering (ISRS) is a useful technique for characterizing the soft optic modes that are responsible for the polar distortion in ferroelectric crystals. ISRS provides an impulse force to the selected mode at a specific wavevector, and the subsequent oscillations and damping of the mode can be observed. Previous researchers have used this technique to measure the wavevector-dependent frequency and damping of optic phonons and phonon-polaritons in a variety of ferroelectric crystals. The recent development of powerful amplified Ti:sapphire femtosecond lasers opens the possibility that the impulse force applied to the ferroelectric soft mode is so large that the resultant ionic excursions will sample the anharmonic portions of the potential energy surface for the soft mode. This would, in principle, allow the experimental measurement of the potential energy surface by carefully characterizing the anharmonic content of the ISRS signals. This information would give insight into the causal mechanism for the phenomenon of ferroelectricity. Measurements of anharmonic phonon-polaritons in ferroelectric crystals have been performed using Wavevector Overtone Spectroscopy (WOS), a refinement of the impulsive stimulated Raman scattering (ISRS) technique. Numerical simulations suggest that harmonics of the polariton wavevector, rather than harmonics of the polariton frequency, are the key signatures of lattice anharmonicity in a time resolved grating experiment. The predicted signals at the wavevector overtones were observed up to the 5th order in LiTaO3, providing strong evidence of anharmonicity of the phonon-polariton response. Further evidence for anharmonicity comes from ISRS measurements at the fundamental wavevector and measurements of diffraction efficiency. The ISRS data shows non-sinusoidal response with a rich overtone spectrum, while the diffraction efficiency measurements reveal ionic displacements of about 1% of the ferroelectric distortion
Colossal Seebeck effect enhanced by quasi-ballistic phonons dragging massive electrons in FeSb2
Takahashi, H.; Okazaki, R.; Ishiwata, S.; Taniguchi, H.; Okutani, A.; Hagiwara, M.; Terasaki, I.
2016-09-01
Phonon transport is an essential property of thermoelectric materials. Although the phonon carries heat, which reduces the thermoelectric efficiency, it contributes positively to the Seebeck coefficient S through the phonon-drag effect, as typified by the high-purity semiconductors, which show fairly large S at cryogenic temperatures. Although such a large S is attractive in terms of Peltier cooling, a clear guiding principle for designing thermoelectric materials enriched by the phonon-drag effect remains to be established. Here we demonstrate that a correlated semiconductor, FeSb2, is a promising thermoelectric material featuring quasi-ballistic phonons dragging d electrons with large effective mass. By changing the sample size within the sub-millimetre order for high-purity single crystals, we succeed in substantially increasing S to as much as -27 mV K-1 at low temperatures. Our results exemplify a strategy for exploring phonon-drag-based thermoelectric materials, the performance of which can be maximized by combining heavy electrons with ballistic phonons.
Electron mobility limited by optical phonons in wurtzite InGaN/GaN core-shell nanowires
Liu, W. H.; Qu, Y.; Ban, S. L.
2017-09-01
Based on the force-balance and energy-balance equations, the optical phonon-limited electron mobility in InxGa1-xN/GaN core-shell nanowires (CSNWs) is discussed. It is found that the electrons tend to distribute in the core of the CSNWs due to the strong quantum confinement. Thus, the scattering from first kind of the quasi-confined optical (CO) phonons is more important than that from the interface (IF) and propagating (PR) optical phonons. Ternary mixed crystal and size effects on the electron mobility are also investigated. The results show that the PR phonons exist while the IF phonons disappear when the indium composition x < 0.047, and vice versa. Accordingly, the total electron mobility μ first increases and then decreases with indium composition x, and reaches a peak value of approximately 3700 cm2/(V.s) when x = 0.047. The results also show that the mobility μ increases as increasing the core radius of CSNWs due to the weakened interaction between the electrons and CO phonons. The total electron mobility limited by the optical phonons exhibits an obvious enhancement as decreasing temperature or increasing line electron density. Our theoretical results are expected to be helpful to develop electronic devices based on CSNWs.
Phonon Sensor Dynamics for Cryogenic Dark Matter Search Experiment
Energy Technology Data Exchange (ETDEWEB)
Yen, Jeffrey [Stanford Univ., CA (United States)
2015-01-01
Understanding the quasiparticle diffusion process inside sputtered aluminum (Al thin films (~ 0.1-1 μm is critical for the Cryogenic Dark Matter Search (CDMS experiment to further optimize its detectors to directly search for dark matter. An initial study with Al films was undertaken by our group ~ 20 years ago, but some important questions were not answered at the time. This thesis can be considered a continuation of that critical study. The CDMS experiment utilizes high purity silicon and germanium crystals to simultaneously measure ionization and phonons created by particle interactions. In addition to describing some of the rich physics involved in simultaneously detecting ionization and phonons with a CDMS detector, this thesis focuses on the detailed physics of the phonon sensors themselves, which are patterned onto CDMS detector surfaces. CDMS detectors use thin sputtered Al films to collect phonon energy when it propagates to the surfaces of the detector crystals. The phonon energy breaks Cooper pairs and creates quasiparticles (qps). These qps diffuse until they get trapped in an proximitized “overlap” region where lower-Tc tungsten films connect to the Al film. These tungsten films are the transition edge sensors (W-TESs CDMS uses to readout phonon signals. We performed a wide range of experiments using several sets of test devices designed and fabricated specifically for this work. The devices were used mostly to study quasiparticle (qp transport in Al films and qp transmission through Al/W interfaces. The results of this work are being used to optimize the design of detectors for SuperCDMS SNOLAB. This thesis is intended for CDMS collaborators who are interested in knowing more about the detailed fundamentals of how our phonon sensors work so they can take full advantage of their benefits. However, this work can also be read by general readers who are interested in particle detection using TES technology. This thesis contains eight chapters. The
Optical phonon modes and polaron related parameters in GaxIn1-xP
Bouarissa, N.; Algarni, H.; Al-Hagan, O. A.; Khan, M. A.; Alhuwaymel, T. F.
2018-02-01
Based on a pseudopotential approach under the virtual crystal approximation that includes the effect of compositional disorder, the optical lattice vibration frequencies and polaron related parameters in zinc-blende GaxIn1-xP have been studied. Our findings showed generally reasonably good accord with data in the literature. Other case, our results are predictions. The composition dependence of longitudinal optical (LO) and transverse optical (TO) phonon modes, LO-TO splittings, Frӧhlich coupling parameter, Debye temperature of LO phonon frequency, and polaron effective mass has been analyzed and discussed. While a non-monotonic behavior has been noticed for the LO and TO phonon frequencies versus Ga concentration x, a monotonic behavior has been observed for the rest of the features of interest. The information derived from this investigation may be useful for optoelectronic technological applications.
Spontaneous emission spectrum from a V-type three-level atom in a double-band photonic crystal
International Nuclear Information System (INIS)
Zhang Han Zhuang; Tang Sing Hai; Dong Po; He Jun
2002-01-01
The spontaneous emission spectrum from a V-type three-level atom embedded in a double-band photonic band gap (PBG) material has been investigated for the first time. Most interestingly it is shown that there is not only a black dark line, but also a narrow spontaneous line near the edges of the double photonic band. The positions of the dark line and narrow spontaneous line are near the transition from an empty upper level to a lower level. The lines stem from destructive and constructive quantum interferences, which induce population transfer between the two upper levels, in the PBG reservoirs. The effects of system parameters on the interference have been discussed in detail
Feng, Tianli; Ruan, Xiulin
2018-01-01
We have developed a formalism of the exact solution to linearized phonon Boltzmann transport equation (BTE) for thermal conductivity calculation including three- and four-phonon scattering. We find strikingly high four-phonon scattering rates in single-layer graphene (SLG) based on the optimized Tersoff potential. The reflection symmetry in graphene, which forbids the three-ZA (out-of-plane acoustic) scattering, allows the four-ZA processes ZA +ZA ⇌ZA +ZA and ZA ⇌ZA +ZA + ZA. As a result, the large phonon population of the low-energy ZA branch originated from the quadratic phonon dispersion leads to high four-phonon scattering rates, even much higher than the three-phonon scattering rates at room temperature. These four-phonon processes are dominated by the normal processes, which lead to a failure of the single mode relaxation time approximation. Therefore, we have solved the exact phonon BTE using an iterative scheme and then calculated the length- and temperature-dependent thermal conductivities. We find that the predicted thermal conductivity of SLG is lower than the previously predicted value from the three-phonon scattering only. The relative contribution of the ZA branch is reduced from 70% to 30% when four-phonon scattering is included. Furthermore, we have demonstrated that the four-phonon scattering in multilayer graphene and graphite is not strong due to the ZA splitting by interlayer van der Waals interaction. We also demonstrate that the five-phonon process in SLG is not strong due to the restriction of reflection symmetry.
Phonon scattering in metallic glasses
International Nuclear Information System (INIS)
Black, J.L.
1979-01-01
The purpose of this article is to review some recent theoretical and experimental developments in the study of metallic glasses at temperatures near or below 1K. In this temperature regime, it appears that practically all glasses, whether metallic or insulating, behave in a similar fashion. The fact that such similarities occur, despite substantial structural differences between metallic and insulating glasses, constitutes a major theoretical challenge. This challenge, however, is not directly addressed in what follows. Instead, the evidence for universal behavior and the theory which is necessary to understand this evidence are emphasized. It turns out that most of this evidence involves a comparison of phonon scattering in metallic glasses with its counterpart in insulating glasses
Electron–phonon coupling from finite differences
Monserrat, Bartomeu
2018-02-01
The interaction between electrons and phonons underlies multiple phenomena in physics, chemistry, and materials science. Examples include superconductivity, electronic transport, and the temperature dependence of optical spectra. A first-principles description of electron–phonon coupling enables the study of the above phenomena with accuracy and material specificity, which can be used to understand experiments and to predict novel effects and functionality. In this topical review, we describe the first-principles calculation of electron–phonon coupling from finite differences. The finite differences approach provides several advantages compared to alternative methods, in particular (i) any underlying electronic structure method can be used, and (ii) terms beyond the lowest order in the electron–phonon interaction can be readily incorporated. But these advantages are associated with a large computational cost that has until recently prevented the widespread adoption of this method. We describe some recent advances, including nondiagonal supercells and thermal lines, that resolve these difficulties, and make the calculation of electron–phonon coupling from finite differences a powerful tool. We review multiple applications of the calculation of electron–phonon coupling from finite differences, including the temperature dependence of optical spectra, superconductivity, charge transport, and the role of defects in semiconductors. These examples illustrate the advantages of finite differences, with cases where semilocal density functional theory is not appropriate for the calculation of electron–phonon coupling and many-body methods such as the GW approximation are required, as well as examples in which higher-order terms in the electron–phonon interaction are essential for an accurate description of the relevant phenomena. We expect that the finite difference approach will play a central role in future studies of the electron–phonon interaction.
Preparation of TiC single crystals
International Nuclear Information System (INIS)
Scheerer, B.; Fink, J.; Reichardt, W.
1975-07-01
TiC single crystals were prepared by vertical zone melting for measurements of the phonon dispersion by inelastic neutron scattering. The influence of the starting material and of the growing conditions on the growth of the crystal were studied. The crystals were characterized by chemical methods, EMX and neutron diffraction. It was possible to grow single crystals with a volume of up to 0.6 cm 3 and mosaic spread of less then 0.4 0 . (orig.) [de
Wu, Xufei; Liu, Zeyu; Luo, Tengfei
2018-02-01
In recent years, the fundamental physics of spin-lattice (e.g., magnon-phonon) interaction has attracted significant experimental and theoretical interests given its potential paradigm-shifting impacts in areas like spin-thermoelectrics, spin-caloritronics, and spintronics. Modelling studies of the transport of magnons and phonons in magnetic crystals are very rare. In this paper, we use spin-lattice dynamics (SLD) simulations to model ferromagnetic crystalline iron, where the spin and lattice systems are coupled through the atomic position-dependent exchange function, and thus the interaction between magnons and phonons is naturally considered. We then present a method combining SLD simulations with spectral energy analysis to calculate the magnon and phonon harmonic (e.g., dispersion, specific heat, and group velocity) and anharmonic (e.g., scattering rate) properties, based on which their thermal conductivity values are calculated. This work represents an example of using SLD simulations to understand the transport properties involving coupled magnon and phonon dynamics.
A bond-order theory on the phonon scattering by vacancies in two-dimensional materials.
Xie, Guofeng; Shen, Yulu; Wei, Xiaolin; Yang, Liwen; Xiao, Huaping; Zhong, Jianxin; Zhang, Gang
2014-05-28
We theoretically investigate the phonon scattering by vacancies, including the impacts of missing mass and linkages (τ(V)(-1)) and the variation of the force constant of bonds associated with vacancies (τ(A)(-1)) by the bond-order-length-strength correlation mechanism. We find that in bulk crystals, the phonon scattering rate due to change of force constant τ(A)(-1) is about three orders of magnitude lower than that due to missing mass and linkages τ(V)(-1). In contrast to the negligible τ(A)(-1) in bulk materials, τ(A)(-1) in two-dimensional materials can be 3-10 folds larger than τ(V)(-1). Incorporating this phonon scattering mechanism to the Boltzmann transport equation derives that the thermal conductivity of vacancy defective graphene is severely reduced even for very low vacancy density. High-frequency phonon contribution to thermal conductivity reduces substantially. Our findings are helpful not only to understand the severe suppression of thermal conductivity by vacancies, but also to manipulate thermal conductivity in two-dimensional materials by phononic engineering.
Indian Academy of Sciences (India)
Abstract. Phonons in a metal interact with conduction electrons which give rise to a finite linewidth. In the normal state, this leads to a Lorentzian shape of the phonon line. Density functional theory is able to predict the phonon linewidths as a function of wave vector for each branch of the phonon dispersion. An experimental ...
Frequency-tunable terahertz wave generation via excitation of phonon-polaritons in GaP
Tanabé, T; Nishizawa, J I; Saitô, K; Kimura, T
2003-01-01
High-power, wide-frequency-tunable terahertz waves were generated based on difference-frequency generation in GaP crystals with small-angle noncollinear phase matching. The tunable frequency range was as wide as 0.5-7 THz, and the peak power remained high, near 100 mW, over most of the frequency region. The tuning properties were well described by the dispersion relationship for the phonon-polariton mode of GaP up to 6 THz. We measured the spectra of crystal polyethylene and crystal quartz with high resolution using this THz-wave source.
Electron–phonon superconductivity in YIn3
International Nuclear Information System (INIS)
Billington, D; Llewellyn-Jones, T M; Maroso, G; Dugdale, S B
2013-01-01
First-principles calculations of the electron–phonon coupling were performed on the cubic intermetallic compound YIn 3 . The electron–phonon coupling constant was found to be λ ep = 0.42. Using the Allen–Dynes formula with a Coulomb pseudopotential of μ* = 0.10, a T c of approximately 0.77 K is obtained which is reasonably consistent with the experimentally observed temperature (between 0.8 and 1.1 K). The results indicate that conventional electron–phonon coupling is capable of producing the superconductivity in this compound. (paper)
International Nuclear Information System (INIS)
Doak, R.B.
1981-01-01
A crystal surface terminates abruptly one dimension of lattice periodicity, constituting a lattice defect with concomitant localized modes of vibration, termed surface phonons. Such surface phonons have previously been investigated in the long wavelength, non-dispersive regime. The present work reports the first observation of surface phonons in the short wavelength, dispersive range. The data allow for the first time a surface phonon dispersion curve to be plotted completely from origin to edge of the surface Brillouin zone. Measurements were made of phonons along the (anti GAMMA anti M) and (anti GAMMA anti X) azimuths of the LiF(001) surface and along the azimuth of NaF(001) and KC1(001) surfaces. The results are in substantial agreement with theoretical predictions, although for LiF the measured Rayleigh dispersion curve at M lies appreciably below the theoretical value, possibly reflecting the effects of surface relaxation. (orig.)
Phonon characteristics of high Tc superconductors from neutron Doppler broadening measurements
International Nuclear Information System (INIS)
Trela, W.J.; Kwei, G.H.; Lynn, J.E.; Meggers, K.
1994-01-01
Statistical information on the phonon frequency spectrum of materials can be measured by neutron transmission techniques if they contain nuclei with low energy resonances, narrow enough to be Doppler-broadened, in their neutron cross sections. The authors have carried out some measurements using this technique for materials of the lanthanum barium cuprate class, La 2-x Ba x CuO 4 . Two samples with slightly different concentrations of oxygen, one being superconductive, the other not, were examined. Pure lanthanum cuprate was also measured. Lanthanum, barium and copper all have relatively low energy narrow resonances. Thus it should be possible to detect differences in the phonons carried by different kinds of atom in the lattice. Neutron cross section measurements have been made with high energy resolution and statistical precision on the 59m flight path of LANSCE, the pulsed spallation neutron source at Los Alamos National Laboratory. Measurements on all three materials were made over a range of temperatures from 15K to 300K, with small steps through the critical temperature region near 27K. No significant changes in the mean phonon energy of the lanthanum atoms were observed near the critical temperature of the super-conducting material. It appears however that the mean phonon energy of lanthanum in the superconductor is considerably higher than that in the non-superconductors. The samples used in this series of experiments were too thin in barium and copper to determine anything significant about their phonon spectra
Phonon characteristics of high {Tc} superconductors from neutron Doppler broadening measurements
Energy Technology Data Exchange (ETDEWEB)
Trela, W.J.; Kwei, G.H.; Lynn, J.E. [Los Alamos National Lab., NM (United States); Meggers, K. [Univ. of Kiel (Germany)
1994-12-01
Statistical information on the phonon frequency spectrum of materials can be measured by neutron transmission techniques if they contain nuclei with low energy resonances, narrow enough to be Doppler-broadened, in their neutron cross sections. The authors have carried out some measurements using this technique for materials of the lanthanum barium cuprate class, La{sub 2{minus}x}Ba{sub x}CuO{sub 4}. Two samples with slightly different concentrations of oxygen, one being superconductive, the other not, were examined. Pure lanthanum cuprate was also measured. Lanthanum, barium and copper all have relatively low energy narrow resonances. Thus it should be possible to detect differences in the phonons carried by different kinds of atom in the lattice. Neutron cross section measurements have been made with high energy resolution and statistical precision on the 59m flight path of LANSCE, the pulsed spallation neutron source at Los Alamos National Laboratory. Measurements on all three materials were made over a range of temperatures from 15K to 300K, with small steps through the critical temperature region near 27K. No significant changes in the mean phonon energy of the lanthanum atoms were observed near the critical temperature of the super-conducting material. It appears however that the mean phonon energy of lanthanum in the superconductor is considerably higher than that in the non-superconductors. The samples used in this series of experiments were too thin in barium and copper to determine anything significant about their phonon spectra.
Yu, Chung; Chong, Yat C.; Fong, Chee K.
1989-06-01
Interaction of GHz and MHz radiation with CO2 laser propagation in a silver halide fiber using sBs based phonon coupling is furthet investigated. The external signal serves to both probe and enhance laser generated sBs phonons in the fiber. Efficient coupling of microwave radiation into the fiber is accomplished by placing the fiber in a hollow metallic waveguide, designed and constructed to transmit the dominant mode in the 0.9-2.0 GHz band. MHz radiation is conveniently coupled into the fiber using the guided microwave radiation as carrier. Phonon emissions from the fiber under CO2 laser pumping are first established on a spectrum analyzer; low frequency generators ale then tuned to match these frequencies and their maximum interaction recorded. Such interactions are systematically studied by monitoring the amplitude and waveform of the reflected and transmitted laser pulse at various power levels and frequencies of the externally coupled radiation. A plot of reflected laser power versus incident laser power reveals a distinct sBs generated phonon threshold. Variouslaunch directions of the GHz and MHz radiation with respect to the direction of laser propagation are realized to verify theory governing sBs interactions. The MHz radiation and its associated phonons in the fiber are convenient tools for probing sBs related phenomenon in infrared fibers.
Goldberg, Ilana G; Vila, Fernando D; Jach, Terrence
2012-10-11
Recent studies of the crystallization of cyclotrimethylene-trinitramine (RDX) have shown that the presence of the α- and β-phases of the compound is sensitive to the substrate when using drop cast crystallization methods. The specific phase has potential consequences for measurements of the nitrogen K X-ray emission spectrum (XES) that were recently reported for this compound using samples crystallized on In metal substrates. We have determined that the crystallization of RDX on a clean In metal substrate starts out completely as the β-phase but progressively incorporates the α-phase as the film thickens. In addition, we have carried out additional molecular orbital calculations of the N 1s X-ray fluorescence from the valence band, comparing the results expected from the α-and β- phases. The differences due to the presence of the β-phase instead of, or in addition to, the α-phase appear to be minimal.
Phonon Squeezing by Raman Scattering.
Nori, Franco; Hu, Xuedong
1997-03-01
We have studied quantum fluctuation properties of a crystal lattice, and proposed several mechanisms to achieve this goal(X. Hu and F. Nori, Phys. Rev. Lett. 76, 2294 (1996); Phys. Rev. B 53, 2419 (1996); preprint.).
Crystal fields and conduction electrons in praseodymium
DEFF Research Database (Denmark)
Clausen, K.N.; Aagaard Sørensen, S.; McEwen, K.A.
1995-01-01
The interactions between the crystal-field excitations, the phonons and the conduction electrons in Pr have been studied further. The low-energy satellites to the crystal-field excitations, which are believed to be associated with propagating paramagnon modes in the conduction-electron gas, appear...
Length-scale dependent phonon interactions
Srivastava, Gyaneshwar
2014-01-01
This book presents a comprehensive description of phonons and their interactions in systems with different dimensions and length scales. Internationally-recognized leaders describe theories and measurements of phonon interactions in relation to the design of materials with exotic properties such as metamaterials, nano-mechanical systems, next-generation electronic, photonic, and acoustic devices, energy harvesting, optical information storage, and applications of phonon lasers in a variety of fields. The emergence of techniques for control of semiconductor properties and geometry has enabled engineers to design structures in which functionality is derived from controlling electron behavior. As manufacturing techniques have greatly expanded the list of available materials and the range of attainable length scales, similar opportunities now exist for designing devices whose functionality is derived from controlling phonon behavior. However, progress in this area is hampered by gaps in our knowledge of phono...
Electromagnetic decay of two-phonon states
International Nuclear Information System (INIS)
Catara, F.; Chomaz, Ph.; Van Giai, N.; Paris-11 Univ., 91 - Orsay
1991-01-01
The electromagnetic decay of two-phonon states corresponding to the multi-excitation of giant resonances is studied. The calculations are performed within a boson expansion approach and the elementary modes are constructed in random phase approximation (RPA). The rates for direct transition of two-phonon states to the ground state turn out to be not negligibly smaller than those from the (single) giant resonances. The former transitions are accompanied by a γ-ray whose energy is equal to the sum of the two phonon energies. Thus the detection of such high energy γ-rays could provide a signature of the excitation of two-phonon states. (author) 9 refs., 3 tabs
Characterizing phonon dynamics using stochastic sampling
International Nuclear Information System (INIS)
Kunal, K.; Aluru, N. R.
2016-01-01
Predicting phonon relaxation time from molecular dynamics (MD) requires a long simulation time to compute the mode energy auto-correlation function. Here, we present an alternative approach to infer the phonon life-time from an approximate form of the energy auto-correlation function. The method requires as an input a set of sampled equilibrium configurations. A stochastic sampling method is used to generate the equilibrium configurations. We consider a truncated Taylor series expansion of the phonon energy auto-correlation function. The different terms in the truncated correlation function are obtained using the stochastic sampling approach. The expansion terms, thus, obtained are in good agreement with the corresponding values obtained using MD. We then use the approximate function to compute the phonon relaxation time. The relaxation time computed using this method is compared with that obtained from the exact correlation function. The two values are in agreement with each other.
Influence of phonons on semiconductor quantum emission
Energy Technology Data Exchange (ETDEWEB)
Feldtmann, Thomas
2009-07-06
A microscopic theory of interacting charge carriers, lattice vibrations, and light modes in semiconductor systems is presented. The theory is applied to study quantum dots and phonon-assisted luminescence in bulk semiconductors and heterostructures. (orig.)
Phonon limited electronic transport in Pb
Rittweger, F.; Hinsche, N. F.; Mertig, I.
2017-09-01
We present a fully ab initio based scheme to compute electronic transport properties, i.e. the electrical conductivity σ and thermopower S, in the presence of electron-phonon interaction. We explicitly investigate the \
Direct measurement of individual phonon lifetimes in the clathrate compound Ba7.81Ge40.67Au5.33.
Lory, Pierre-François; Pailhès, Stéphane; Giordano, Valentina M; Euchner, Holger; Nguyen, Hong Duong; Ramlau, Reiner; Borrmann, Horst; Schmidt, Marcus; Baitinger, Michael; Ikeda, Matthias; Tomeš, Petr; Mihalkovič, Marek; Allio, Céline; Johnson, Mark Robert; Schober, Helmut; Sidis, Yvan; Bourdarot, Frédéric; Regnault, Louis Pierre; Ollivier, Jacques; Paschen, Silke; Grin, Yuri; de Boissieu, Marc
2017-09-08
Engineering lattice thermal conductivity requires to control the heat carried by atomic vibration waves, the phonons. The key parameter for quantifying it is the phonon lifetime, limiting the travelling distance, whose determination is however at the limits of instrumental capabilities. Here, we show the achievement of a direct quantitative measurement of phonon lifetimes in a single crystal of the clathrate Ba 7.81 Ge 40.67 Au 5.33 , renowned for its puzzling 'glass-like' thermal conductivity. Surprisingly, thermal transport is dominated by acoustic phonons with long lifetimes, travelling over distances of 10 to 100 nm as their wave-vector goes from 0.3 to 0.1 Å -1 . Considering only low-energy acoustic phonons, and their observed lifetime, leads to a calculated thermal conductivity very close to the experimental one. Our results challenge the current picture of thermal transport in clathrates, underlining the inability of state-of-the-art simulations to reproduce the experimental data, thus representing a crucial experimental input for theoretical developments.Phonon lifetime is a fundamental parameter of thermal transport however its determination is challenging. Using inelastic neutron scattering and the neutron resonant spin-echo technique, Lory et al. determine the acoustic phonon lifetime in a single crystal of clathrate Ba7.81Ge40.67Au5.33.
Squeezed Phonons: Modulating Quantum Fluctuations of Atomic Displacements.
Hu, Xuedong; Nori, Franco
1997-03-01
We have studied phonon squeezed states and also put forward several proposals for their generation(On phonon parametric process, X. Hu and F. Nori, Phys. Rev. Lett. 76), 2294 (1996); on polariton mechanism, X. Hu and F. Nori, Phys. Rev. B 53, 2419 (1996); on second-order Raman scattering, X. Hu and F. Nori, preprint.. Here, we compare the relative merits and limitations of these approaches, including several factors that will limit the amount of phonon squeezing. In particular, we investigate the effect of the initial thermal states on the phonon modes. Using a model for the phonon density matrix, we also study the mixing of the phonon squeezed states with thermal states, which describes the decay of the phonon coherence. Finally, we calculate the maximum possible squeezing from a phonon parametric process limited by phonon decay.
Lattice dynamics and electron-phonon coupling on Mn1-xFexSi: effect of magnetism
Gonzalez Castelazo, Paola; de La Peã+/-A Seaman, Omar; Heid, Rolf; Bohnen, Klaus-Peter
We have studied the electronic, lattice dynamics, and electron-phonon (e-ph) coupling properties of the Mn1-xFexSi alloy. This system have been analyzed within the framework of density functional perturbation theory, using a mixed-basis pseudopotential method and the virtual crystal approximation (VCA) for modeling the alloy. In particular, the electronic density of states (DOS), the full-phonon dispersion, as well as the electron-phonon coupling (λ) and the phonon linewidth (γ) have been calculated with and without the inclusion of spin polarization. While for FeSi is very well known that the effects of magnetism on the lattice dynamics are observed trough the phonon linewidths for specific regions on the zone boundary, on MnSi such detail analysis has not been addressed so far. Thus, the evolution of phonon frequencies and linewidths as a function of Fe-content are presented and discussed in detail, paying special attention the effect of spin-polarization on such properties for the magnetic region on the phase diagram x Conacyt-México under project No. CB2013-221807-F.
Fabrication of Si(111) crystalline thin film on graphene by aluminum-induced crystallization
Energy Technology Data Exchange (ETDEWEB)
Høiaas, I. M. [Department of Electronics and Telecommunications, Norwegian University of Science and Technology, NO-7491 Trondheim (Norway); Kim, D. C., E-mail: dc.kim@crayonano.com, E-mail: helge.weman@ntnu.no; Weman, H., E-mail: dc.kim@crayonano.com, E-mail: helge.weman@ntnu.no [Department of Electronics and Telecommunications, Norwegian University of Science and Technology, NO-7491 Trondheim (Norway); CrayoNano AS, Otto Nielsens vei 12, NO-7052 Trondheim (Norway)
2016-04-18
We report the fabrication of a Si(111) crystalline thin film on graphene by the aluminum-induced crystallization (AIC) process. The AIC process of Si(111) on graphene is shown to be enhanced compared to that on an amorphous SiO{sub 2} substrate, resulting in a more homogeneous Si(111) thin film structure as revealed by X-ray diffraction and atomic force microscopy measurements. Raman measurements confirm that the graphene is intact throughout the process, retaining its characteristic phonon spectrum without any appearance of the D peak. A red-shift of Raman peaks, which is more pronounced for the 2D peak, is observed in graphene after the crystallization process. It is found to correlate with the red-shift of the Si Raman peak, suggesting an epitaxial relationship between graphene and the adsorbed AIC Si(111) film with both the graphene and Si under tensile strain.
Phonovoltaic. III. Electron-phonon coupling and figure of merit of graphene:BN
Melnick, Corey; Kaviany, Massoud
2016-12-01
The phonovoltaic cell harvests optical phonons like a photovoltaic harvests photons, that is, a nonequilibrium (hot) population of optical phonons (at temperature Tp ,O) more energetic than the band gap produces electron-hole pairs in a p -n junction, which separates these pairs to produce power. A phonovoltaic material requires an optical phonon mode more energetic than its band gap and much more energetic than the thermal energy (Ep ,O>Δ Ee ,g≫kBT ), which relaxes by generating electrons and power (at rate γ˙e -p) rather than acoustic phonons and heat (at rate γ˙p -p). Graphene (h-C) is the most promising material candidate: when its band gap is tuned to its optical phonon energy without greatly reducing the electron-phonon (e -p ) coupling, it reaches a substantial figure of merit [ZpV=Δ Ee ,gγ˙e -p/Ep ,O(γ˙e -p+γ˙p -p) ≈0.8 ] . A simple tight-binding (TB) model presented here predicts that lifting the sublattice symmetry of graphene in order to open a band gap proscribes the e -p interaction at the band edge, such that γ˙e -p→0 as Δ Ee ,g→Ep ,O . However, ab initio (DFT-LDA) simulations of layered h-C/BN and substitutional h-C:BN show that the e -p coupling remains substantial in these asymmetric crystals. Indeed, h-C:BN achieves a high figure of merit (ZpV≈0.6 ). At 300 K and for a Carnot limit of 0.5 (Tp ,O=600 K) , a h-C:BN phonovoltaic can reach an efficiency of ηpV≈0.2 , double the thermoelectric efficiency (Z T ≈1 ) under similar conditions.
Kang, Joon Sang; Wu, Huan; Hu, Yongjie
2017-12-13
Heat dissipation is an increasingly critical technological challenge in modern electronics and photonics as devices continue to shrink to the nanoscale. To address this challenge, high thermal conductivity materials that can efficiently dissipate heat from hot spots and improve device performance are urgently needed. Boron phosphide is a unique high thermal conductivity and refractory material with exceptional chemical inertness, hardness, and high thermal stability, which holds high promises for many practical applications. So far, however, challenges with boron phosphide synthesis and characterization have hampered the understanding of its fundamental properties and potential applications. Here, we describe a systematic thermal transport study based on a synergistic synthesis-experimental-modeling approach: we have chemically synthesized high-quality boron phosphide single crystals and measured their thermal conductivity as a record-high 460 W/mK at room temperature. Through nanoscale ballistic transport, we have, for the first time, mapped the phonon spectra of boron phosphide and experimentally measured its phonon mean free-path spectra with consideration of both natural and isotope-pure abundances. We have also measured the temperature- and size-dependent thermal conductivity and performed corresponding calculations by solving the three-dimensional and spectral-dependent phonon Boltzmann transport equation using the variance-reduced Monte Carlo method. The experimental results are in good agreement with that predicted by multiscale simulations and density functional theory, which together quantify the heat conduction through the phonon mode dependent scattering process. Our finding underscores the promise of boron phosphide as a high thermal conductivity material for a wide range of applications, including thermal management and energy regulation, and provides a detailed, microscopic-level understanding of the phonon spectra and thermal transport mechanisms of
Directory of Open Access Journals (Sweden)
Lokteva Irina
2011-01-01
Full Text Available Abstract Resonant Raman study reveals the noticeable effect of the ligand exchange on the nanocrystal (NC surface onto the phonon spectra of colloidal CdTe NC of different size and composition. The oleic acid ligand exchange for pyridine ones was found to change noticeably the position and width of the longitudinal optical (LO phonon mode, as well as its intensity ratio to overtones. The broad shoulder above the LO peak frequency was enhanced and sharpened after pyridine treatment, as well as with decreasing NC size. The low-frequency mode around 100 cm-1 which is commonly related with the disorder-activated acoustical phonons appears in smaller NCs but is not enhanced after pyridine treatment. Surprisingly, the feature at low-frequency shoulder of the LO peak, commonly assigned to the surface optical phonon mode, was not sensitive to ligand exchange and concomitant close packing of the NCs. An increased structural disorder on the NC surface, strain and modified electron-phonon coupling is discussed as the possible reason of the observed changes in the phonon spectrum of ligand-exchanged CdTe NCs. PACS: 63.20.-e, 78.30.-j, 78.67.-n, 78.67.Bf
Trigonal warping and photo-induced effects on zone boundary phonon in monolayer graphene
Akay, D.
2018-05-01
We have reported the electronic band structure of monolayer graphene when the combined effects arising from the trigonal warp and highest zone-boundary phonons having A1 g symmetry with Haldane interaction which induced photo-irradiation effect. On the basis of our model, we have introduced a diagonalization to solve the associated Fröhlich Hamiltonian. We have examined that, a trigonal warping effect is introduced on the K and K ' points, leading to a dynamical band gap in the graphene electronic band spectrum due to the electron-A1 g phonon interaction and Haldane mass interaction. Additionally, the bands exhibited an anisotropy at this point. It is also found that, photo-irradiation effect is quite smaller than the trigonal warp effects in the graphene electronic band spectrum. In spite of this, controllability of the photo induced effects by the Haldane mass will have extensive implications in the graphene.
Phonon optimized interatomic potential for aluminum
Muraleedharan, Murali Gopal; Rohskopf, Andrew; Yang, Vigor; Henry, Asegun
2017-12-01
We address the problem of generating a phonon optimized interatomic potential (POP) for aluminum. The POP methodology, which has already been shown to work for semiconductors such as silicon and germanium, uses an evolutionary strategy based on a genetic algorithm (GA) to optimize the free parameters in an empirical interatomic potential (EIP). For aluminum, we used the Vashishta functional form. The training data set was generated ab initio, consisting of forces, energy vs. volume, stresses, and harmonic and cubic force constants obtained from density functional theory (DFT) calculations. Existing potentials for aluminum, such as the embedded atom method (EAM) and charge-optimized many-body (COMB3) potential, show larger errors when the EIP forces are compared with those predicted by DFT, and thus they are not particularly well suited for reproducing phonon properties. Using a comprehensive Vashishta functional form, which involves short and long-ranged interactions, as well as three-body terms, we were able to better capture interactions that reproduce phonon properties accurately. Furthermore, the Vashishta potential is flexible enough to be extended to Al2O3 and the interface between Al-Al2O3, which is technologically important for combustion of solid Al nano powders. The POP developed here is tested for accuracy by comparing phonon thermal conductivity accumulation plots, density of states, and dispersion relations with DFT results. It is shown to perform well in molecular dynamics (MD) simulations as well, where the phonon thermal conductivity is calculated via the Green-Kubo relation. The results are within 10% of the values obtained by solving the Boltzmann transport equation (BTE), employing Fermi's Golden Rule to predict the phonon-phonon relaxation times.
Phonon optimized interatomic potential for aluminum
Directory of Open Access Journals (Sweden)
Murali Gopal Muraleedharan
2017-12-01
Full Text Available We address the problem of generating a phonon optimized interatomic potential (POP for aluminum. The POP methodology, which has already been shown to work for semiconductors such as silicon and germanium, uses an evolutionary strategy based on a genetic algorithm (GA to optimize the free parameters in an empirical interatomic potential (EIP. For aluminum, we used the Vashishta functional form. The training data set was generated ab initio, consisting of forces, energy vs. volume, stresses, and harmonic and cubic force constants obtained from density functional theory (DFT calculations. Existing potentials for aluminum, such as the embedded atom method (EAM and charge-optimized many-body (COMB3 potential, show larger errors when the EIP forces are compared with those predicted by DFT, and thus they are not particularly well suited for reproducing phonon properties. Using a comprehensive Vashishta functional form, which involves short and long-ranged interactions, as well as three-body terms, we were able to better capture interactions that reproduce phonon properties accurately. Furthermore, the Vashishta potential is flexible enough to be extended to Al2O3 and the interface between Al-Al2O3, which is technologically important for combustion of solid Al nano powders. The POP developed here is tested for accuracy by comparing phonon thermal conductivity accumulation plots, density of states, and dispersion relations with DFT results. It is shown to perform well in molecular dynamics (MD simulations as well, where the phonon thermal conductivity is calculated via the Green-Kubo relation. The results are within 10% of the values obtained by solving the Boltzmann transport equation (BTE, employing Fermi’s Golden Rule to predict the phonon-phonon relaxation times.
Tanigaki, Katsumi; Wu, Jiazhen; Tanabe, Yoichi; Heguri, Satoshi; Shiimotani, Hidekazu; Tohoku University Collaboration
2014-03-01
Clathrates are featured by cage-like polyhedral hosts mainly composed of the IVth group elements of Si, Ge, or Sn and alkali metal or alkaline-earth metal elements can be accommodated inside as a guest atom. One of the most intriguing issues in clathrates is their outstanding high thermoelectric performances thanks to the low thermal conductivity. Being irrespective of good electric conductivity σ, the guest atom motions provide a low-energy lying less-dispersive phonons and can greatly suppress thermal conductivity κ. This makes clathrates close to the concept of ``phonon glass electron crystal: PGEC'' and useful in thermoelectric materials from the viewpoint of the figure of merit. In the present study, we show that the local phonon anharmonicity indicated by the tunneling-term of the endohedral atoms (αT) and the itinerant-electron term (γeT), both of which show T-linear dependences in specific heat Cp, can successfully be separated by employing single crystals with various carrier concentrations in a wide range of temperture experimennts. The factors affecting on the phonon anharmonicity as well as the strength of electron-phonon interactions will be discussed based on our recent experiments. The research was financially supported by Ministry of Education, Science, Sports and Culture, Grant in Aid for Science, and Technology of Japan.
Nano-imaging and nano-spectroscopy of tunable surface phonon polaritons in hexagonal boron nitride
Dai, Siyuan; Fei, Zhe; Ma, Qiong; Rodin, Aleksandr; Wagner, Martin; McLeod, Alexander; Liu, Mengkun; Gannett, Will; Regan, William; Thiemens, Mark; Dominguez, Gerardo; Castro Neto, Antonio; Zettl, Alex; Keilmann, Fritz; Jarillo-Herrero, Pablo; Fogler, Michael; Basov, Dimitri
2014-03-01
Van der Waals crystals such as graphene, topological insulators, cuprate high-temperature superconductors, and many other layered structures reveal a rich variety of enigmatic electronic, photonic and magnetic properties. We report infrared (IR) nano-imaging of surface phonon polaritons in a prototypical van-der-Waals crystal: hexagonal boron nitride (hBN). In the setting of an antenna-based IR spectroscopic nanoscope, we accomplished launching, detecting, and real space imaging of the polaritonic waves. We were able to alter both the wavelength and the amplitude of such waves by varying the number of crystal layers in our specimens. We demonstrated a new nano-photonics method for mapping the polariton dispersion. The dispersion is shown to be governed by the crystal thickness according to a scaling law that persists down to a few monolayers. Our results point to novel functionalities of van-der-Waals crystals as reconfigurable nano-photonic materials.
A step closer to visualizing the electron___phonon interplay
Energy Technology Data Exchange (ETDEWEB)
Chen, Y.L.; Lee, W.S.; Shen, Z.X.; /Stanford U., Appl. Phys. Dept. /Stanford U., Phys. Dept. /SLAC, PULSE
2011-01-04
dynamic information. This pump-probe experiment is reminiscent of the standard method used by bell makers for hundreds of years to judge the quality of their products (hitting a bell then listening to how the sound would fade away), albeit the relevant time scale here is way beyond tens of femtoseconds. Traditionally, ultrafast spectroscopy was carried out to study gas-phase reactions, but it has also been applied to study condensed phase systems since the development of reliable solid-state ultrafast lasers approximately a decade ago. In addition, the ability to control pulse width, wavelength, and amplification of the output of Ti:Sapphire lasers has further increased the capability of this experimental method. During the past decade, many ultrafast pump-probe experiments have been carried out in various fields by using different probing methods, such as photo-resistivity, fluorescence yield, and photoemission, and they have revealed much new information complementary to the equilibrium spectroscopy methods used before. Carbone et al. used the photon-pump, electron (diffraction)-probe method. The pumping photon pulse first drives the electrons in the sample into an oscillating mode along its polarization direction. Then during the delay time, these excited electrons can transfer excess energy to the adjacent nuclei and cause crystal lattice vibration on their way back to the equilibrium state. An ultrashort electron pulse is shot at the sample at various time delays {Delta}t and the diffraction pattern is collected. Because the electron diffraction pattern is directly related to the crystal lattice structure and its motion, this technique provides a natural way to study the electron-phonon coupling problem. Furthermore, by adjusting the pump pulse's relative polarization with respect to the Cu-O bond direction, Carbone et al. were able to acquire the electron-phonon coupling strength along different directions. Focusing on the lattice dynamic along the c axis
Engineering the hypersonic phononic band gap of hybrid Bragg stacks.
Schneider, Dirk; Liaqat, Faroha; El Boudouti, El Houssaine; El Hassouani, Youssef; Djafari-Rouhani, Bahram; Tremel, Wolfgang; Butt, Hans-Jürgen; Fytas, George
2012-06-13
We report on the full control of phononic band diagrams for periodic stacks of alternating layers of poly(methyl methacrylate) and porous silica combining Brillouin light scattering spectroscopy and theoretical calculations. These structures exhibit large and robust on-axis band gaps determined by the longitudinal sound velocities, densities, and spacing ratio. A facile tuning of the gap width is realized at oblique incidence utilizing the vector nature of the elastic wave propagation. Off-axis propagation involves sagittal waves in the individual layers, allowing access to shear moduli at nanoscale. The full theoretical description discerns the most important features of the hypersonic one-dimensional crystals forward to a detailed understanding, a precondition to engineer dispersion relations in such structures.
Effect of chemical and isotope substitution in LiH crystals on polariton emission
International Nuclear Information System (INIS)
Plekhanov, V.G.
1994-01-01
Measurements of fine structure of phonon-free line of free exciton radiation in mixed crystals LiH x F 1-x (o x D 1-x (O x F 1-x crystals a sharp increase in the intensity of phonon-free line of free exciton radiation as compared with its LO repetitions is observed. The experimental results suggest manifestation of polariton effects in mixed crystals produced on the basis of lithium hydride. 17 refs., 2 figs
Observation of the Phononic Lamb Shift with a Synthetic Vacuum
Directory of Open Access Journals (Sweden)
T. Rentrop
2016-11-01
Full Text Available In contrast to classical empty space, the quantum vacuum fundamentally alters the properties of embedded particles. This paradigm shift allows one to explain the discovery of the celebrated Lamb shift in the spectrum of the hydrogen atom. Here, we engineer a synthetic vacuum, building on the unique properties of ultracold atomic gas mixtures, offering the ability to switch between empty space and quantum vacuum. Using high-precision spectroscopy, we observe the phononic Lamb shift, an intriguing many-body effect originally conjectured in the context of solid-state physics. We find good agreement with theoretical predictions based on the Fröhlich model. Our observations establish this experimental platform as a new tool for precision benchmarking of open theoretical challenges, especially in the regime of strong coupling between the particles and the quantum vacuum.
Black hole elasticity and gapped transverse phonons in holography
Alberte, Lasma; Ammon, Martin; Baggioli, Matteo; Jiménez, Amadeo; Pujolàs, Oriol
2018-01-01
We study the elastic response of planar black hole (BH) solutions in a simple class of holographic models with broken translational invariance. We compute the transverse quasi-normal mode spectrum and the propagation speed of the lowest energy mode. We find that the speed of the lowest mode relates to the BH rigidity modulus as dictated by elasticity theory. This allows to identify these modes as transverse phonons — the pseudo Goldstone bosons of spontaneously broken translational invariance. In addition, we show that these modes have a mass gap controlled by an explicit source of the translational symmetry breaking. These results provide a new confirmation that the BHs in these models do exhibit solid properties that become more manifest at low temperatures. Also, by the AdS/CFT correspondence, this allows to extend the standard results from the effective field theory for solids to quantum-critical materials.
Phonon scattering by isotopic impurities
International Nuclear Information System (INIS)
Dacol, D.K.
1974-06-01
The effects upon vibrations of a perfect crystal lattice due to the replacement of some of its atoms by isotopes of these atoms are studied. The approach consists in considering the isotopic impurities as scattering centres for the quanta of the elastic waves the objective is to obtain the scattering amplitudes. These amplitudes are obtained through a canonical transformation method which was introduced by Chevalier and Rideau in the study of the Wentzel's model in quantum field theory
Bianchini, Andrea
The coupling of the electromagnetic field with polar lattice vibrations of a solid, which gives rise to what is traditionally known as phonon polaritons, is investigated both through spontaneous and stimulated Raman scattering. Experimental results relative to polariton modes excited in several semiconductors are presented to explore their dependence on the crystal symmetry, temperature, excitation wavelength and measuring techniques. In GaAs we find discrepancies between spontaneous and Impulsive Stimulated Raman Scattering (ISRS) which are attributed to the presence of free carriers interacting with the electric field of the longitudinal phonon mode. In CraSe, we successfully excite two distinct frequencies of the lower phonon polariton branch. In the transparent regime, this is accomplished combining in the same experiment backward and forward scattering, the latter one induced by the beam reflected at the back surface of the sample. Moreover, it is shown how the reduced value of the scattering cross section retrieved in the time domain experiments is attributable to the polariton field spatial distribution, estimated in accordance with the Cherenkov radiation theory. In CdSe we identify another polariton mode that is present whenever the dielectric constant of a medium becomes negative: the surface plasmon polariton. Besides coherent phonons, squeezed phonons are studied. discussing their generation and detection in regard to the ISRS theory. In particular we introduce a novel phenomenon, named "phonon echo", occurring whenever a squeezed phonon field is induced in a crystal through a double pump excitation. Simulations are shown to validate the theoretical predictions and pave the way to future experiments. Shifting to the metamaterial field, we consider a viable technique to achieve artificial diamagnetism (the magnetic permeability mu is < 1). The proposed approach is based on the well established sphere-in-a-host model that is thoroughly described with
Phonon tunneling through a double barrier system
Energy Technology Data Exchange (ETDEWEB)
Villegas, Diosdado [Departamento de Física, Universidad Central “Marta Abreu” de Las Villas, CP 54830, Santa Clara, Villa Clara (Cuba); Instituto de Física, Universidad Autónoma de Puebla, 18 Sur y San Claudio, Edif. 110A, Ciudad Universitaria, 72570 Puebla (Mexico); León-Pérez, Fernando de [Centro Universitario de la Defensa de Zaragoza, Ctra. de Huesca s/n, E-50090 Zaragoza (Spain); Pérez-Álvarez, R. [Universidad Autónoma del Estado de Morelos, Av. Universidad 1001, CP 62209 Cuernavaca (Mexico); Arriaga, J., E-mail: arriaga@ifuap.buap.mx [Instituto de Física, Universidad Autónoma de Puebla, 18 Sur y San Claudio, Edif. 110A, Ciudad Universitaria, 72570 Puebla (Mexico)
2015-04-15
The tunneling of optical and acoustic phonons at normal incidence on a double-barrier is studied in this paper. Transmission coefficients and resonance conditions are derived theoretically under the assumption that the long-wavelength approximation is valid. It is shown that the behavior of the transmission coefficients for the symmetric double barrier has a Lorentzian form close to resonant frequencies and that Breit–Wigner's formula have a general validity in one-dimensional phonon tunneling. Authors also study the so-called generalized Hartman effect in the tunneling of long-wavelength phonons and show that this effect is a numerical artifact resulting from taking the opaque limit before exploring the variation with a finite barrier width. This study could be useful for the design of acoustic devices.
Phonon tunneling through a double barrier system
International Nuclear Information System (INIS)
Villegas, Diosdado; León-Pérez, Fernando de; Pérez-Álvarez, R.; Arriaga, J.
2015-01-01
The tunneling of optical and acoustic phonons at normal incidence on a double-barrier is studied in this paper. Transmission coefficients and resonance conditions are derived theoretically under the assumption that the long-wavelength approximation is valid. It is shown that the behavior of the transmission coefficients for the symmetric double barrier has a Lorentzian form close to resonant frequencies and that Breit–Wigner's formula have a general validity in one-dimensional phonon tunneling. Authors also study the so-called generalized Hartman effect in the tunneling of long-wavelength phonons and show that this effect is a numerical artifact resulting from taking the opaque limit before exploring the variation with a finite barrier width. This study could be useful for the design of acoustic devices
Nonequilibrium phonon effects in midinfrared quantum cascade lasers
Energy Technology Data Exchange (ETDEWEB)
Shi, Y. B., E-mail: yshi9@wisc.edu; Knezevic, I., E-mail: knezevic@engr.wisc.edu [Department of Electrical and Computer Engineering, University of Wisconsin-Madison, Madison, Wisconsin 53706-1691 (United States)
2014-09-28
We investigate the effects of nonequilibrium phonon dynamics on the operation of a GaAs-based midinfrared quantum cascade laser over a range of temperatures (77–300 K) via a coupled ensemble Monte Carlo simulation of electron and optical-phonon systems. Nonequilibrium phonon effects are shown to be important below 200 K. At low temperatures, nonequilibrium phonons enhance injection selectivity and efficiency by drastically increasing the rate of interstage electron scattering from the lowest injector state to the next-stage upper lasing level via optical-phonon absorption. As a result, the current density and modal gain at a given field are higher and the threshold current density lower and considerably closer to experiment than results obtained with thermal phonons. By amplifying phonon absorption, nonequilibrium phonons also hinder electron energy relaxation and lead to elevated electronic temperatures.
Investigation of quasi-one-dimensional finite phononic crystal with ...
Indian Academy of Sciences (India)
assume that the longitudinal wave propagated in the structure is a plane-wave, and the vibration of any particle on the same plane has equal amplitude and phase, i.e. the propagation of the longitudinal wave in the structure can be simplified to a 1D problem. Figure 1b shows a cell with n springs and particles connected in ...
Investigation of quasi-one-dimensional finite phononic crystal with ...
Indian Academy of Sciences (India)
... Xi'an, Shaanxi 710055, People's Republic of China; Institute of Applied Acoustics, Shaanxi Normal University, No. 199, Chang'an South Road, Xi'an, Shaanxi 710062, People's Republic of China; China Electronics Technology Group Corporation 26th Research Institute, Chongqing 400060, People's Republic of China ...
Hierarchical thermoelectrics : Crystal grain boundaries as scalable phonon scatterers
Selli, Daniele; Boulfelfel, Salah Eddine; Schapotschnikow, PZ; Donadio, Davide; Leoni, Stefano
2016-01-01
Thermoelectric materials are strategically valuable for sustainable development, as they allow for the generation of electrical energy from wasted heat. In recent years several strategies have demonstrated some efficiency in improving thermoelectric properties. Dopants affect carrier
Investigation of quasi-one-dimensional finite phononic crystal with ...
Indian Academy of Sciences (India)
The effects of lattice constant and the filling fraction on the band gap are also analysed, and the change trends of the initial frequency and cut-off frequency are consistent with those of constant section. It is shown that the results using this method are in good agreement with the results analysed by the finite element software, ...
Space-time modulations of phononic crystals (Conference Presentation)
Nassar, Hussein; Norris, Andrew; Huang, Guoliang
2017-04-01
When a set of resonators is attached to a master structure, a bandgap opens in the vicinity of the resonance frequency. Then, using piezoelectric circuitry for instance, the spring constant coupling the resonators to the structure can be tuned thus allowing to actively control the resonance frequency and subsequently the position of the bandgap. In this study, we investigate the consequences of dynamically changing the resonance frequency of a resonant metamaterial on its dispersion diagram. In particular, the resonance frequency is modulated periodically in space and in time at a uniform speed in a wave-like fashion and at low frequencies of the same order of magnitude of the resonance frequency itself. A two-scale asymptotic homogenization approach shows that the modulated resonant metamaterial effectively behave as another resonant metamaterial with a different set of resonance frequencies. Changing the modulation speed reveals interesting effective dynamics whereby the bandgaps of the original metamaterial split, move, condense and merge to form new band structures. The results are illustrated and exemplified through the analytical study of a onedimensional elastic medium coupled with a continuous distribution of spring-mass oscillators resonating at low frequencies. The conclusions point towards possible applications in breaking time-reversal symmetry, active wave control and filtering.
Soft Phonon and Central Peak Scattering in Molecular Crystal System
DEFF Research Database (Denmark)
Ellenson, W. D.; Kjems, Jørgen
1977-01-01
Elastic and inelastic neutron scattering has been used to study the continuous structural transition in chloranil at Tc=90.3 K. The transition results in a doubling of the monoclinic unit cell along the c axis and the molecular displacements correspond to a staggered rotation, ϕ, about axes...... perpendicular to the molecular planes. The temperature dependence of the order parameter, ϕ, has been determined from superlattice Bragg intensities with the result ϕ∝ (Tc−T)0.33±0.02 for 0.005
Self-consistency in the phonon space of the particle-phonon coupling model
Tselyaev, V.; Lyutorovich, N.; Speth, J.; Reinhard, P.-G.
2018-04-01
In the paper the nonlinear generalization of the time blocking approximation (TBA) is presented. The TBA is one of the versions of the extended random-phase approximation (RPA) developed within the Green-function method and the particle-phonon coupling model. In the generalized version of the TBA the self-consistency principle is extended onto the phonon space of the model. The numerical examples show that this nonlinear version of the TBA leads to the convergence of results with respect to enlarging the phonon space of the model.
Phonon limited electronic transport in Pb
DEFF Research Database (Denmark)
Rittweger, Florian; Hinsche, Nicki Frank; Mertig, Ingrid
2017-01-01
We present a fully ab initio based scheme to compute electronic transport properties, i.e. the electrical conductivity σ and thermopower S, in the presence of electron-phonon interaction. We explicitly investigate the k-dependent structure of the Éliashberg spectral function, the coupling strength......, the linewidth and the relaxation time τ. We obtain a state-dependent τ and show its necessity to reproduce the increased thermopower for temperatures below the Debye temperature, without accounting for the phonon-drag effect. Despite the detailed investigations of various k- and q-dependencies, the presented...
Phonon dispersion curves for CsCN
International Nuclear Information System (INIS)
Gaur, N.K.; Singh, Preeti; Rini, E.G.; Galgale, Jyostna; Singh, R.K.
2004-01-01
The motivation for the present work was gained from the recent publication on phonon dispersion curves (PDCs) of CsCN from the neutron scattering technique. We have applied the extended three-body force shell model (ETSM) by incorporating the effect of coupling between the translation modes and the orientation of cyanide molecules for the description of phonon dispersion curves of CsCN between the temperatures 195 and 295 K. Our results on PDCs in symmetric direction are in good agreement with the experimental data measured with inelastic neutron scattering technique. (author)
Microscopic model of a phononic refrigerator
Arrachea, Liliana; Mucciolo, Eduardo R.; Chamon, Claudio; Capaz, Rodrigo B.
2012-09-01
We analyze a simple microscopic model to pump heat from a cold to a hot reservoir in a nanomechanical system. The model consists of a one-dimensional chain of masses and springs coupled to a back gate through which a time-dependent perturbation is applied. The action of the gate creates a moving phononic barrier by locally pinning a mass. We solve the problem numerically using a nonequilibrium Green's function technique. For low driving frequencies and for sharp traveling barriers, we show that this microscopic model realizes a phonon refrigerator.
Phonon emission in a degenerate semiconductor at low lattice temperatures
International Nuclear Information System (INIS)
Midday, S.; Nag, S.; Bhattacharya, D.P.
2015-01-01
The characteristics of phonon growth in a degenerate semiconductor at low lattice temperatures have been studied for inelastic interaction of non-equilibrium electrons with the intravalley acoustic phonons. The energy of the phonon and the full form of the phonon distribution are taken into account. The results reveal significant changes in the growth characteristics compared to the same for a non-degenerate material
The role of atomic vacancies on phonon confinement in α-GeTe
Directory of Open Access Journals (Sweden)
Geetanjali Kalra
2015-04-01
Full Text Available Atomic defects and their dynamics play a vital role in controlling the behavior of non-volatile phase change memory materials used in advanced optical storage devices. Synthesis and structural analysis by XRD and Raman spectroscopy on α-GeTe single crystal with different sizes are reported. The spectroscopic measurements on micron and nano sized α-GeTe single crystal reveal the evolution of phonon confinement with crystal sizes of few hundred nanometers. The characteristic vibrational modes of bulk α-GeTe structure are found to downshift and asymmetrically broaden to lower frequency with decreasing the single crystal size. We attribute the observed downshift of Raman lines in α-GeTe is largely due to the presence of high concentration of atomic vacancies. The crystal size and temperature dependent Raman spectra provide explicitly the dynamics of vacancies on optical phonon confinement in α-GeTe structure. Thus, the observed large concentration of vacancies and their size dependency might influence the phase change phenomenon in GeTe based alloys.
Relaxation between electrons and surface phonons of a ...
Indian Academy of Sciences (India)
Abstract. The energy relaxation between the hot degenerate electrons of a homoge- neously photoexcited metal film and the surface phonons (phonon wave vectors in two dimensions) is considered under Debye approximation. The state of electrons and phonons is described by equilibrium Fermi and Bose functions with ...
Optical pumping of hot phonons in GaAs
International Nuclear Information System (INIS)
Collins, C.L.; Yu, P.Y.
1982-01-01
Optical pumping of hot LO phonons in GaAs has been studied as a function of the excitation photon frequency. The experimental results are in good agreement with a model calculation which includes both inter- and intra-valley electron-phonon scatterings. The GAMMA-L and GAMMA-X intervalley electron-phonon interactions in GaAs have been estimated
Relaxation between electrons and surface phonons of a ...
Indian Academy of Sciences (India)
The energy relaxation between the hot degenerate electrons of a homogeneously photoexcited metal film and the surface phonons (phonon wave vectors in two dimensions) is considered under Debye approximation. The state of electrons and phonons is described by equilibrium Fermi and Bose functions with different ...
Phonon frequency shift and effect of correlation on the electron ...
Indian Academy of Sciences (India)
Abstract. The electron–phonon interaction in the periodic Anderson model (PAM) is considered. The PAM incorporates the effect of onsite Coulomb interaction (U) between /-electrons. The in- fluence of Coulomb correlation U on the phonon response of the system is studied by evaluating the phonon spectral function for ...
Nebogin, S. A.; Ivanov, N. A.; Bryukvina, L. I.; V. Shipitsin, N.; E. Rzhechitskii, A.; Papernyi, V. L.
2018-05-01
In the present paper, the effect of magnesium nanoparticles implanted in a LiF crystal on the optical properties of color centers is studied. The transmittance spectra and AFM images demonstrate effective formation of the color centers and magnesium nanoparticles in an implanted layer of ∼ 60-100 nm in thickness. Under thermal annealing, a periodical structure is formed on the surface of the crystal and in the implanted layer due to self-organization of the magnesium nanoparticles. Upon excitation by argon laser with a wavelength of 488 nm at 5 K, in a LiF crystal, implanted with magnesium ions as well as in heavily γ-irradiated LiF: Mg crystals, luminescence of the color centers at λmax = 640 nm with a zero-phonon line at 601.5 nm is observed. The interaction of magnesium nanoparticles and luminescing color centers in a layer implanted with magnesium ions has been revealed. It is shown that the luminescence intensity of the implanted layer at a wavelength of 640 nm is by more than two thousand times higher than that of a heavily γ-irradiated LiF: Mg crystal. The broadening of the zero-phonon line at 601.5 nm in the spectrum of the implanted layer indicates the interaction of the emitting quantum system with local field of the surface plasmons of magnesium nanoparticles. The focus of this work is to further optimize the processing parameters in a way to result in luminescence great enhancement of color centers by magnesium nanoparticles in LiF.
Electron-phonon interactions and the phonon anomaly in β-phase NiTi
International Nuclear Information System (INIS)
Zhao, G.L.; Harmon, B.N.
1993-01-01
The electronic structure of β-phase NiTi has been calculated using a first-principles linear-combination-of-atomic-orbitals method. The resulting band structure was fitted with a nonorthogonal tight-binding Hamiltonian from which electron-phonon matrix elements were evaluated. The soft phonon near Q 0 =(2/3, 2) / (3 ,0)π/a, which is responsible for the premartensitic phase transition in β-phase NiTi, is found to arise from the strong electron-phonon coupling of nested electronic states on the Fermi surface. Thermal vibrations and changes in electronic occupation cause a smearing of the nested features, which in turn cause a hardening of the phonon anomaly
Roy, Chiranjeeb
In this thesis we study the role of nonradiative degrees of freedom on quantum optical properties of mesoscopic quantum dots placed in the structured electromagnetic reservoir of a photonic crystal. We derive a quantum theory of the role of acoustic and optical phonons in modifying the optical absorption lineshape, polarization dynamics, and population dynamics of a two-level atom (quantum dot) in the "colored" electromagnetic vacuum of a photonic band gap (PBG) material. This is based on a microscopic Hamiltonian describing both radiative and vibrational processes quantum mechanically. Phonon sidebands in an ordinary electromagnetic reservoir are recaptured in a simple model of optical phonons using a mean-field factorization of the atomic and lattice displacement operators. Our formalism is then used to treat the non-Markovian dynamics of the same system within the structured electromagnetic density of states of a photonic crystal. We elucidate the extent to which phonon-assisted decay limits the lifetime of a single photon-atom bound state and derive the modified spontaneous emission dynamics due to coupling to various phonon baths. We demonstrate that coherent interaction with undamped phonons can lead to enhanced lifetime of a photon-atom bound state in a PBG by (i) dephasing and reducing the transition electric dipole moment of the atom and (ii) reducing the quantum mechanical overlap of the state vectors of the excited and ground state (polaronic shift). This results in reduction of the steady-state atomic polarization but an increase in the fractionalized upper state population in the photon-atom bound state. We demonstrate, on the other hand, that the lifetime of the photon-atom bound state in a PBG is limited by the lifetime of phonons due to lattice anharmonicities (break-up of phonons into lower energy phonons) and purely nonradiative decay. We demonstrate how these additional damping effects limit the extent of the polaronic (Franck-Condon) shift of
Lattice and Molecular Vibrations in Single Crystal I2 at 77 K by Inelastic Neutron Scattering
DEFF Research Database (Denmark)
Smith, H. G.; Nielsen, Mourits; Clark, C. B.
1975-01-01
Phonon dispersion curves of single crystal iodine at 77 K have been measured by one-phonon coherent inelastic neutron scattering techniques. The data are analysed in terms of two Buckingham-six intermolecular potentials; one to represent the shortest intermolecular interaction (3.5 Å) and the other...
Phonon dispersion curves of CsCN
Indian Academy of Sciences (India)
Abstract. The motivation for the present work was gained from the recent publication on phonon dispersion curves (PDCs) of CsCN from the neutron scattering technique. We have applied the extended three-body force shell model (ETSM) by incorporating the effect of coupling between the translation modes and the ...
Phonon density of states in nanocrystalline Fe
Indian Academy of Sciences (India)
Kara and Rahman [10] did the cluster calculations using the interaction potential based on the embedded ... It is found that in the interior of the clusters large capillary pressure is built up and the surface tension derived .... results due to flatness of phonon dispersion relations in the transverse branch in the [111] direction at ζ ...
Phonon dispersion relation of liquid metals
Indian Academy of Sciences (India)
Abstract. The phonon dispersion curves of some liquid metals, viz. Na (Z = 1), Mg. (Z = 2), Al (Z = 3) and Pb (Z = 4), have been computed using our model potential. The charged hard sphere (CHS) reference system is applied to describe the structural information. Our model potential along with CHS reference system is ...
Time and momentum-resolved phonon decay
Reis, David
2017-04-01
The high brightness of x-ray free-electron lasers provides us a unique opportunity to measure lattice dynamics directly in the time domain and out of equilibrium. As a first step in this direction we demonstrate how ultrafast optical excitation creates temporal coherences in the mean-square phonon displacements spanning the Brillouin zone by a second-order squeezing process. This leads to broad-bandwidth high-resolution measurements of the phonon dispersion without the need for high-resolution monochromators or analyzers. We will also show how anharmonic phonon decay can be viewed as a parametric squeezing process, and present first momentum-resolved measurements of the downconversion of a coherent optical phonon into pairs of high-wavevector acoustic modes, information that cannot be obtained by spectroscopic measurements in the frequency domain. Supported by the Department of Energy, Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division, under Contract DE-AC02-76SF00515.
Magnetic polarization and two-phonon states
International Nuclear Information System (INIS)
Tsoneva, N.; Stoyanov, Ch.; Grinberg, M.; Vdovin, A.
1997-01-01
Influence of magnetic core polarization on properties of 2 - member of two-phonon quintet of states 2 1 + x 3 1 - is analyzed. Like for recently identified lowest 1 - member of this quintet, an excitation probability of 2 - state is strongly affected by polarization of the nucleus
Phonon density of states in nanocrystalline Fe
Indian Academy of Sciences (India)
Abstract. The Born–von Karman model is used to calculate phonon density of states (DOS) of nanocrystalline bcc Fe. It is found that there is an anisotropic stiffening in the interatomic force constants and hence there is shrinking in the nearest-neighbour distances in the nanophase. This leads to additional vibrational modes ...
Phononic band gap structures as optimal designs
DEFF Research Database (Denmark)
Jensen, Jakob Søndergaard; Sigmund, Ole
2003-01-01
In this paper we use topology optimization to design phononic band gap structures. We consider 2D structures subjected to periodic loading and obtain the distribution of two materials with high contrast in material properties that gives the minimal vibrational response of the structure. Both in...
Phonon affected transport through molecular quantum
Czech Academy of Sciences Publication Activity Database
Loos, Jan; Koch, T.; Alvermann, A.; Bishop, A. R.; Fehske, H.
2009-01-01
Roč. 21, č. 39 (2009), 395601/1-395601/18 ISSN 0953-8984 Institutional research plan: CEZ:AV0Z10100521 Keywords : quantum dots * electron - phonon interaction * polarons Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 1.964, year: 2009
Phonon heat transport in gallium arsenide
Indian Academy of Sciences (India)
The energy linewidth is found to be an extremely sensitive quantity in the transport phenomena of crystalline solids as a collection of large number of scattering processes, namely, boundary scattering, impurity scattering, multiphonon scattering, interference scattering, electron–phonon processes and resonance scattering.
Structure factors and phonon dispersion in liquid
Indian Academy of Sciences (India)
Technology and Engineering, M.S. University of Baroda, Vadodara 390 001, India. 2Electronics Department, Narmada College of Science and Commerce, Bharuch 392 011,. India. E-mail: apratapmsu@yahoo.com. Abstract. The phonon spectra for liquid Li and Na have been computed through the phenomenological model ...
``Forbidden'' phonon in the iron chalcogenide series
Fobes, David M.; Zaliznyak, Igor A.; Xu, Zhijun; Gu, Genda; Tranquada, John M.
2015-03-01
Recently, we uncovered evidence for the formation of a bond-order wave (BOW) leading to ferro-orbital order at low temperature, acting to stabilize the bicollinear AFM order, in the iron-rich parent compound, Fe1+yTe. Investigating the inelastic spectra centered near (100) in Fe1+yTe, a signature peak for the BOW formation in the monoclinic phase, we observed an acoustic phonon dispersion in both tetragonal and monoclinic phases. While a structural Bragg peak accompanies the mode in the monoclinic phase, in the tetragonal phase Bragg scattering at this Q is forbidden by symmetry, and we observed no elastic peak. This phonon mode was also observed in superconducting FeTe0.6Se0.4, where structural and magnetic transitions are suppressed. LDA frozen phonon calculations suggested that this mode could result from a spin imbalance between neighboring Fe atoms, but polarized neutron measurements revealed no additional magnetic scattering. We propose that this ``forbidden'' phonon mode may originate from dynamically broken symmetry, perhaps related to the strong dynamic spin correlations in these materials. Work at BNL was supported by BES, US DOE, under Contract No. DE-AC02-98CH10886. Research at ORNL's HFIR and SNS sponsored by Scientific User Facilities Division, BES, US DOE. We acknowledge the support of NIST, in providing neutron research facilities.
Phonon scattering in graphene over substrate steps
DEFF Research Database (Denmark)
Sevincli, Haldun; Brandbyge, Mads
2014-01-01
We calculate the effect on phonon transport of substrate-induced bends in graphene. We consider bending induced by an abrupt kink in the substrate, and provide results for different step-heights and substrate interaction strengths. We find that individual substrate steps reduce thermal conductance...
Directory of Open Access Journals (Sweden)
Y. Ishikawa
2015-04-01
Full Text Available Neutron diffraction measurement of powder α-Fe sample at 295 K was carried out at the high resolution powder diffractometer installed at Japan Proton Accelerator Research Complex (J-PARC. Crystal parameters were determined from Rietveld analysis. The correlation effects among thermal displacements of atoms were estimated from a generalized equation based on the results of fomer diffuse scattering analysis. The force constants among atoms were obtained using an equation for transforming of the correlation effects to force constants. The force constants and the crystal structure of α-Fe were used to estimate the phonon dispersion relations, phonon density of states, and specific heat by computer simulation. The obtained force constants among first-nearest-neighboring atoms is 2.3 eV/Å2 at 295 K and the specific heat is 185 meV/K at 150 K. The calculated phonon dispersion relations and specific heat of α-Fe are similar to those obtained from inelastic neutron scattering and specific heat measurements, respectively
Optical phonon scattering on electronic mobility in Al2O3/AlGaN/AlN/GaN heterostructures
Zhou, X. J.; Qu, Y.; Ban, S. L.; Wang, Z. P.
2017-12-01
Considering the built-in electric fields and the two-mode property of transverse optical phonons in AlGaN material, the electronic eigen-energies and wave functions are obtained by solving Schrödinger equation with the finite difference method. The dispersion relations and potentials of the optical phonons are given by the transfer matrix method. The mobility of the two dimensional electron gas influenced by the optical phonons in Al2O3/AlGaN/AlN/GaN heterostructures is investigated based on the theory of Lei-Ting force balance equation. It is found that the scattering from the half-space phonons is the main factor affecting the electronic mobility, and the influence of the other phonons can be ignored. The results show that the mobility decreases with increasing the thicknesses of Al2O3 and AlN layers, but there is no definite relationship between the mobility and the thickness of AlGaN barrier. The mobility is obviously reduced by increasing Al component in AlGaN crystal to show that the effect of ternary mixed crystals is important. It is also found that the mobility increases first and then decreases as the increment of the fixed charges, but decreases always with increasing temperature. The heterostructures constructed here can be good candidates as metal-oxide-semiconductor high-electron-mobility-transistors since they have higher electronic mobility due to the influence from interface phonons weakened by the AlN interlayer.
Soft and isotropic phonons in PrFeAsO1-y
Fukuda, T.; Baron, A. Q. R.; Nakamura, H.; Shamoto, S.; Ishikado, M.; Machida, M.; Uchiyama, H.; Iyo, A.; Kito, H.; Mizuki, J.; Arai, M.; Eisaki, H.
2011-08-01
Phonons in single crystals of PrFeAsO1-y are investigated using high-resolution inelastic x-ray scattering and ab initio pseudopotential calculations. Extensive measurements of several samples (ỹ0, 0.1 and 0.3) at temperatures spanning the magnetic ordering temperature (TN˜145 K for ỹ 0) and the superconducting transition temperature (Tc=36 K for ỹ0.1 and Tc=45 K for ỹ 0.3) show that there are some changes in phonon spectra with temperature and/or doping. We compare our measurements with several ab initio pseudopotential models (nonmagnetic tetragonal, oxygen-deficient O7/8 supercell, magnetic orthorhombic, and magnetic tetragonal) and find that the experimentally observed changes are much smaller than the differences between the experimental data and the calculations. Agreement is improved if magnetism is included in the calculations via the local spin density approximation, as the Fe atomic motions parallel to the ferromagnetic ordering direction are softened. However, the antiferromagnetically polarized modes remain hard, and in disagreement with the experimental data. In fact, given the increasing evidence for anisotropy in the iron pnictide materials, the phonon response is surprisingly isotropic. We consider several modifications of the ab initio calculations to improve the agreement with the experimental data. Improved agreement is found by setting the matrix to zero (clipping the bond) between nearest-neighbor antiferromagnetically aligned Fe atoms in the magnetic calculation, or by softening only the in-plane nearest-neighbor Fe-As force constant in the nonmagnetic calculation. We discuss these results in the context of other measurements, especially of phonons, for several FeAs systems. Fluctuating magnetism may be a partial explanation for the failure of the calculations, but seems incomplete in the face of the similarity of the measured phonon response in all the systems investigated here including those known to have static magnetism.
The lattice dynamical studies of rare earth compounds: electron-phonon interactions
International Nuclear Information System (INIS)
Jha, Prafulla K.; Sanyal, Sankar P.; Singh, R.K.
2002-01-01
During the last two decades chalcogenides and pnictides of rare earth (RE) atoms have drawn considerable attention of the solid state physicists because of their peculiar electronic, magnetic, optical and phonon properties. Some of these compounds e.g. sulphides and selenides of cerium (Ce), samarium (Sm), yttrium (Y), ytterbium (Yb), europium (Eu) and thulium (Tm) and their alloys show nonintegral valence (between 2 and 3), arising due to f-d electron hybridization at ambient temperature and pressure. The rare earth mixed valence compounds (MVC) reviewed in this article crystallize in simple cubic structure. Most of these compounds show the existence of strong electron-phonon coupling at half way to the zone boundary. This fact manifests itself through softening of the longitudinal acoustic mode, negative value of elastic constant C 12 etc. The purpose of this contribution is to review some of the recent activities in the fields of lattice dynamics and allied properties of rare earth compounds. The present article is primarily devoted to review the effect of electron-phonon interactions on the dynamical properties of rare earth compounds by using the lattice dynamical model theories based on charged density deformations and long-range many body forces. While the long range charge transfer effect arises due to f-d hybridization of nearly degenerate 4f-5d bands of rare earth ions, the density deformation comes into the picture of breathing motion of electron shells. These effects of charge transfer and charge density deformation when considered in the lattice dynamical models namely the three body force rigid ion model (TRM) and breathing shell model (BSM) are quite successful in explaining the phonon anomalies in these compounds and undoubtedly unraveled many important physical process governing the phonon anomalies in rare earth compounds
Reducing support loss in micromechanical ring resonators using phononic band-gap structures
Energy Technology Data Exchange (ETDEWEB)
Hsu, Feng-Chia; Huang, Tsun-Che; Wang, Chin-Hung; Chang, Pin [Industrial Technology Research Institute-South, Tainan 709, Taiwan (China); Hsu, Jin-Chen, E-mail: fengchiahsu@itri.org.t, E-mail: hsujc@yuntech.edu.t [Department of Mechanical Engineering, National Yunlin University of Science and Technology, Douliou, Yunlin 64002, Taiwan (China)
2011-09-21
In micromechanical resonators, energy loss via supports into the substrates may lead to a low quality factor. To eliminate the support loss, in this paper a phononic band-gap structure is employed. We demonstrate a design of phononic-crystal (PC) strips used to support extensional wine-glass mode ring resonators to increase the quality factor. The PC strips are introduced to stop elastic-wave propagation by the band-gap and deaf-band effects. Analyses of resonant characteristics of the ring resonators and the dispersion relations, eigenmodes, and transmission properties of the PC strips are presented. With the proposed resonator architecture, the finite-element simulations show that the leaky power is effectively reduced and the stored energy inside the resonators is enhanced simultaneously as the operating frequencies of the resonators are within the band gap or deaf bands. Realization of a high quality factor micromechanical ring resonator with minimized support loss is expected.
Sensitive Phonon-Based Probe for Structure Identification of 1T' MoTe2.
Zhou, Lin; Huang, Shengxi; Tatsumi, Yuki; Wu, Lijun; Guo, Huaihong; Bie, Ya-Qing; Ueno, Keiji; Yang, Teng; Zhu, Yimei; Kong, Jing; Saito, Riichiro; Dresselhaus, Mildred
2017-06-28
In this work, by combining transmission electron microscopy and polarized Raman spectroscopy for the 1T' MoTe 2 flakes with different thicknesses, we found that the polarization dependence of Raman intensity is given as a function of excitation laser wavelength, phonon symmetry, and phonon frequency, but has weak dependence on the flake thickness from few-layer to multilayer. In addition, the frequency of Raman peaks and the relative Raman intensity are sensitive to flake thickness, which manifests Raman spectroscopy as an effective probe for thickness of 1T' MoTe 2 . Our work demonstrates that polarized Raman spectroscopy is a powerful and nondestructive method to quickly identify the crystal structure and thickness of 1T' MoTe 2 simultaneously, which opens up opportunities for the in situ probe of anisotropic properties and broad applications of this novel material.
A Numerical Analysis of Phononic-Assisted Control of Ultrasound Waves in Acoustofluidic Device
Moiseyenko, Rayisa P.; Bruus, Henrik
The ability to precisely sort individual microparticles/cells/droplets in suspension is important for various chemical and biological applications such as cancer cell detection, drug screening etc. The past decade, label- free particle handling of particle suspensions by ultrasonic radiation forces and streaming has received much attention, since it relies solely on mechanical properties such as particle size and contrast in density and compressibility. We present a theoretical study of phononic-assisted control of ultrasound waves in acoustofluidic devices. We propose the use of phononic crystal diffractors, which can be introduced in acoustofluidic structures. These diffractors can be applied in the design of efficient resonant cavities, directional sound waves for new types of particle sorting methods, or acoustically controlled deterministic lateral displacement. The PnC-diffractor-based devices can be made configurable, by embedding the diffractors, all working at the same excitation frequency but with different resulting diffraction patterns, in exchangeable membranes on top of the device.
Dual gauge field theory of quantum liquid crystals in two dimensions
Beekman, Aron J.; Nissinen, Jaakko; Wu, Kai; Liu, Ke; Slager, Robert-Jan; Nussinov, Zohar; Cvetkovic, Vladimir; Zaanen, Jan
2017-04-01
We present a self-contained review of the theory of dislocation-mediated quantum melting at zero temperature in two spatial dimensions. The theory describes the liquid-crystalline phases with spatial symmetries in between a quantum crystalline solid and an isotropic superfluid: quantum nematics and smectics. It is based on an Abelian-Higgs-type duality mapping of phonons onto gauge bosons (;stress photons;), which encode for the capacity of the crystal to propagate stresses. Dislocations and disclinations, the topological defects of the crystal, are sources for the gauge fields and the melting of the crystal can be understood as the proliferation (condensation) of these defects, giving rise to the Anderson-Higgs mechanism on the dual side. For the liquid crystal phases, the shear sector of the gauge bosons becomes massive signaling that shear rigidity is lost. After providing the necessary background knowledge, including the order parameter theory of two-dimensional quantum liquid crystals and the dual theory of stress gauge bosons in bosonic crystals, the theory of melting is developed step-by-step via the disorder theory of dislocation-mediated melting. Resting on symmetry principles, we derive the phenomenological imaginary time actions of quantum nematics and smectics and analyze the full spectrum of collective modes. The quantum nematic is a superfluid having a true rotational Goldstone mode due to rotational symmetry breaking, and the origin of this 'deconfined' mode is traced back to the crystalline phase. The two-dimensional quantum smectic turns out to be a dizzyingly anisotropic phase with the collective modes interpolating between the solid and nematic in a non-trivial way. We also consider electrically charged bosonic crystals and liquid crystals, and carefully analyze the electromagnetic response of the quantum liquid crystal phases. In particular, the quantum nematic is a real superconductor and shows the Meissner effect. Their special properties
Phonon Scattering and Confinement in Crystalline Films
Parrish, Kevin D.
The operating temperature of energy conversion and electronic devices affects their efficiency and efficacy. In many devices, however, the reference values of the thermal properties of the materials used are no longer applicable due to processing techniques performed. This leads to challenges in thermal management and thermal engineering that demand accurate predictive tools and high fidelity measurements. The thermal conductivity of strained, nanostructured, and ultra-thin dielectrics are predicted computationally using solutions to the Boltzmann transport equation. Experimental measurements of thermal diffusivity are performed using transient grating spectroscopy. The thermal conductivities of argon, modeled using the Lennard-Jones potential, and silicon, modeled using density functional theory, are predicted under compressive and tensile strain from lattice dynamics calculations. The thermal conductivity of silicon is found to be invariant with compression, a result that is in disagreement with previous computational efforts. This difference is attributed to the more accurate force constants calculated from density functional theory. The invariance is found to be a result of competing effects of increased phonon group velocities and decreased phonon lifetimes, demonstrating how the anharmonic contribution of the atomic potential can scale differently than the harmonic contribution. Using three Monte Carlo techniques, the phonon-boundary scattering and the subsequent thermal conductivity reduction are predicted for nanoporous silicon thin films. The Monte Carlo techniques used are free path sampling, isotropic ray-tracing, and a new technique, modal ray-tracing. The thermal conductivity predictions from all three techniques are observed to be comparable to previous experimental measurements on nanoporous silicon films. The phonon mean free paths predicted from isotropic ray-tracing, however, are unphysical as compared to those predicted by free path sampling
Falvo, Cyril
2018-02-01
The theory of linear and non-linear infrared response of vibrational Holstein polarons in one-dimensional lattices is presented in order to identify the spectral signatures of self-trapping phenomena. Using a canonical transformation, the optical response is computed from the small polaron point of view which is valid in the anti-adiabatic limit. Two types of phonon baths are considered: optical phonons and acoustical phonons, and simple expressions are derived for the infrared response. It is shown that for the case of optical phonons, the linear response can directly probe the polaron density of states. The model is used to interpret the experimental spectrum of crystalline acetanilide in the C=O range. For the case of acoustical phonons, it is shown that two bound states can be observed in the two-dimensional infrared spectrum at low temperature. At high temperature, analysis of the time-dependence of the two-dimensional infrared spectrum indicates that bath mediated correlations slow down spectral diffusion. The model is used to interpret the experimental linear-spectroscopy of model α-helix and β-sheet polypeptides. This work shows that the Davydov Hamiltonian cannot explain the observations in the NH stretching range.
Cerenkov emission of acoustic phonons electrically generated from three-dimensional Dirac semimetals
Energy Technology Data Exchange (ETDEWEB)
Kubakaddi, S. S., E-mail: sskubakaddi@gmail.com [Department of Physics, Karnatak University, Dharwad 580 003, Karnataka (India)
2016-05-21
Cerenkov acoustic phonon emission is theoretically investigated in a three-dimensional Dirac semimetal (3DDS) when it is driven by a dc electric field E. Numerical calculations are made for Cd{sub 3}As{sub 2} in which mobility and electron concentration are large. We find that Cerenkov emission of acoustic phonons takes place when the electron drift velocity v{sub d} is greater than the sound velocity v{sub s}. This occurs at small E (∼few V/cm) due to large mobility. Frequency (ω{sub q}) and angular (θ) distribution of phonon emission spectrum P(ω{sub q}, θ) are studied for different electron drift velocities v{sub d} (i.e., different E) and electron concentrations n{sub e}. The frequency dependence of P(ω{sub q}, θ) shows a maximum P{sub m}(ω{sub q}, θ) at about ω{sub m} ≈ 1 THz and is found to increase with the increasing v{sub d} and n{sub e}. The value of ω{sub m} shifts to higher region for larger n{sub e}. It is found that ω{sub m}/n{sub e}{sup 1/3} and P{sub m}(ω{sub q}, θ)/n{sub e}{sup 2/3} are nearly constants. The latter is in contrast with the P{sub m}(ω{sub q}, θ)n{sub e}{sup 1/2 }= constant in conventional bulk semiconductor. Each maximum is followed by a vanishing spectrum at nearly “2k{sub f} cutoff,” where k{sub f} is the Fermi wave vector. Angular dependence of P(ω{sub q}, θ) and the intensity P(θ) of the phonon emission shows a maximum at an emission angle 45° and is found to increase with increasing v{sub d}. P(θ) is found to increase linearly with n{sub e} giving the ratio P(θ)/(n{sub e}v{sub d}) nearly a constant. We suggest that it is possible to have the controlled Cerenkov emission and generation of acoustic phonons with the proper choice of E, θ, and n{sub e}. 3DDS with large n{sub e} and mobility can be a good source of acoustic phonon generation in ∼THz regime.
International Nuclear Information System (INIS)
Bulat, Lev P.; Osvenskii, Vladimir B.; Parkhomenko, Yurii N.; Pshenay-Severin, Dmitry A.
2012-01-01
One of the possible ways to increase the thermoelectric figure of merit is the use of bulk nanostructured materials fabricated by melt spinning with subsequent hot pressing or spark plasma sintering. Among a variety of nanostructure types these materials contain regions of initial solid solution with nanometer sized inclusions of different compositions. In the present work the scattering of holes and phonons on nanoinclusions in such p-Bi x Sb 1−x Te 3 based materials is considered. The change of transport coefficients due to this scattering mechanism is theoretically estimated. The estimations showed that the reduction of lattice thermal conductivity (about 12–13%) for nanoinclusions of Bi 2 Te 3 –Sb 2 Te 3 solid solution with different compositions is much greater than the change in power factor. Therefore the corresponding increase of the thermoelectric figure of merit for this case is determined mainly by phonon scattering. Also it is shown that the results of estimations depend on phonon spectrum approximation, e.g. in the case of sine-shaped instead of linear phonon spectrum the estimations give two times higher thermal conductivity reduction. - Graphical abstract: Relative phonon thermal conductivity κ ph change (black line) due to nanoinclusion scattering versus nanoinclusion radius a, and relative thermoelectric power factor change (red line) due to nanoinclusion scattering versus chemical potential μ at nanoinclusion size a=1.5 nm and U 0 =−0.146 eV. Highlights: ► p-Bi x Sb 1−x Te 3 solid solutions with nanosized inclusions were considered. ► Selective hole scattering can increase power factor at high carrier concentrations. ► Lattice thermal conductivity estimations depend on phonon spectrum approximation. ► Phonon scattering can reduce lattice thermal conductivity by about 12–13%. ► The latter factor mainly determines the increase of thermoelectric efficiency.
Directory of Open Access Journals (Sweden)
Garkavenko A. S.
2011-11-01
Full Text Available There was investigated the influence of excitation level and temperature on the radiation parameters of lasers based on n-type GaAs crystals with high optical homogeneity, modified with the use of radiotechnologies.
Understanding photon sideband statistics and correlation for determining phonon coherence
Ding, Ding; Yin, Xiaobo; Li, Baowen
2018-01-01
Generating and detecting coherent high-frequency heat-carrying phonons have been topics of great interest in recent years. Although there have been successful attempts in generating and observing coherent phonons, rigorous techniques to characterize and detect phonon coherence in a crystalline material have been lagging compared to what has been achieved for photons. One main challenge is a lack of detailed understanding of how detection signals for phonons can be related to coherence. The quantum theory of photoelectric detection has greatly advanced the ability to characterize photon coherence in the past century, and a similar theory for phonon detection is necessary. Here, we reexamine the optical sideband fluorescence technique that has been used to detect high-frequency phonons in materials with optically active defects. We propose a quantum theory of phonon detection using the sideband technique and found that there are distinct differences in sideband counting statistics between thermal and coherent phonons. We further propose a second-order correlation function unique to sideband signals that allows for a rigorous distinction between thermal and coherent phonons. Our theory is relevant to a correlation measurement with nontrivial response functions at the quantum level and can potentially bridge the gap of experimentally determining phonon coherence to be on par with that of photons.
Structural Properties and Phonon dispertion of NACl
Directory of Open Access Journals (Sweden)
R. Khoda-Bakhsh
2001-06-01
Full Text Available Although many phenomena in condensed matter Physics can be understood on the basis of a model, there are also considerable number of physical properties of solid which can not be explained except in the framework of lattice dynamics. We have calculated the phonon frequencies of Na Cl, using an approach which is a combination of frozen phonon and force constants methods in the framework of density functional pseudopotential theory. The dispersion relation curves, were calculated along symmetry direction Δ, Σ and Ù. We also calculated Grunesein parameters for all modes at X and L points in Brillion zone. The calcutions are made in the framework of density functional and pseudopotential theory, using super cell method, with the valence orbitals expanded in plane waves.
Electron and Phonon Transport in Molecular Junctions
DEFF Research Database (Denmark)
Li, Qian
transmission at the Fermi energy. We propose and analyze a way of using π stacking to design molecular junctions to control heat transport. We develop a simple model system to identify optimal parameter regimes and then use density functional theory (DFT) to extract model parameters for a number of specific......Molecular electronics provide the possibility to investigate electron and phonon transport at the smallest imaginable scale, where quantum effects can be investigated and exploited directly in the design. In this thesis, we study both electron transport and phonon transport in molecular junctions....... The system we are interested in here are π-stacked molecules connected with two semi-infinite leads. π-stacked aromatic rings, connected via π-π electronic coupling, provides a rather soft mechanical bridge while maintaining high electronic conductivity. We investigate electron transport...
Phonon dispersion relations for caesium thiocyanate
International Nuclear Information System (INIS)
Irving, M.A.; Smith, T.F.; Elcombe, M.M.
1984-01-01
Room temperature phonon dispersion relations for frequencies below 2 THz have been measured, along the three orthorhombic axes and selected diagonal directions by neutron inelastic scattering, for caesium thiocyanate. These curves, which represent 13 acoustic modes and 11 optic modes of vibration, do not agree with the dispersion behaviour calculated from the rigid-ion model developed by Ti and Ra to describe their Raman scattering observations
Quantum mode phonon forces between chainmolecules
DEFF Research Database (Denmark)
Bohr, Jakob
2001-01-01
A phenomenological description of the contributions of phonons to molecular force is developed. It uses an approximation to consider macromolecules as solid continua. The molecular modes of a molecule can then be characterized by a Debye-like description of the partition function. The resulting b....... For the later case, a significant change in zero-point energy is found. This may be the underlying cause for cold denaturation of proteins. (C) 2001 John Wiley & Sons, Inc....
Phonons: Theory and experiments II. Volume 2
International Nuclear Information System (INIS)
Bruesch, P.
1986-01-01
The present second volume titled as ''Phonons: Theory and Experiments II'', contains, a thorough study of experimental techniques and the interpretation of experimental results. This three-volume set tries to bridge the gap between theory and experiment, and is addressed to those working in both camps in the vast field of dynamical properties of solids. Topics presented in the second volume include; infrared-, Raman and Brillouin spectroscopy, interaction of X-rays with phonons, and inelastic neutron scattering. In addition an account is given of some other techniques, including ultrasonic methods, inelastic electron tunneling spectroscopy, point contact spectroscopy, and spectroscopy of surface phonons, thin films and adsorbates. Both experimental aspects and theoretical concepts necessary for the interpretation of experimental data are discussed. An attempt is made to present the descriptive as well as the analytical aspects of the topics. Simple models are often used to illustrate the basic concepts and more than 100 figures are included to illustrate both theoretical and experimental results. Many chapters contain a number of problems with hints and results giving additional information
Energy Technology Data Exchange (ETDEWEB)
Kandemir, B S; Keskin, M [Department of Physics, Faculty of Sciences, Ankara University, 06100 Tandogan, Ankara (Turkey)
2008-08-13
In this paper, exact analytical expressions for the entire phonon spectra in single-walled carbon nanotubes with zigzag geometry are presented by using a new approach, originally developed by Kandemir and Altanhan. This approach is based on the concept of construction of a classical lattice Hamiltonian of single-walled carbon nanotubes, wherein the nearest and next nearest neighbor and bond bending interactions are all included, then its quantization and finally diagonalization of the resulting second quantized Hamiltonian. Furthermore, within this context, explicit analytical expressions for the relevant electron-phonon interaction coefficients are also investigated for single-walled carbon nanotubes having this geometry, by the phonon modulation of the hopping interaction.
International Nuclear Information System (INIS)
Kandemir, B S; Keskin, M
2008-01-01
In this paper, exact analytical expressions for the entire phonon spectra in single-walled carbon nanotubes with zigzag geometry are presented by using a new approach, originally developed by Kandemir and Altanhan. This approach is based on the concept of construction of a classical lattice Hamiltonian of single-walled carbon nanotubes, wherein the nearest and next nearest neighbor and bond bending interactions are all included, then its quantization and finally diagonalization of the resulting second quantized Hamiltonian. Furthermore, within this context, explicit analytical expressions for the relevant electron-phonon interaction coefficients are also investigated for single-walled carbon nanotubes having this geometry, by the phonon modulation of the hopping interaction
Measurement of the velocity of sound in crystals by pulsed neutron diffraction
International Nuclear Information System (INIS)
Willis, B.T.M.; Carlile, C.J.; Ward, R.C.; David, W.I.F.; Johnson, M.W.
1986-03-01
The diffraction method of observing elementary excitations in crystals has been applied to the study of one-phonon thermal diffuse scattering from pyrolytic graphite on a high resolution pulsed neutron diffractometer. The variation of the phase velocity of sound as a function of direction in the crystal and efficient method of determining sound velocities in crystals under extreme conditions. (author)
NATO Advanced Study Institute on Nonequilibrium Phonon Dynamics
1985-01-01
Phonons are always present in the solid state even at an absolute temperature of 0 K where zero point vibrations still abound. Moreover, phonons interact with all other excitations of the solid state and, thereby, influence most of its properties. Historically experimental information on phonon transport came from measurements of thermal conductivity. Over the past two decades much more, and much more detailed, information on phonon transport and on many of the inherent phonon interaction processes have come to light from experiments which use nonequilibrium phonons to study their dynamics. The resultant research field has most recently blossomed with the development of ever more sophisticated experimental and theoretical methods which can be applied to it. In fact, the field is moving so rapidly that new members of the research community have difficulties in keeping up to date. This NATO Advanced Study Institute (ASI) was organized with the objective of overcoming the information barrier between those expert...
Phonon hydrodynamics for nanoscale heat transport at ordinary temperatures
Guo, Yangyu; Wang, Moran
2018-01-01
The classical Fourier's law fails in extremely small and ultrafast heat conduction even at ordinary temperatures due to strong thermodynamic nonequilibrium effects. In this work, a macroscopic phonon hydrodynamic equation beyond Fourier's law with a relaxation term and nonlocal terms is derived through a perturbation expansion to the phonon Boltzmann equation around a four-moment nonequilibrium solution. The temperature jump and heat flux tangential retardant boundary conditions are developed based on the Maxwell model of the phonon-boundary interaction. Extensive steady-state and transient nanoscale heat transport cases are modeled by the phonon hydrodynamic model, which produces quantitative predictions in good agreement with available phonon Boltzmann equation solutions and experimental results. The phonon hydrodynamic model provides a simple and elegant mathematical description of non-Fourier heat conduction with a clear and intuitive physical picture. The present work will promote deeper understanding and macroscopic modeling of heat transport in extreme states.
Frictional drag between quantum wells mediated by phonon exchange
DEFF Research Database (Denmark)
Bønsager, M.C.; Flensberg, Karsten; Hu, Ben Yu-Kuang
1998-01-01
We use the Kubo formalism to evaluate the contribution of acoustic-phonon exchange to the frictional drag between nearby two-dimensional electron systems. In the case of free phonons, we find a divergent drag rate (tau(D)(-l)). However, tau(D)(-l) becomes finite when phonon scattering from either...... lattice imperfections or electronic excitations is accounted for. In the case of GaAs quantum wells, we find that for a phonon mean free path l(ph) smaller than a critical value, imperfection scattering dominates and the drag rate varies as ln(l(ph)/d) over many orders of magnitude of the layer separation...... d. When l(ph) exceeds the critical value, the drag rate is dominated by coupling through an electron-phonon collective mode localized in the vicinity of the electron layers. We argue that the coupled electron-phonon mode may be observable for realistic parameters. Our theory is in good agreement...
Spin-phonon coupling in Gd(Co.sub.1/2./sub.Mn.sub.1/2./sub.)O.sub.3./sub. perovskite
Czech Academy of Sciences Publication Activity Database
Silva, R.X.; Reichlová, Helena; Martí, Xavier; Barbosa, D.A.B.; Lufaso, M. W.; Araujo, B.S.; Ayala, A.P.; Paschoal, C.W.A.
2013-01-01
Roč. 114, č. 19 (2013), "194102-1"-"194102-4" ISSN 0021-8979 Institutional support: RVO:68378271 Keywords : dielectric oxides * phonons * ferromagnetism * raman spectra * crystal structure * multiferroics Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 2.185, year: 2013
Yang, Jia-Yue; Cheng, Long; Hu, Ming
2017-12-01
Intermetallic clathrates, one class of guest-host systems with perfectly crystalline structures, hold great potential to be the "phonon glass - electron crystal" thermoelectric materials. Previous studies focus on revealing the atomistic origins of blocked phononic transport, yet little attention is drawn to the enhanced electronic transport. In this work, we investigate the binary type-I M8Si46 (M = Sr, Ba, Tl, and Pb) clathrates and unravel how rattlers concurrently block phononic transport and enhance electronic transport from first-principles. By comparing the empty and filled clathrates, the lattice thermal conductivity is greatly reduced by a factor of 21 due to the decrease in phonon relaxation time for propagative phonons over 0-6 THz by 1.5 orders of magnitude. On the other hand, rattlers bridge charge gaps among cages by donating electrons and thus drastically increase electrical conductivity. The concurrent realization of blocked phononic transport and enhanced electronic transport boosts the figure-of-merit (ZT) of empty clathrate by 4 orders of magnitude. Furthermore, by manipulating metallic rattlers and n-type doping, the power factor is markedly improved and ZT can reach 0.55 at 800 K. These results provide a quantitative description of the guest-host interaction and coupling dynamics from first-principles. The proposed strategy of manipulating ratting atoms and in-situ doping offers important guidance to engineer clathrates with high thermoelectric performance.
Phonon-assisted tunneling and its dependence on pressure
International Nuclear Information System (INIS)
Roy, P.N.; Singh, A.P.; Thakur, B.N.
1999-01-01
First the mechanism of phonon-assisted tunneling has been investigated. The indirect tunnel current density has been computed after taking the amplitude of the time dependent perturbation as the energy of the lattice vibration. Later the pressure dependence of the phonon-assisted tunnel current has been computed using Payne's expression for the dependence of phonon frequency on pressure. Very good qualitative agreements are obtained between predicted and observed characteristics. (author)
Acoustic phonon dispersion of CoSi2
International Nuclear Information System (INIS)
Weiss, L.; Rumyantsev, A.Yu.; Ivanov, A.S.
1985-01-01
The acoustical phonon dispersion curves of CoSi 2 are measured at room temperature along the main symmetry directions by means of coherent one-phonon scattering of thermal neutrons. The dispersion curves are compared with those of Ge, Si, and the fluorite structure types as CaF 2 and UO 2 . From the slope of the phonon dispersion curves at the GAMMA-point the elastic constants have been obtained
Computational modeling of geometry dependent phonon transport in silicon nanostructures
Cheney, Drew A.
Recent experiments have demonstrated that thermal properties of semiconductor nanostructures depend on nanostructure boundary geometry. Phonons are quantized mechanical vibrations that are the dominant carrier of heat in semiconductor materials and their aggregate behavior determine a nanostructure's thermal performance. Phonon-geometry scattering processes as well as waveguiding effects which result from coherent phonon interference are responsible for the shape dependence of thermal transport in these systems. Nanoscale phonon-geometry interactions provide a mechanism by which nanostructure geometry may be used to create materials with targeted thermal properties. However, the ability to manipulate material thermal properties via controlling nanostructure geometry is contingent upon first obtaining increased theoretical understanding of fundamental geometry induced phonon scattering processes and having robust analytical and computational models capable of exploring the nanostructure design space, simulating the phonon scattering events, and linking the behavior of individual phonon modes to overall thermal behavior. The overall goal of this research is to predict and analyze the effect of nanostructure geometry on thermal transport. To this end, a harmonic lattice-dynamics based atomistic computational modeling tool was created to calculate phonon spectra and modal phonon transmission coefficients in geometrically irregular nanostructures. The computational tool is used to evaluate the accuracy and regimes of applicability of alternative computational techniques based upon continuum elastic wave theory. The model is also used to investigate phonon transmission and thermal conductance in diameter modulated silicon nanowires. Motivated by the complexity of the transmission results, a simplified model based upon long wavelength beam theory was derived and helps explain geometry induced phonon scattering of low frequency nanowire phonon modes.
Phonon excitation and instabilities in biased graphene nanoconstrictions
DEFF Research Database (Denmark)
Gunst, Tue; Lu, Jing Tao; Hedegård, Per
2013-01-01
We investigate how a high current density perturbs the phonons in a biased graphene nanoconstriction coupled to semi-infinite electrodes. The coupling to electrode phonons, electrode electrons under bias, Joule heating, and current-induced forces is evaluated using first principles density...... to the presence of negatively damped phonons driven by the current. The effects may limit the stability and capacity of graphene nanoconstrictions to carry high currents....
Spin waves and phonons in a paraelectric antiferromagnet EuTiO3
Cao, Huibo; Hong, Jiawang; Delaire, Olivier; Hahn, Steven; Ehlers, Georg; Chi, Songxue; Garlea, Vasile; Fernandez-Baca, Jaime; Chakoumakos, Bryan; Yan, Jiaqiang; Sales, Brian
2015-03-01
Perovskite titanates ATiO3 (A=Ba,Pb,Sr,Ca,Cd,or Eu) are widely studied for their interesting instabilities and broad applications. A ferroelectric (FE) transition occurs in Ba, Pb, and Cd titanates, but not in SrTiO3 (STO) or EuTiO3 (ETO). In the case of STO, fluctuations yield a quantum paraelectric state, but whether ETO is quantum paraelectric remains an open question. Despite a number of similarities with well-studied STO, ETO is also unique owing to the magnetic Eu ions. By applying a tuning parameter, such as bi-axial tension, ETO can be turned into a FE ferromagnet, the ideal multiferroic. [J. H. Lee, et al., Nature 466, 954 (2010)] Studies of spin-spin and spin-lattice couplings in ETO are of great interest not only from a fundamental standpoint, but also for technological applications. We successfully grew a large, high-quality isotopically-enriched ETO crystal for neutron scattering. The crystal and magnetic structures were characterized with single crystal diffraction at HB-3A at HFIR at ORNL. The spin waves and phonons were measured in the temperature range of 1.5-400 K with CNCS at SNS and HB-3 at HFIR at ORNL. In this presentation, we will discuss structural instabilities, spin-spin interactions, and spin-phonon couplings in ETO. This work was supported by Office of Basic Energy Sciences, U.S. Department of Energy.
Eom, Intae; Yoon, Eunjin; Baik, Sung-Hoon; Lim, Yong-Sik; Joo, Taiha
2014-12-15
Femtosecond time-resolved signals often display oscillations arising from the nuclear and electronic wave packet motions. Fourier power spectrum is generally used to retrieve the frequency spectrum. We have shown by numerical simulations and coherent phonon spectrum of single walled carbon nanotubes (SWCNT) that the Fourier power spectrum may not be appropriate to obtain the spectrum, when the peaks overlap with varying phases. Linear prediction singular value decomposition (LPSVD) can be a good alternative for this case. We present a robust way to perform LPSVD analysis and demonstrate the method for the chirality assignment of SWCNT through the time-domain coherent phonon spectroscopy.
Phonon-assisted decoherence and tunneling in quantum dot molecules
DEFF Research Database (Denmark)
Grodecka-Grad, Anna; Foerstner, Jens
2011-01-01
We study the influence of the phonon environment on the electron dynamics in a doped quantum dot molecule. A non-perturbative quantum kinetic theory based on correlation expansion is used in order to describe both diagonal and off-diagonal electron-phonon couplings representing real and virtual...... processes with relevant acoustic phonons. We show that the relaxation is dominated by phonon-assisted electron tunneling between constituent quantum dots and occurs on a picosecond time scale. The dependence of the time evolution of the quantum dot occupation probabilities on the energy mismatch between...
Surface optical phonons in GaAs nanowires grown by Ga-assisted chemical beam epitaxy
Energy Technology Data Exchange (ETDEWEB)
García Núñez, C., E-mail: carlos.garcia@uam.es; Braña, A. F.; Pau, J. L.; Ghita, D.; García, B. J. [Grupo de Electrónica y Semiconductores, Departamento de Física Aplicada, Universidad Autónoma de Madrid, 28049 Madrid (Spain); Shen, G.; Wilbert, D. S.; Kim, S. M.; Kung, P. [Department of Electrical and Computer Engineering, The University of Alabama, Tuscaloosa, Alabama 35487 (United States)
2014-01-21
Surface optical (SO) phonons were studied by Raman spectroscopy in GaAs nanowires (NWs) grown by Ga-assisted chemical beam epitaxy on oxidized Si(111) substrates. NW diameters and lengths ranging between 40 and 65 nm and between 0.3 and 1.3 μm, respectively, were observed under different growth conditions. The analysis of the Raman peak shape associated to either longitudinal or surface optical modes gave important information about the crystal quality of grown NWs. Phonon confinement model was used to calculate the density of defects as a function of the NW diameter resulting in values between 0.02 and 0.03 defects/nm, indicating the high uniformity obtained on NWs cross section size during growth. SO mode shows frequency downshifting as NW diameter decreases, this shift being sensitive to NW sidewall oxidation. The wavevector necessary to activate SO phonon was used to estimate the NW facet roughness responsible for SO shift.
Phonon and thermal properties of exfoliated TaSe{sub 2} thin films
Energy Technology Data Exchange (ETDEWEB)
Yan, Z.; Jiang, C.; Renteria, J. [Nano-Device Laboratory, Department of Electrical Engineering, Bourns College of Engineering, University of California–Riverside, Riverside, California 92521 (United States); Pope, T. R.; Tsang, C. F.; Stickney, J. L.; Salguero, T. T., E-mail: salguero@uga.edu, E-mail: balandin@ee.ucr.edu [Department of Chemistry, University of Georgia, Athens, Georgia 30602 (United States); Goli, P. [Materials Science and Engineering Program, Bourns College of Engineering, University of California–Riverside, Riverside, California 92521 (United States); Balandin, A. A., E-mail: salguero@uga.edu, E-mail: balandin@ee.ucr.edu [Nano-Device Laboratory, Department of Electrical Engineering, Bourns College of Engineering, University of California–Riverside, Riverside, California 92521 (United States); Materials Science and Engineering Program, Bourns College of Engineering, University of California–Riverside, Riverside, California 92521 (United States)
2013-11-28
We report on the phonon and thermal properties of thin films of tantalum diselenide (2H-TaSe{sub 2}) obtained via the “graphene-like” mechanical exfoliation of crystals grown by chemical vapor transport. The ratio of the intensities of the Raman peak from the Si substrate and the E{sub 2g} peak of TaSe{sub 2} presents a convenient metric for quantifying film thickness. The temperature coefficients for two main Raman peaks, A{sub 1g} and E{sub 2g}, are −0.013 and −0.0097 cm{sup −1}/{sup o}C, respectively. The Raman optothermal measurements indicate that the room temperature thermal conductivity in these films decreases from its bulk value of ∼16 W/mK to ∼9 W/mK in 45-nm thick films. The measurement of electrical resistivity of the field-effect devices with TaSe{sub 2} channels shows that heat conduction is dominated by acoustic phonons in these van der Waals films. The scaling of thermal conductivity with the film thickness suggests that the phonon scattering from the film boundaries is substantial despite the sharp interfaces of the mechanically cleaved samples. These results are important for understanding the thermal properties of thin films exfoliated from TaSe{sub 2} and other metal dichalcogenides, as well as for evaluating self-heating effects in devices made from such materials.
Phonon and thermal properties of exfoliated TaSe2 thin films
International Nuclear Information System (INIS)
Yan, Z.; Jiang, C.; Renteria, J.; Pope, T. R.; Tsang, C. F.; Stickney, J. L.; Salguero, T. T.; Goli, P.; Balandin, A. A.
2013-01-01
We report on the phonon and thermal properties of thin films of tantalum diselenide (2H-TaSe 2 ) obtained via the “graphene-like” mechanical exfoliation of crystals grown by chemical vapor transport. The ratio of the intensities of the Raman peak from the Si substrate and the E 2g peak of TaSe 2 presents a convenient metric for quantifying film thickness. The temperature coefficients for two main Raman peaks, A 1g and E 2g , are −0.013 and −0.0097 cm −1 / o C, respectively. The Raman optothermal measurements indicate that the room temperature thermal conductivity in these films decreases from its bulk value of ∼16 W/mK to ∼9 W/mK in 45-nm thick films. The measurement of electrical resistivity of the field-effect devices with TaSe 2 channels shows that heat conduction is dominated by acoustic phonons in these van der Waals films. The scaling of thermal conductivity with the film thickness suggests that the phonon scattering from the film boundaries is substantial despite the sharp interfaces of the mechanically cleaved samples. These results are important for understanding the thermal properties of thin films exfoliated from TaSe 2 and other metal dichalcogenides, as well as for evaluating self-heating effects in devices made from such materials
Phonon and thermal properties of exfoliated TaSe2 thin films
Yan, Z.; Jiang, C.; Pope, T. R.; Tsang, C. F.; Stickney, J. L.; Goli, P.; Renteria, J.; Salguero, T. T.; Balandin, A. A.
2013-11-01
We report on the phonon and thermal properties of thin films of tantalum diselenide (2H-TaSe2) obtained via the "graphene-like" mechanical exfoliation of crystals grown by chemical vapor transport. The ratio of the intensities of the Raman peak from the Si substrate and the E2g peak of TaSe2 presents a convenient metric for quantifying film thickness. The temperature coefficients for two main Raman peaks, A1g and E2g, are -0.013 and -0.0097 cm-1/oC, respectively. The Raman optothermal measurements indicate that the room temperature thermal conductivity in these films decreases from its bulk value of ˜16 W/mK to ˜9 W/mK in 45-nm thick films. The measurement of electrical resistivity of the field-effect devices with TaSe2 channels shows that heat conduction is dominated by acoustic phonons in these van der Waals films. The scaling of thermal conductivity with the film thickness suggests that the phonon scattering from the film boundaries is substantial despite the sharp interfaces of the mechanically cleaved samples. These results are important for understanding the thermal properties of thin films exfoliated from TaSe2 and other metal dichalcogenides, as well as for evaluating self-heating effects in devices made from such materials.
Ultrafast optical generation of squeezed magnon states and long lifetime coherent LO phonons
Zhao, Jimin
2005-12-01
Ultrafast optical pulses have been used to generate, probe, and control low-energy elementary excitations in crystals. In particular, we report the first experimental demonstration of the generation of quantum squeezed states of magnons (collective spin-wave excitations) in a magnetic material, and new progress in experimental investigation of anharmonic interactions in a semiconductor. The mechanism for the magnon squeezing is two-magnon impulsive stimulated Raman scattering (ISRS). Femtosecond laser pulses have been used to coherently correlate degenerate counter-propagating magnons in the antiferromagnetic insulator MnF2. In the squeezed state, fluctuations of the magnetization of a crystallographic unit cell vary periodically in time and are reduced below that of the ground-state quantum noise. Similar experiments were also performed in another antiferromagnetic insulator, FeF2, for which the squeezing effect is one order of magnitude larger. We have also investigated the anharmonic interaction of the low-frequency E2 phonon in ZnO through ISRS. Temperature dependence of the linewidth and frequency indicates that the two-phonon up-conversion process is the dominant decay channel and isotopic disorder may be the main limit on the lifetime at low temperature. We have observed the longest lifetime of an optical phonon mode in a solid (211 ps at 5 K). And we have found that pump-probe experiments, compared with spontaneous Raman spectroscopy, have extremely high accuracy in determining the frequency of a low-lying excitation.
Transverse acoustic phonon anomalies at intermediate wave vectors in MgV2O4
Weber, T.; Roessli, B.; Stock, C.; Keller, T.; Schmalzl, K.; Bourdarot, F.; Georgii, R.; Ewings, R. A.; Perry, R. S.; Böni, P.
2017-11-01
Magnetic spinels (with chemical formula A X2O4 , with X a 3 d transition metal ion) that also have an orbital degeneracy are Jahn-Teller active and hence possess a coupling between spin and lattice degrees of freedom. At high temperatures, MgV2O4 is a cubic spinel based on V3 + ions with a spin S =1 and a triply degenerate orbital ground state. A structural transition occurs at TOO=63 K to an orbitally ordered phase with a tetragonal unit cell followed by an antiferromagnetic transition of TN=42 K on cooling. We apply neutron spectroscopy in single crystals of MgV2O4 to show an anomaly for intermediate wave vectors at TOO associated with the acoustic phonon sensitive to the shear elastic modulus (C11-C12)/2 . On warming, the shear mode softens for momentum transfers near close to half the Brillouin zone boundary, but recovers near the zone center. High resolution spin-echo measurements further illustrate a temporal broadening with increased temperature over this intermediate range of wave vectors, indicative of a reduction in phonon lifetime. A subtle shift in phonon frequencies over the same range of momentum transfers is observed with magnetic fields. We discuss this acoustic anomaly in context of coupling to orbital and charge fluctuations.
Phase diagram of the layered oxide SnO: GW and electron-phonon studies
Chen, Peng-Jen; Jeng, Horng-Tay
2015-11-01
First-principles calculations are performed to study the electronic properties and the electron-phonon interactions of the layered oxide semiconductor SnO. In addition to the high hole mobility that makes SnO a promising material in electronics, it has recently been reported that the semimetallic phase under pressure is superconducting. The superconducting Tc curve exhibits a dome-like feature under pressure and reaches the maximum of 1.4 K at p = 9.2 GPa. Both its crystal structure and the dome-like Tc curve are reminiscent of the Fe-based superconductor FeSe. Motivated by this observation, we investigate the electronic, phonon, and their interactions in SnO using first-principles schemes. GW approximation is adopted to correct the underestimated band gaps, including real and continuous band gaps in the semiconducting and semimetallic phases. The phase diagram showing the semiconductor-to-semimetal transition and the Tc curve has been successfully reproduced. Detailed analysis of the electron-phonon interactions demonstrate the importance of the out-of-plane motions of O atoms and the Sn-s lone pairs for the superconductivity to occur. Our method combining GW and e-ph calculations can be further extended to the study of other materials that undergo insulator-to-superconductor phase transition.
Hypersonic modulation of light in three-dimensional photonic and phononic band-gap materials.
Akimov, A V; Tanaka, Y; Pevtsov, A B; Kaplan, S F; Golubev, V G; Tamura, S; Yakovlev, D R; Bayer, M
2008-07-18
The elastic coupling between the a-SiO2 spheres composing opal films brings forth three-dimensional periodic structures which besides a photonic stop band are predicted to also exhibit complete phononic band gaps. The influence of elastic crystal vibrations on the photonic band structure has been studied by injection of coherent hypersonic wave packets generated in a metal transducer by subpicosecond laser pulses. These studies show that light with energies close to the photonic band gap can be efficiently modulated by hypersonic waves.
Phonons in orientationally disordered neopentane C(CD3)4
International Nuclear Information System (INIS)
Debeau, M.; Depondt, P.; Hennion, B.; Reichardt, W.
1993-01-01
The phonons of deuteriated neopentane (C(CD 3 ) 4 single crystals in the orientationally disordered phase were measured at T=173 K by coherent inelastic neutron scattering, yielding very broad bands that spread, at a given energy, over a large portion of the Brillouin zone while sitting on an intense background. No librational mode was detected. Selection rule violations, presumably linked to disorder, were observed. The elastic constants are discussed in terms or rotational-translational coupling, and inelastic scattering results are compared with the molecular center of mass translational disorder as obtained from diffraction experiments providing a confirmation of a previous interpretation of these experiments. (orig.)
Material and Phonon Engineering for Next Generation Acoustic Devices
Kuo, Nai-Kuei
This thesis presents the theoretical and experimental work related to micromachining of low intrinsic loss sapphire and phononic crystals for engineering new classes of electroacoustic devices for frequency control applications. For the first time, a low loss sapphire suspended membrane was fabricated and utilized to form the main body of a piezoelectric lateral overtone bulk acoustic resonator (LOBAR). Since the metalized piezoelectric transducer area in a LOBAR is only a small fraction of the overall resonant cavity (made out of sapphire), high quality factor (Q) overtones are attained. The experiment confirms the low intrinsic mechanical loss of the transferred sapphire thin film, and the resonators exhibit the highest Q of 5,440 at 2.8 GHz ( f·Q of 1.53.1013 Hz). This is also the highest f·Q demonstrated for aluminum-nitride-(AIN)-based Lamb wave devices to date. Beyond demonstrating a low loss device, this experimental work has laid the foundation for the future development of new micromechanical devices based on a high Q, high hardness and chemically resilient material. The search for alternative ways to more efficiently perform frequency control functionalities lead to the exploration of Phononic Crystal (PnC) structures in AIN thin films. Four unit cell designs were theoretically and experimentally investigated to explore the behavior of phononic bandgaps (PBGs) in the ultra high frequency (UHF) range: (i) the conventional square lattice with circular air scatterer, (ii) the inverse acoustic bandgap (IABG) structure, (iii) the fractal PnC, and (iv) the X-shaped PnC. Each unit cell has its unique frequency characteristic that was exploited to synthesize either cavity resonators or improve the performance of acoustic delay lines. The PBGs operate in the range of 770 MHz to 1 GHz and exhibit a maximum acoustic rejection of 40 dB. AIN Lamb wave transducers (LWTs) were employed for the experimental demonstration of the PBGs and cavity resonances. Ultra
Optical phonon cascade emission by photoelectrons at a p-GaN (Cs,O)-vacuum interface
Rozhkov, S. A.; Bakin, V. V.; Gorshkov, D. V.; Kosolobov, S. N.; Scheibler, H. E.; Terekhov, A. S.
2016-07-01
It has been experimentally established that the transfer of photoelectrons from the bulk of a p-GaN (Cs,O) photocathode to vacuum is accompanied by the emission of a cascade of optical phonons. In the quantum efficiency spectrum of the p-GaN (Cs,O) photocathode, an exciton peak has been identified, indicating a significant contribution of the electron-hole interaction to the generation of free electrons in heavily doped p-GaN.
Czech Academy of Sciences Publication Activity Database
Khalaji, A.D.; Mehrani, S.; Eigner, Václav; Dušek, Michal
2013-01-01
Roč. 1047, SEP (2013), s. 87-94 ISSN 0022-2860 Grant - others:AV ČR(CZ) AP0701 Program:Akademická prémie - Praemium Academiae Institutional support: RVO:68378271 Keywords : thiosemicarbazide * single crystal * FT-IR * 1 H NMR * DFT Subject RIV: CB - Analytical Chemistry , Separation Impact factor: 1.599, year: 2013
One-Dimensional Physics of Interacting Electrons and Phonons in Carbon Nanotubes
Deshpande, Vikram Vijay
The one-dimensional (1D) world is quite different from its higher dimensional counterparts. For example, the electronic ground state in 1D is not a Fermi liquid as in most solids, due to the role of electron-electron interactions. Most commonly, electrons in 1D are described as a Luttinger liquid , where the low-energy excitations are decoupled bosonic charge and spin waves. Carbon nanotubes are clean 1D systems which have been shown to behave like a Luttinger liquid at high electron density. However, at low electron density and in the absence of disorder, the ground state is predicted to be a 1D Wigner crystal---an electron solid dominated by long-range Coulomb interaction. Moreover, short-range interaction mediated by the atomic lattice (umklapp scattering) is predicted to transform a nominal 1D metal into a Mott insulator. In this thesis, we develop techniques to make extremely clean nanotube single-electron transistors. We study them in the few-electron/hole regime using Coulomb blockade spectroscopy in a magnetic field. In semiconducting nanotubes, we map out the antiferromagnetic exchange coupling as a function of carrier number and find excellent agreement to a Wigner crystal model. In nominally metallic nanotubes, we observe a universal energy gap in addition to the single-particle bandgap, implying that nanotubes are never metallic. The magnitude, radius dependence and low-energy neutral excitations of this additional gap indicate a Mott insulating origin. Further, we use simultaneous electrical and Raman spectroscopy measurements to study the phonons scattered by an electric current. At high bias, suspended nanotubes show striking negative differential conductance, attributed to non-equilibrium phonons. We directly observe such "hot" phonon populations in the Raman response and also report preferential electron coupling to one of two optical phonon modes. In addition, using spatially-resolved Raman spectroscopy, we obtain a wealth of local information
Electromagnetic microwaves in metal films with electron-phonon interaction and a dc magnetic field
DEFF Research Database (Denmark)
Hasselberg, L.E.
1976-01-01
A quantum-mechanical treatment of electromagnetic microwaves is performed for a metal film. The directions of the exterior ac and dc fields are taken to be arbitrary and boundary conditions for the electrons are assumed to be specular. The relation between the current and the electromagnetic field...... in the transmission spectrum can perhaps be obtained by assuming a finite Debye temperature and specular reflections of the electrons at the boundary surfaces. A sharp peak entirely caused by the finite electron-phonon interaction is also discussed....
A new phase of disordered phonons modelled by random matrices
Schmittner, Sebastian; Zirnbauer, Martin
2015-03-01
Starting from the clean harmonic crystal and not invoking two-level systems, we propose a model for phonons in a disordered solid. In this model the strength of mass and spring constant disorder can be increased separately. Both types of disorder are modelled by random matrices that couple the degrees of freedom locally. Treated in coherent potential approximation (CPA), the speed of sound decreases with increasing disorder until it reaches zero at finite disorder strength. There, a critical transition to a strong disorder phase occurs. In this novel phase, we find the density of states at zero energy in three dimensions to be finite, leading to a linear temperature dependence of the heat capacity, as observed experimentally for vitreous systems. For any disorder strength, our model is stable, i.e. masses and spring constants are positive, and there are no runaway dynamics. This is ensured by using appropriate probability distributions, inspired by Wishart ensembles, for the random matrices. The CPA self-consistency equations are derived in a very accessible way using planar diagrams. The talk focuses on the model and the results. The first author acknowledges financial support by the Deutsche Telekom Stiftung.
Huang, Wen Deng; Bao, Li Fu; Ren, Ya Jie; Yuan, Zhao Lin
2018-04-01
The properties of interface optical phonons and their electron-phonon interactions in ZnS/CdS multi-shell spherical quantum dots are studied by adopting dielectric continuum model. The dispersion curves and electron-phonon coupling strengths for interface optical phonons in ZnS/CdS multi-shell dots are calculated and analyzed in detail. It is shown that the number of interface optical phonon branches increase with the increase of layers of multi-shell quantum dots. The number of interface optical phonons increase two branches for increasing one layer material. The dispersions of interface optical phonon with low quantum number l are weak. The electron-interface optical phonon interactions are mainly localized at hetero-interfaces. The interface optical phonons with low quantum number l have important contribution to electron-interface optical phonon interactions.
Phonon hydrodynamics and its applications in nanoscale heat transport
Guo, Yangyu; Wang, Moran
2015-09-01
Phonon hydrodynamics is an effective macroscopic method to study heat transport in dielectric solid and semiconductor. It has a clear and intuitive physical picture, transforming the abstract and ambiguous heat transport process into a concrete and evident process of phonon gas flow. Furthermore, with the aid of the abundant models and methods developed in classical hydrodynamics, phonon hydrodynamics becomes much easier to implement in comparison to the current popular approaches based on the first-principle method and kinetic theories involving complicated computations. Therefore, it is a promising tool for studying micro- and nanoscale heat transport in rapidly developing micro and nano science and technology. However, there still lacks a comprehensive account of the theoretical foundations, development and implementation of this approach. This work represents such an attempt in providing a full landscape, from physical fundamental and kinetic theory of phonons to phonon hydrodynamics in view of descriptions of phonon systems at microscopic, mesoscopic and macroscopic levels. Thus a systematical kinetic framework, summing up so far scattered theoretical models and methods in phonon hydrodynamics as individual cases, is established through a frame of a Chapman-Enskog solution to phonon Boltzmann equation. Then the basic tenets and procedures in implementing phonon hydrodynamics in nanoscale heat transport are presented through a review of its recent wide applications in modeling thermal transport properties of nanostructures. Finally, we discuss some pending questions and perspectives highlighted by a novel concept of generalized phonon hydrodynamics and possible applications in micro/nano phononics, which will shed more light on more profound understanding and credible applications of this new approach in micro- and nanoscale heat transport science.
Parity-Time Synthetic Phononic Media
DEFF Research Database (Denmark)
Christensen, Johan; Willatzen, Morten; Velasco, V. R.
2016-01-01
media, have been devised in many optical systems with the ground breaking potential to create nonreciprocal structures and one-way cloaks of invisibility. Here we demonstrate a feasible approach for the case of sound where the most important ingredients within synthetic materials, loss and gain......, are achieved through electrically biased piezoelectric semiconductors. We study first how wave attenuation and amplification can be tuned, and when combined, can give rise to a phononic PT synthetic media with unidirectional suppressed reflectance, a feature directly applicable to evading sonar detection....
3D quantum liquid crystals by condensation of dislocation worldsheets
Beekman, Aron; Wu, Kai; Nissinen, Jaakko; Zaanen, Jan
A solid can partially melt into a liquid crystal where rotational rigidity is maintained while translational symmetry is restored. The topological melting is caused by an unbinding of dislocations. We recently provided a comprehensive review of quantum dislocation-mediated melting in 2D (arXiv:1603.04254). Through a duality mapping, phonons turn into dual gauge fields mediating interactions between dislocations. Upon condensation of dislocations, the dual gauge fields undergo the Anderson-Higgs mechanism and become gapped, signaling the loss of shear rigidity. Here we extend this theory to three dimensions. Dislocations are now linelike objects, strings, tracing out worldsheets in spacetime, while the dual gauge-fields become two-form (Kalb-Ramond) fields. We obtain the Higgs phase of these two-form gauge fields. Translational symmetry can be restored in three, two or one directions leading to nematic, smectic or columnar quantum liquid crystals. We derive the spectrum of low-energy excitations and its linear response. Goldstone modes due to broken rotational symmetry as well as superconductivity emerge whenever translational symmetry is restored. The peculiar features of liquid-crystalline order can be probed by finite-momentum spectroscopy.
Effect of doping on lattice dynamics and electron-phonon coupling of the actinides Ac-Th alloy.
de Coss-Martínez, R; González-Castelazo, P; De la Peña-Seaman, O; Heid, R; Bohnen, K-P
2017-09-06
We have studied the electronic, lattice dynamical, and electron-phonon properties of the actinides [Formula: see text]Th x alloy within the framework of density functional perturbation theory. The self-consistent virtual crystal approximation is used for the alloy modeling, and spin-orbit coupling is included in the calculation of all relevant quantities. An overall decrease of the electron-phonon coupling (λ) by [Formula: see text] from Ac to Th was observed. However, its dependence on x shows a non-linear behavior. λ reduces just 6% from Ac to a Th content of [Formula: see text], then drops drastically (∼[Formula: see text]) from there until [Formula: see text]. The large decrease of λ for [Formula: see text] is due to the reduction of the density of states at the Fermi level ([Formula: see text]), combined with a general phonon hardening. On contrast, the behavior for [Formula: see text] is the result of a subtle balance between an enhancement of phase space and the above mentioned effects on [Formula: see text] and the phonons. The phase-space enhancement is related to the appearance of Kohn anomalies, which fade away as the Th concentration increases.
Carrete, Jesús; Vermeersch, Bjorn; Katre, Ankita; van Roekeghem, Ambroise; Wang, Tao; Madsen, Georg K. H.; Mingo, Natalio
2017-11-01
almaBTE is a software package that solves the space- and time-dependent Boltzmann transport equation for phonons, using only ab-initio calculated quantities as inputs. The program can predictively tackle phonon transport in bulk crystals and alloys, thin films, superlattices, and multiscale structures with size features in the nm- μm range. Among many other quantities, the program can output thermal conductances and effective thermal conductivities, space-resolved average temperature profiles, and heat-current distributions resolved in frequency and space. Its first-principles character makes almaBTE especially well suited to investigate novel materials and structures. This article gives an overview of the program structure and presents illustrative examples for some of its uses. PROGRAM SUMMARY Program Title:almaBTE Program Files doi:http://dx.doi.org/10.17632/8tfzwgtp73.1 Licensing provisions: Apache License, version 2.0 Programming language: C++ External routines/libraries: BOOST, MPI, Eigen, HDF5, spglib Nature of problem: Calculation of temperature profiles, thermal flux distributions and effective thermal conductivities in structured systems where heat is carried by phonons Solution method: Solution of linearized phonon Boltzmann transport equation, Variance-reduced Monte Carlo
One- and two-phonon capture processes in quantum dots
DEFF Research Database (Denmark)
Magnúsdóttir, Ingibjörg; Uskov, Alexander; Bischoff, Svend
2002-01-01
Multiphonon capture processes are investigated theoretically and found to contribute efficiently to the carrier injection into quantum dots. It is shown that two-phonon capture contributes where single-phonon capture is energetically inhibited and can lead to electron capture times of a few...
Modelling exciton–phonon interactions in optically driven quantum dots
DEFF Research Database (Denmark)
Nazir, Ahsan; McCutcheon, Dara
2016-01-01
We provide a self-contained review of master equation approaches to modelling phonon effects in optically driven self-assembled quantum dots. Coupling of the (quasi) two-level excitonic system to phonons leads to dissipation and dephasing, the rates of which depend on the excitation conditions...
Phonon thermal transport through tilt grain boundaries in strontium titanate
Energy Technology Data Exchange (ETDEWEB)
Zheng, Zexi; Chen, Xiang; Yang, Shengfeng; Xiong, Liming; Chen, Youping [Department of Mechanical and Aerospace Engineering, University of Florida, Gainesville, Florida 32611 (United States); Deng, Bowen; Chernatynskiy, Aleksandr [Department of Materials Science and Engineering, University of Florida, Gainesville, Florida 32611 (United States)
2014-08-21
In this work, we perform nonequilibrium molecular dynamics simulations to study phonon scattering at two tilt grain boundaries (GBs) in SrTiO{sub 3}. Mode-wise energy transmission coefficients are obtained based on phonon wave-packet dynamics simulations. The Kapitza conductance is then quantified using a lattice dynamics approach. The obtained results of the Kapitza conductance of both GBs compare well with those obtained by the direct method, except for the temperature dependence. Contrary to common belief, the results of this work show that the optical modes in SrTiO{sub 3} contribute significantly to phonon thermal transport, accounting for over 50% of the Kapitza conductance. To understand the effect of the GB structural disorder on phonon transport, we compare the local phonon density of states of the atoms in the GB region with that in the single crystalline grain region. Our results show that the excess vibrational modes introduced by the structural disorder do not have a significant effect on phonon scattering at the GBs, but the absence of certain modes in the GB region appears to be responsible for phonon reflections at GBs. This work has also demonstrated phonon mode conversion and simultaneous generation of new modes. Some of the new modes have the same frequency as the initial wave packet, while some have the same wave vector but lower frequencies.
Phonons and charge-transfer excitations in HTS superconductors
International Nuclear Information System (INIS)
Bishop, A.R.
1989-01-01
Some of the experimental and theoretical evidence implicating phonons and charge-transfer excitations in HTS superconductors is reviewed. It is suggested that superconductivity may be driven by a synergistic interplay of (anharmonic) phonons and electronic degrees of freedom (e.g., charge fluctuations, excitons). 47 refs., 5 figs
Phonon frequency shift and effect of correlation on the electron ...
Indian Academy of Sciences (India)
P.G. Department of Physics, Sambalpur University, Jyoti Vihar, Burla 768 019, India. *. Institute of Physics ... observed magneto-elastic effect (coupling of phonon to thef-electrons), anisotropic Fermi surface, Kondo ... Considering the importance of the lanthanide contraction in these systems, the phonons are assumed to ...
Phonon thermal transport through tilt grain boundaries in strontium titanate
International Nuclear Information System (INIS)
Zheng, Zexi; Chen, Xiang; Yang, Shengfeng; Xiong, Liming; Chen, Youping; Deng, Bowen; Chernatynskiy, Aleksandr
2014-01-01
In this work, we perform nonequilibrium molecular dynamics simulations to study phonon scattering at two tilt grain boundaries (GBs) in SrTiO 3 . Mode-wise energy transmission coefficients are obtained based on phonon wave-packet dynamics simulations. The Kapitza conductance is then quantified using a lattice dynamics approach. The obtained results of the Kapitza conductance of both GBs compare well with those obtained by the direct method, except for the temperature dependence. Contrary to common belief, the results of this work show that the optical modes in SrTiO 3 contribute significantly to phonon thermal transport, accounting for over 50% of the Kapitza conductance. To understand the effect of the GB structural disorder on phonon transport, we compare the local phonon density of states of the atoms in the GB region with that in the single crystalline grain region. Our results show that the excess vibrational modes introduced by the structural disorder do not have a significant effect on phonon scattering at the GBs, but the absence of certain modes in the GB region appears to be responsible for phonon reflections at GBs. This work has also demonstrated phonon mode conversion and simultaneous generation of new modes. Some of the new modes have the same frequency as the initial wave packet, while some have the same wave vector but lower frequencies
Stimulated emission of phonons in an acoustic cavity
Tilstra, Lieuwe Gijsbert
2001-01-01
This thesis will present experiments on stimulated emission of phonons in dilute ruby following complete population inversion of the Zeeman-split E(2E) Kramers doublet by selective pulsed optical pumping into its upper component. The resulting phonon avalanches are detected by use of the R1
Multiple interruption of optically generated acoustic phonons in ruby
International Nuclear Information System (INIS)
Dijkhuis, J.I.
1979-01-01
This thesis clarifies the rate-determining processes which tend to equilibrate the bottlenecked 29 cm -1 phonons with the temperature bath in stationary experiments. In addition, the direct relaxation between the Zeeman components of E is measured, revealing at high pumping, both continuous and time-resolved, a strong phonon bottleneck. (Auth.)
Phonon localization transition in relaxor ferroelectric PZN-5%PT
International Nuclear Information System (INIS)
Manley, Michael E.; Christianson, Andrew D.; Abernathy, Douglas L.; Sahul, Raffi
2017-01-01
Relaxor ferroelectric behavior occurs in many disordered ferroelectric materials but is not well understood at the atomic level. Recent experiments and theoretical arguments indicate that Anderson localization of phonons instigates relaxor behavior by driving the formation of polar nanoregions (PNRs). Here, we use inelastic neutron scattering to observe phonon localization in relaxor ferroelectric PZN-5%PT (0.95[Pb(Zn 1/3 Nb 2/3 )O 3 ]–0.05PbTiO 3 ) and detect additional features of the localization process. In the lead, up to phonon localization on cooling, the local resonant modes that drive phonon localization increase in number. The increase in resonant scattering centers is attributed to a known increase in the number of locally off centered Pb atoms on cooling. The transition to phonon localization occurs when these random scattering centers increase to a concentration where the Ioffe-Regel criterion is satisfied for localizing the phonon. Finally, we also model the effects of damped mode coupling on the observed phonons and phonon localization structure.
Colloquium: Phononics: Manipulating heat flow with electronic analogs and beyond
Li, Nianbei; Ren, Jie; Wang, Lei; Zhang, Gang; Hänggi, Peter; Li, Baowen
2012-07-01
The form of energy termed heat that typically derives from lattice vibrations, i.e., phonons, is usually considered as waste energy and, moreover, deleterious to information processing. However, in this Colloquium, an attempt is made to rebut this common view: By use of tailored models it is demonstrated that phonons can be manipulated similarly to electrons and photons, thus enabling controlled heat transport. Moreover, it is explained that phonons can be put to beneficial use to carry and process information. In the first part ways are presented to control heat transport and to process information for physical systems which are driven by a temperature bias. In particular, a toolkit of familiar electronic analogs for use of phononics is put forward, i.e., phononic devices are described which act as thermal diodes, thermal transistors, thermal logic gates, and thermal memories. These concepts are then put to work to transport, control, and rectify heat in physically realistic nanosystems by devising practical designs of hybrid nanostructures that permit the operation of functional phononic devices; the first experimental realizations are also reported. Next, richer possibilities to manipulate heat flow by use of time-varying thermal bath temperatures or various other external fields are discussed. These give rise to many intriguing phononic nonequilibrium phenomena such as, for example, the directed shuttling of heat, geometrical phase-induced heat pumping, or the phonon Hall effect, which may all find their way into operation with electronic analogs.
Phonon and thermal properties of achiral single wall carbon ...
Indian Academy of Sciences (India)
A detailed theoretical study of the phonon and thermal properties of achiral single wall carbon nanotubes has been carried out using force constant model considering up to third nearest-neighbor interactions. We have calculated the phonon dispersions, density of states, radial breathing modes (RBM) and the specific heats ...
Indirect phase transition of TiC, ZrC, and HfC crystal structures
Energy Technology Data Exchange (ETDEWEB)
Abavare, Eric K.K.; Dodoo, Samuel N.A. [Department of Physics, Kwame Nkrumah University of Science and Technology, Kumasi (Ghana); Uchida, Kazuyuki; Oshiyama, Atsushi [Department of Applied Physics, The University of Tokyo, Hongo, Tokyo (Japan); Nkurumah-Buandoh, George K.; Yaya, Abu [Department of Physics, University of Ghana, Legon (Ghana)
2016-06-15
We have performed first-principles calculations to analyze the electronic structures, static, and dynamical structural stabilities of the pressure-induced phase transformation of refractory compounds (transition-metal carbides) from NaCl-type (B1) to CsCl-type (B2) via zinc-blende phase using the plane-wave pseudopotential approach in the framework of the generalized gradient approximation (GGA) for the exchange and correlation functional. The ground-state properties, equilibrium lattice constant, bulk moduli, and band structures are determined for the stoichiometry of the compounds and compared with known experimental and theoretical values. We find that the phase-transition pressure for the indirect phase transition from B1→B2 via zinc-blende structure is about 17-fold for TiC, 12-fold for both ZrC and HfC, respectively, when compared with the direct phase transition. Calculated phonon instability exists for the CsCl-B2 phase, which can prevent the structures from forming and contrary to the zinc-blende and the NaCl-B1 phases. The band dispersion and electronic density of states for B1 and B2 crystal phases were explored and found to indicate metallic character in contrast with the zinc-blende phase, which has a pseudogap opening in the bandgap region suggesting a semiconducting property and also a frequency gap in the phonon spectrum. (copyright 2016 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)
DEFF Research Database (Denmark)
Abdali, Salim; Tarrio, C.; Christensen, Finn Erland
1996-01-01
, the reflectivity performance as a function of energy and angle of incidence of all crystals has been measured using line radiation from an x-ray tube which provides 1.487 keV and 0.277 keV and using synchrotron radiation from 0.16 keV to 0.28 keV at the Synchrotron Ultraviolet Radiation electron storage ring a t...
Strong anharmonicity in the phonon spectra of PbTe and SnTe from first principles
Ribeiro, Guilherme A. S.; Paulatto, Lorenzo; Bianco, Raffaello; Errea, Ion; Mauri, Francesco; Calandra, Matteo
2018-01-01
At room temperature, PbTe and SnTe are efficient thermoelectrics with a cubic structure. At low temperature, SnTe undergoes a ferroelectric transition with a critical temperature strongly dependent on the hole concentration, while PbTe is an incipient ferroelectric. By using the stochastic self-consistent harmonic approximation, we investigate the anharmonic phonon spectra and the occurrence of a ferroelectric transition in both systems. We find that vibrational spectra strongly depend on the approximation used for the exchange-correlation kernel in density-functional theory. If gradient corrections and the theoretical volume are employed, then the calculation of the phonon frequencies as obtained from the diagonalization of the free-energy Hessian leads to phonon spectra in good agreement with experimental data for both systems. In PbTe we evaluate the linear thermal expansion coefficient γ =2.3 ×10-5K-1 , finding it to be in good agreement with experimental value of γ =2.04 ×10-5K-1 . Furthermore, we study the phonon spectrum and we do reproduce the transverse optical mode phonon satellite detected in inelastic neutron scattering and the crossing between the transverse optical and the longitudinal acoustic modes along the Γ X direction. The phonon satellite becomes broader at high temperatures but its energy is essentially temperature independent, in agreement with experiments. We decompose the self-consistent harmonic free energy in second-, third-, and fourth-order anharmonic terms. We find that the third- and fourth-order terms are small. However, treating the third-order term perturbatively on top of the second-order self-consistent harmonic free energy overestimates the energy of the satellite associated with the transverse optical mode. On the contrary, a perturbative treatment on top of the harmonic Hamiltonian breaks down and leads to imaginary phonon frequencies already at 300 K. In the case of SnTe, we describe the occurrence of a ferroelectric
Directory of Open Access Journals (Sweden)
Minárik Stanislav
2015-08-01
Full Text Available In this paper, we propose theoretical basis for investigation of dynamics of acoustic phonons in a thin layers containing nano-scale structural inhomogeneities. One-dimensional (1D model of a crystal lattice was considered to reveal specific features of the processes arising in such system of phonons in equilibrium state. Standard quantization of energy of 1D ionic chain vibrating by acoustic frequencies was carried out while the presence of foreign ions in this chain was taken into account. Since only two dimensions are dominant in thin layers, only longitudinal vibrations of the chain in the plane of the layer were considered. Results showed that foreign ions affect the energy quantization. Phonon-phonon interaction between two phonon`s modes can be expected if the mass of foreign ions implanted by ion-beam differs from the mass of ions in the initial layer.
Thickness-dependent coherent phonon frequency in ultrathin FeSe/SrTiO_{3} films
Energy Technology Data Exchange (ETDEWEB)
Yang, Shuolong [SLAC National Accelerator Lab., Menlo Park, CA (United States); Stanford Univ., Stanford, CA (United States); Sobota, Jonathan A. [SLAC National Accelerator Lab., Menlo Park, CA (United States); Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States); Leuenberger, Dominik [SLAC National Accelerator Lab., Menlo Park, CA (United States); Stanford Univ., Stanford, CA (United States); Kemper, Alexander F. [Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States); Lee, James J. [SLAC National Accelerator Lab., Menlo Park, CA (United States); Stanford Univ., Stanford, CA (United States); Schmitt, Felix T. [SLAC National Accelerator Lab., Menlo Park, CA (United States); Stanford Univ., Stanford, CA (United States); Li, Wei [SLAC National Accelerator Lab., Menlo Park, CA (United States); Stanford Univ., Stanford, CA (United States); Moore, Rob G. [SLAC National Accelerator Lab., Menlo Park, CA (United States); Stanford Univ., Stanford, CA (United States); Kirchmann, Patrick S. [SLAC National Accelerator Lab., Menlo Park, CA (United States); Shen, Zhi -Xun [SLAC National Accelerator Lab., Menlo Park, CA (United States); Stanford Univ., Stanford, CA (United States)
2015-06-01
Ultrathin FeSe films grown on SrTiO_{3} substrates are a recent milestone in atomic material engineering due to their important role in understanding unconventional superconductivity in Fe-based materials. By using femtosecond time- and angle-resolved photoelectron spectroscopy, we study phonon frequencies in ultrathin FeSe/SrTiO_{3} films grown by molecular beam epitaxy. After optical excitation, we observe periodic modulations of the photoelectron spectrum as a function of pump–probe delay for 1-unit-cell, 3-unit-cell, and 60-unit-cell thick FeSe films. The frequencies of the coherent intensity oscillations increase from 5.00 ± 0.02 to 5.25 ± 0.02 THz with increasing film thickness. By comparing with previous works, we attribute this mode to the Se A_{1g} phonon. The dominant mechanism for the phonon softening in 1-unit-cell thick FeSe films is a substrate-induced lattice strain. Results demonstrate an abrupt phonon renormalization due to a lattice mismatch between the ultrathin film and the substrate.
Myasnikova, A. E.; Zhileeva, E. A.; Moseykin, D. V.
2018-03-01
An approach to considering systems with a high concentration of correlated carriers and strong long-range electron–phonon interaction and to calculating the high-energy part of the angle-resolved photoemission spectroscopy (ARPES) spectra of such systems is suggested. Joint relaxation of strongly coupled fields—a field of correlated electrons and phonon field—after photoemission is studied to clarify the nature of characteristic features observed in the high-energy part of the ARPES spectra of cuprate superconductors. Such relaxation occurs in systems with strong predominantly long-range electron–phonon interaction at sufficiently high carrier concentration due to the coexistence of autolocalized and delocalized carriers. A simple method to calculate analytically a high-energy part of the ARPES spectrum arising is proposed. It takes advantage of using the coherent states basis for the phonon field in the polaron and bipolaron states. The approach suggested yields all the high-energy spectral features like broad Gaussian band and regions of ‘vertical dispersion’ being in good quantitative agreement with the experiments on cuprates at any doping with both types of carriers. Demonstrated coexistence of autolocalized and delocalized carriers in superconducting cuprates changes the idea about their ground state above the superconducting transition temperature that is important for understanding transport and magnetic properties. High density of large-radius autolocalized carriers revealed may be a key to the explanation of charge ordering in doped cuprates.
Phonon bottleneck identification in disordered nanoporous materials
Romano, Giuseppe; Grossman, Jeffrey C.
2017-09-01
Nanoporous materials are a promising platform for thermoelectrics in that they offer high thermal conductivity tunability while preserving good electrical properties, a crucial requirement for high-efficiency thermal energy conversion. Understanding the impact of the pore arrangement on thermal transport is pivotal to engineering realistic materials, where pore disorder is unavoidable. Although there has been considerable progress in modeling thermal size effects in nanostructures, it has remained a challenge to screen such materials over a large phase space due to the slow simulation time required for accurate results. We use density functional theory in connection with the Boltzmann transport equation to perform calculations of thermal conductivity in disordered porous materials. By leveraging graph theory and regressive analysis, we identify the set of pores representing the phonon bottleneck and obtain a descriptor for thermal transport, based on the sum of the pore-pore distances between such pores. This approach provide a simple tool to estimate phonon suppression in realistic porous materials for thermoelectric applications and enhance our understanding of heat transport in disordered materials.
Phonon-Driven Oscillatory Plasmonic Excitonic Nanomaterials
Energy Technology Data Exchange (ETDEWEB)
Kirschner, Matthew S. [Department; Ding, Wendu [Department; Li, Yuxiu [Center; College; Chapman, Craig T. [Department; Lei, Aiwen [College; Lin, Xiao-Min [Center; Chen, Lin X. [Department; Chemical; Schatz, George C. [Department; Schaller, Richard D. [Department; Center
2017-12-08
We demonstrate that coherent acoustic phonons derived from plasmonic nanoparticles can modulate electronic interactions with proximal excitonic molecular species. A series of gold bipyramids with systematically varied aspect ratios and corresponding localized surface plasmon resonance energies, functionalized with a J-aggregated thiacarbocyanine dye molecule, produce two hybridized states that exhibit clear anti-crossing behavior with a Rabi splitting energy of 120 meV. In metal nanoparticles, photoexcitation generates coherent acoustic phonons that cause oscillations in the plasmon resonance energy. In the coupled system, these photo-generated oscillations alter the metal nanoparticle’s energetic contribution to the hybridized system and, as a result, change the coupling between the plasmon and exciton. We demonstrate that such modulations in the hybridization is consistent across a wide range of bipyramid ensembles. We also use Finite-Difference Time Domain calculations to develop a simple model describing this behavior. Such oscillatory plasmonic-excitonic nanomaterials (OPENs) offer a route to manipulate and dynamically-tune the interactions of plasmonic/excitonic systems and unlock a range of potential applications.
Controllable photon and phonon localization in optomechanical Lieb lattices.
Wan, Liang-Liang; Lü, Xin-You; Gao, Jin-Hua; Wu, Ying
2017-07-24
The Lieb lattice featuring flat band is not only important in strongly-correlated many-body physics, but also can be utilized to inspire new quantum devices. Here we propose an optomechanical Lieb lattice, where the flat-band physics of photon-phonon polaritons is demonstrated. The tunability of the band structure of the optomechanical arrays allows one to obtain an approximate photon or phonon flat band as well as the transition between them. This ultimately leads to the result that the controllable photon or phonon localization could be realized by the path interference effects. This study offers an alternative approach to explore the exotic photon and phonon many-body effects, which has potential applications in the future hybrid-photon-phonon quantum network and engineering new type solid-state quantum devices.