Wave-equation Migration Velocity Analysis Using Plane-wave Common Image Gathers

KAUST Repository

Guo, Bowen

2017-06-01

Wave-equation migration velocity analysis (WEMVA) based on subsurface-offset, angle domain or time-lag common image gathers (CIGs) requires significant computational and memory resources because it computes higher dimensional migration images in the extended image domain. To mitigate this problem, a WEMVA method using plane-wave CIGs is presented. Plane-wave CIGs reduce the computational cost and memory storage because they are directly calculated from prestack plane-wave migration, and the number of plane waves is often much smaller than the number of shots. In the case of an inaccurate migration velocity, the moveout of plane-wave CIGs is automatically picked by a semblance analysis method, which is then linked to the migration velocity update by a connective function. Numerical tests on two synthetic datasets and a field dataset validate the efficiency and effectiveness of this method.

3D plane-wave least-squares Kirchhoff migration

KAUST Repository

Wang, Xin

2014-08-05

A three dimensional least-squares Kirchhoff migration (LSM) is developed in the prestack plane-wave domain to increase the quality of migration images and the computational efficiency. Due to the limitation of current 3D marine acquisition geometries, a cylindrical-wave encoding is adopted for the narrow azimuth streamer data. To account for the mispositioning of reflectors due to errors in the velocity model, a regularized LSM is devised so that each plane-wave or cylindrical-wave gather gives rise to an individual migration image, and a regularization term is included to encourage the similarities between the migration images of similar encoding schemes. Both synthetic and field results show that: 1) plane-wave or cylindrical-wave encoding LSM can achieve both computational and IO saving, compared to shot-domain LSM, however, plane-wave LSM is still about 5 times more expensive than plane-wave migration; 2) the regularized LSM is more robust compared to LSM with one reflectivity model common for all the plane-wave or cylindrical-wave gathers.

Regularized plane-wave least-squares Kirchhoff migration

KAUST Repository

Wang, Xin

2013-09-22

A Kirchhoff least-squares migration (LSM) is developed in the prestack plane-wave domain to increase the quality of migration images. A regularization term is included that accounts for mispositioning of reflectors due to errors in the velocity model. Both synthetic and field results show that: 1) LSM with a reflectivity model common for all the plane-wave gathers provides the best image when the migration velocity model is accurate, but it is more sensitive to the velocity errors, 2) the regularized plane-wave LSM is more robust in the presence of velocity errors, and 3) LSM achieves both computational and IO saving by plane-wave encoding compared to shot-domain LSM for the models tested.

Plane-wave scattering from half-wave dipole arrays

DEFF Research Database (Denmark)

Jensen, Niels E.

1970-01-01

A matrix equation for determination of plane-wave scattering from arrays of thin short-circuited dipoles of lengths about half a wavelength is derived. Numerical and experimental results are presented for linear, circular, and concentric circular arrays.......A matrix equation for determination of plane-wave scattering from arrays of thin short-circuited dipoles of lengths about half a wavelength is derived. Numerical and experimental results are presented for linear, circular, and concentric circular arrays....

Pseudopotential theory of atoms and molecules

International Nuclear Information System (INIS)

Szasz, L.

1985-01-01

This book reviews the pseudopotential theory of atoms and molecules. It refers to the quantum mechanical technique in which the Pauli exclusion principle is replaced by operators and potential functions, jointly called pseudopotentials. The book describes the development of the theory up to the state-of-the-art techniques. It discusses exact pseudopotentials for one-valence electron systems, density-dependent pseudopotentials for one-valence electron systems, and model pseudopotentials for one-valence electron systems

Topologically protected edge states for out-of-plane and in-plane bulk elastic waves

Science.gov (United States)

Huo, Shao-Yong; Chen, Jiu-Jiu; Huang, Hong-Bo

2018-04-01

Topological phononic insulators (TPnIs) show promise for application in the manipulation of acoustic waves for the design of low-loss transmission and perfectly integrated communication devices. Since solid phononic crystals exist as a transverse polarization mode and a mixed longitudinal-transverse polarization mode, the realization of topological edge states for both out-of-plane and in-plane bulk elastic waves is desirable to enhance the controllability of the edge waves in solid systems. In this paper, a two-dimensional (2D) solid/solid hexagonal-latticed phononic system that simultaneously supports the topologically protected edge states for out-of-plane and in-plane bulk elastic waves is investigated. Firstly, two pairs of two-fold Dirac cones, respectively corresponding to the out-of-plane and in-plane waves, are obtained at the same frequency by tuning the crystal parameters. Then, a strategy of zone folding is invoked to form double Dirac cones. By shrinking and expanding the steel scatterer, the lattice symmetry is broken, and band inversions induced, giving rise to an intriguing topological phase transition. Finally, the topologically protected edge states for both out-of-plane and in-plane bulk elastic waves, which can be simultaneously located at the frequency range from 1.223 to 1.251 MHz, are numerically observed. Robust pseudospin-dependent elastic edge wave propagation along arbitrary paths is further demonstrated. Our results will significantly broaden its practical application in the engineering field.

Full-band quantum simulation of electron devices with the pseudopotential method: Theory, implementation, and applications

Science.gov (United States)

Pala, M. G.; Esseni, D.

2018-03-01

This paper presents the theory, implementation, and application of a quantum transport modeling approach based on the nonequilibrium Green's function formalism and a full-band empirical pseudopotential Hamiltonian. We here propose to employ a hybrid real-space/plane-wave basis that results in a significant reduction of the computational complexity compared to a full plane-wave basis. To this purpose, we provide a theoretical formulation in the hybrid basis of the quantum confinement, the self-energies of the leads, and the coupling between the device and the leads. After discussing the theory and the implementation of the new simulation methodology, we report results for complete, self-consistent simulations of different electron devices, including a silicon Esaki diode, a thin-body silicon field effect transistor (FET), and a germanium tunnel FET. The simulated transistors have technologically relevant geometrical features with a semiconductor film thickness of about 4 nm and a channel length ranging from 10 to 17 nm. We believe that the newly proposed formalism may find applications also in transport models based on ab initio Hamiltonians, as those employed in density functional theory methods.

First-principles nonlocal-pseudopotential approach in the density-functional formalism: Development and application to atoms

International Nuclear Information System (INIS)

Zunger, A.; Cohen, M.L.

1978-01-01

We present a method for obtaining first-principles nonlocal atomic pseudopotentials in the density-functional formalism by direct inversion of the pseudopotential eigenvalue problem, where the pseudo-wave-functions are represented as a unitary rotation of the exact all-electron wave functions. The usual pseudopotential nonuniqueness of the orbitals is fixed by imposing the physically appealing constraints of maximum similarity to the all-electron wave functions and minimum radial kinetic energy. These potentials are shown to yield very accurate energy eigenvalues, total energy differences, and wave-function moments over a wide range of excited atomic configurations. We have calculated the potentials for 68 transition and nontransition elements of rows 1--5 in the Periodic Table. Their characteristic features, such as classical turning points and minimum potential radii, faithfully reflect the chemical regularities of the Periodic Table. The nonempirical nature of these potentials permits both an analysis of their dominant features in terms of the underlying interelectronic potentials and the systematic improvement of their predictions through inclusion of appropriate correlation terms. As these potentials accurately reproduce both energy eigenvalues and wave functions and can be readily fit to analytic forms with known asymptotic behavior, they can be used directly for studies of many structural and electronic properties of solids

Plane-wave least-squares reverse-time migration

KAUST Repository

Dai, Wei; Schuster, Gerard T.

2013-01-01

. The merits of plane-wave prestack LSRTM are the following: (1) plane-wave prestack LSRTM can sometimes offer stable convergence even when the migration velocity has bulk errors of up to 5%; (2) to significantly reduce computation cost, linear phase

Interaction of gravitational plane waves

International Nuclear Information System (INIS)

Ferrari, V.

1988-01-01

The mathematical theory of colliding, infinite-fronted, plane gravitational waves is presented. The process of focusing, the creation of singularities and horizons, due to the interaction, and the lens effect due to a beam-like gravitational wave are discussed

Plane wave limits and T-duality

International Nuclear Information System (INIS)

Guven, R.

2000-04-01

The Penrose limit is generalized to show that, any leading order solution of the low-energy field equations in any one of the five string theories has a plane wave solution as a limit. This limiting procedure takes into account all the massless fields that may arise and commutes with the T-duality so that any dual solution has again a plane wave limit. The scaling rules used in the limit are unique and stem from the scaling property of the D = 11 supergravity action. Although the leading order dual solutions need not be exact or supersymmetric, their plane wave limits always preserve some portion of the Poincare supersymmetry and solve the relevant field equations in all powers of the string tension parameter. Further properties of the limiting procedure are discussed. (author)

Mixed ultrasoft/norm-conserved pseudopotential scheme

DEFF Research Database (Denmark)

Stokbro, Kurt

1996-01-01

A variant of the Vanderbilt ultrasoft pseudopotential scheme, where the norm conservation is released for only one or a few angular channels, is presented. Within this scheme some difficulties of the truly ultrasoft pseudopotentials are overcome without sacrificing the pseudopotential softness. (...

Photoelectron wave function in photoionization: plane wave or Coulomb wave?

Science.gov (United States)

Gozem, Samer; Gunina, Anastasia O; Ichino, Takatoshi; Osborn, David L; Stanton, John F; Krylov, Anna I

2015-11-19

The calculation of absolute total cross sections requires accurate wave functions of the photoelectron and of the initial and final states of the system. The essential information contained in the latter two can be condensed into a Dyson orbital. We employ correlated Dyson orbitals and test approximate treatments of the photoelectron wave function, that is, plane and Coulomb waves, by comparing computed and experimental photoionization and photodetachment spectra. We find that in anions, a plane wave treatment of the photoelectron provides a good description of photodetachment spectra. For photoionization of neutral atoms or molecules with one heavy atom, the photoelectron wave function must be treated as a Coulomb wave to account for the interaction of the photoelectron with the +1 charge of the ionized core. For larger molecules, the best agreement with experiment is often achieved by using a Coulomb wave with a partial (effective) charge smaller than unity. This likely derives from the fact that the effective charge at the centroid of the Dyson orbital, which serves as the origin of the spherical wave expansion, is smaller than the total charge of a polyatomic cation. The results suggest that accurate molecular photoionization cross sections can be computed with a modified central potential model that accounts for the nonspherical charge distribution of the core by adjusting the charge in the center of the expansion.

DLCQ and plane wave matrix Big Bang models

Science.gov (United States)

Blau, Matthias; O'Loughlin, Martin

2008-09-01

We study the generalisations of the Craps-Sethi-Verlinde matrix big bang model to curved, in particular plane wave, space-times, beginning with a careful discussion of the DLCQ procedure. Singular homogeneous plane waves are ideal toy-models of realistic space-time singularities since they have been shown to arise universally as their Penrose limits, and we emphasise the role played by the symmetries of these plane waves in implementing the flat space Seiberg-Sen DLCQ prescription for these curved backgrounds. We then analyse various aspects of the resulting matrix string Yang-Mills theories, such as the relation between strong coupling space-time singularities and world-sheet tachyonic mass terms. In order to have concrete examples at hand, in an appendix we determine and analyse the IIA singular homogeneous plane wave - null dilaton backgrounds.

DLCQ and plane wave matrix Big Bang models

International Nuclear Information System (INIS)

Blau, Matthias; O'Loughlin, Martin

2008-01-01

We study the generalisations of the Craps-Sethi-Verlinde matrix big bang model to curved, in particular plane wave, space-times, beginning with a careful discussion of the DLCQ procedure. Singular homogeneous plane waves are ideal toy-models of realistic space-time singularities since they have been shown to arise universally as their Penrose limits, and we emphasise the role played by the symmetries of these plane waves in implementing the flat space Seiberg-Sen DLCQ prescription for these curved backgrounds. We then analyse various aspects of the resulting matrix string Yang-Mills theories, such as the relation between strong coupling space-time singularities and world-sheet tachyonic mass terms. In order to have concrete examples at hand, in an appendix we determine and analyse the IIA singular homogeneous plane wave - null dilaton backgrounds.

Plane waves and spacelike infinity

International Nuclear Information System (INIS)

Marolf, Donald; Ross, Simon F

2003-01-01

In an earlier paper, we showed that the causal boundary of any homogeneous plane wave satisfying the null convergence condition consists of a single null curve. In Einstein-Hilbert gravity, this would include any homogeneous plane wave satisfying the weak null energy condition. For conformally flat plane waves such as the Penrose limit of AdS 5 x S 5 , all spacelike curves that reach infinity also end on this boundary and the completion is Hausdorff. However, the more generic case (including, e.g., the Penrose limits of AdS 4 x S 7 and AdS 7 x S 4 ) is more complicated. In one natural topology, not all spacelike curves have limit points in the causal completion, indicating the need to introduce additional points at 'spacelike infinity' - the endpoints of spacelike curves. We classify the distinct ways in which spacelike curves can approach infinity, finding a two-dimensional set of distinct limits. The dimensionality of the set of points at spacelike infinity is not, however, fixed from this argument. In an alternative topology, the causal completion is already compact, but the completion is non-Hausdorff

A differentiated plane wave as an electromagnetic vortex

International Nuclear Information System (INIS)

Hannay, J H; Nye, J F

2015-01-01

Differentiating a complex scalar plane wave with respect to its direction produces an isolated straight vortex line and has a natural extension, described in earlier papers, to the vector waves of electromagnetism—a differentiated plane wave (DPW). It epitomizes destructive interference and will be shown to have the local structure of an electromagnetic vortex. In this paper its polarization structure and Poynting vector field are compared and contrasted with that of the family of linear polynomial waves, of which it is a special member. By definition this wider family has a general linear complex vector function of position multiplying a plane wave, but the function must be such that the combination satisfies Maxwell’s equations. This forces translational invariance of the function along the wavevector direction—in other words the wave is ‘non-diffracting’. In a natural sense all possible polarizations are exhibited once only. But the DPW has a distinctive polarization structure only partly explored previously. Both classes of waves share similar Poynting vector fields, which can be ‘elliptic’ (helix-like flow lines) or ‘hyperbolic’, of a repulsive nature, unexpected for a vortex. Both classes can be considered as a limit in the superposition of three closely parallel ordinary plane waves in destructive interference, and this derivation is supplied in full here. (paper)

Investigation of optical effects in silicon quantum dots by using an empirical pseudopotential method

Energy Technology Data Exchange (ETDEWEB)

Ghoshal, S. K.; Sahar, M. R.; Rohani, M. S. [Universiti Teknologi Malaysia, Johor (Malaysia)

2011-02-15

A computer simulation using a pseudopotential approach has been carried out to investigate the band gap as a function of the size and the shape of small silicon (Si) dots having 3 to 44 atoms per dot with and without surface passivation. We used an empirical pseudo-potential Hamiltonian, a plane-wave basis expansion and a basic tetrahedral structure with undistorted local bonding configurations. In our simulation, the structures of the quantum dots were relaxed and optimized before and after passivation. We found that the gap increased more for an oxygenated surface than a hydrogenated one. Thus, both quantum confinement and surface passivation determined the optical and the electronic properties of Si quantum dots. Visible luminescence was probably due to radiative recombination of electrons and holes in the quantum-confined nanostructures. The effect of passivation of the surface dangling bonds by hydrogen and oxygen atoms and the role of surface states on the gap energy was also examined. We investigated the entire energy spectrum starting from the very low-lying ground state to the very high-lying excited states. The results for the sizes of the gap, the density of states, the oscillator strength and the absorption coefficient as functions of the size are presented. The importance of the confinement and the role of surface passivation on the optical effects are also discussed.

The geometry of plane waves in spaces of constant curvature

International Nuclear Information System (INIS)

Tran, H.V.

1988-01-01

We examined the geometry of possible plane wave fronts in spaces of constant curvature for three cases in which the cosmological constant is positive, zero, or negative. The cosmological constant and a second-order invariant determined by a congruence of null rays were used in the investigation. We embedded the spaces under investigation in a flat five-dimensional space, and studied the null hyperplanes passing through the origin of the flat five-dimensional space. The embedded spaces are represented by quadrics in the five-dimensional space. The plane wave fronts are represented by the intersection of the quadric with null hyperplanes passing through the origin of the five-dimensional space. We concluded that in Minkowski spaces (zero cosmological constant), the plane-fronted waves will intersect if and only if the second-order invariant mentioned above is non-zero. For deSitter spaces (positive cosmological constant), plane-fronted waves will always intersect. For anti-deSitter spaces (negative cosmological constant), plane-fronted waves may but need not intersect

Plane-wave Least-squares Reverse Time Migration

KAUST Repository

Dai, Wei

2012-11-04

Least-squares reverse time migration is formulated with a new parameterization, where the migration image of each shot is updated separately and a prestack image is produced with common image gathers. The advantage is that it can offer stable convergence for least-squares migration even when the migration velocity is not completely accurate. To significantly reduce computation cost, linear phase shift encoding is applied to hundreds of shot gathers to produce dozens of planes waves. A regularization term which penalizes the image difference between nearby angles are used to keep the prestack image consistent through all the angles. Numerical tests on a marine dataset is performed to illustrate the advantages of least-squares reverse time migration in the plane-wave domain. Through iterations of least-squares migration, the migration artifacts are reduced and the image resolution is improved. Empirical results suggest that the LSRTM in plane wave domain is an efficient method to improve the image quality and produce common image gathers.

Plane-Wave Implementation and Performance of à-la-Carte Coulomb-Attenuated Exchange-Correlation Functionals for Predicting Optical Excitation Energies in Some Notorious Cases.

Science.gov (United States)

Bircher, Martin P; Rothlisberger, Ursula

2018-06-12

Linear-response time-dependent density functional theory (LR-TD-DFT) has become a valuable tool in the calculation of excited states of molecules of various sizes. However, standard generalized-gradient approximation and hybrid exchange-correlation (xc) functionals often fail to correctly predict charge-transfer (CT) excitations with low orbital overlap, thus limiting the scope of the method. The Coulomb-attenuation method (CAM) in the form of the CAM-B3LYP functional has been shown to reliably remedy this problem in many CT systems, making accurate predictions possible. However, in spite of a rather consistent performance across different orbital overlap regimes, some pitfalls remain. Here, we present a fully flexible and adaptable implementation of the CAM for Γ-point calculations within the plane-wave pseudopotential molecular dynamics package CPMD and explore how customized xc functionals can improve the optical spectra of some notorious cases. We find that results obtained using plane waves agree well with those from all-electron calculations employing atom-centered bases, and that it is possible to construct a new Coulomb-attenuated xc functional based on simple considerations. We show that such a functional is able to outperform CAM-B3LYP in some cases, while retaining similar accuracy in systems where CAM-B3LYP performs well.

Plane-Wave Imaging Challenge in Medical Ultrasound

DEFF Research Database (Denmark)

Liebgott, Herve; Molares, Alfonso Rodriguez; Jensen, Jørgen Arendt

2016-01-01

for this effect, but comparing the different methods is difficult due to the lack of appropriate tools. PICMUS, the Plane-Wave Imaging Challenge in Medical Ultrasound aims to provide these tools. This paper describes the PICMUS challenge, its motivation, implementation, and metrics.......Plane-Wave imaging enables very high frame rates, up to several thousand frames per second. Unfortunately the lack of transmit focusing leads to reduced image quality, both in terms of resolution and contrast. Recently, numerous beamforming techniques have been proposed to compensate...

Pseudo-potential method for taking into account the Pauli principle in cluster systems

International Nuclear Information System (INIS)

Krasnopol'skii, V.M.; Kukulin, V.I.

1975-01-01

In order to take account of the Pauli principle in cluster systems (such as 3α, α + α + n) a convenient method of renormalization of the cluster-cluster deep attractive potentials with forbidden states is suggested. The renormalization consists of adding projectors upon the occupied states with an infinite coupling constant to the initial deep potential which means that we pass to pseudo-potentials. The pseudo-potential approach in projecting upon the noneigenstates is shown to be equivalent to the orthogonality condition model of Saito et al. The orthogonality of the many-particle wave function to the forbidden states of each two-cluster sub-system is clearly demonstrated

Pseudopotentials for quantum-Monte-Carlo-calculations

International Nuclear Information System (INIS)

Burkatzki, Mark Thomas

2008-01-01

The author presents scalar-relativistic energy-consistent Hartree-Fock pseudopotentials for the main-group and 3d-transition-metal elements. The pseudopotentials do not exhibit a singularity at the nucleus and are therefore suitable for quantum Monte Carlo (QMC) calculations. The author demonstrates their transferability through extensive benchmark calculations of atomic excitation spectra as well as molecular properties. In particular, the author computes the vibrational frequencies and binding energies of 26 first- and second-row diatomic molecules using post Hartree-Fock methods, finding excellent agreement with the corresponding all-electron values. The author shows that the presented pseudopotentials give superior accuracy than other existing pseudopotentials constructed specifically for QMC. The localization error and the efficiency in QMC are discussed. The author also presents QMC calculations for selected atomic and diatomic 3d-transitionmetal systems. Finally, valence basis sets of different sizes (VnZ with n=D,T,Q,5 for 1st and 2nd row; with n=D,T for 3rd to 5th row; with n=D,T,Q for the 3d transition metals) optimized for the pseudopotentials are presented. (orig.)

Goedel, Penrose, anti-Mach: extra supersymmetries of time-dependent plane waves

International Nuclear Information System (INIS)

Blau, Matthias; O'Loughlin, Martin; Meessen, Patrick

2003-01-01

We prove that M-theory plane waves with extra supersymmetries are necessarily homogeneous (but possibly time-dependent), and we show by explicit construction that such time-dependent plane waves can admit extra supersymmetries. To that end we study the Penrose limits of Goedel-like metrics, show that the Penrose limit of the M-theory Goedel metric (with 20 supercharges) is generically a time-dependent homogeneous plane wave of the anti-Mach type, and display the four extra Killings spinors in that case. We conclude with some general remarks on the Killing spinor equations for homogeneous plane waves. (author)

Goedel, Penrose, anti-Mach: extra supersymmetries of time-dependent plane waves

Energy Technology Data Exchange (ETDEWEB)

Blau, Matthias; O' Loughlin, Martin; Meessen, Patrick [SISSA/ISAS, Via Beirut 2-4, 34014 Trieste (Italy)]. E-mail: meessen@sissa.it

2003-09-01

We prove that M-theory plane waves with extra supersymmetries are necessarily homogeneous (but possibly time-dependent), and we show by explicit construction that such time-dependent plane waves can admit extra supersymmetries. To that end we study the Penrose limits of Goedel-like metrics, show that the Penrose limit of the M-theory Goedel metric (with 20 supercharges) is generically a time-dependent homogeneous plane wave of the anti-Mach type, and display the four extra Killings spinors in that case. We conclude with some general remarks on the Killing spinor equations for homogeneous plane waves. (author)

Plane waves with weak singularities

International Nuclear Information System (INIS)

David, Justin R.

2003-03-01

We study a class of time dependent solutions of the vacuum Einstein equations which are plane waves with weak null singularities. This singularity is weak in the sense that though the tidal forces diverge at the singularity, the rate of divergence is such that the distortion suffered by a freely falling observer remains finite. Among such weak singular plane waves there is a sub-class which does not exhibit large back reaction in the presence of test scalar probes. String propagation in these backgrounds is smooth and there is a natural way to continue the metric beyond the singularity. This continued metric admits string propagation without the string becoming infinitely excited. We construct a one parameter family of smooth metrics which are at a finite distance in the space of metrics from the extended metric and a well defined operator in the string sigma model which resolves the singularity. (author)

A plane-wave final-state theory of ATI

International Nuclear Information System (INIS)

Parker, J.S.; Clark, C.W.

1993-01-01

A Fermi Golden Rule calculation of ionization cross-sections provides us with the simplest example of a plane-wave final-state theory. In this method the final (unbound) state is modeled as a plane wave, an approximation that generally gives best results in the high energy limit in which the affect of the atomic potential on the final state can be neglected. A cross-section is then calculated from the matrix element connecting the bound initial state with the final state. The idea of generalizing this method to model transitions among unbound states is credited to L.V. Keldysh, and a number of related formalisms have been proposed that are consistent with the general features of experimental data. Here we describe a plane-wave final-state model of ATI that is in the spirit of these theories, but differs significantly in its implementation and predictions. We will present a comparison of the predictions of the plane-wave model with those of a full numerical integration of the time-dependent Schrodinger equation for atomic hydrogen in a radiation field. The theory and the numerical integration give good qualitative agreement in their predictions of photoelectron spectra over about 14 orders of magnitude

New family of exact solutions for colliding plane gravitational waves

International Nuclear Information System (INIS)

Yurtsever, U.

1988-01-01

We construct an infinite-parameter family of exact solutions to the vacuum Einstein field equations describing colliding gravitational plane waves with parallel polarizations. The interaction regions of the solutions in this family are locally isometric to the interiors of those static axisymmetric (Weyl) black-hole solutions which admit both a nonsingular horizon, and an analytic extension of the exterior metric to the interior of the horizon. As a member of this family of solutions we also obtain, for the first time, a colliding plane-wave solution where both of the two incoming plane waves are purely anastigmatic, i.e., where both incoming waves have equal focal lengths

Plane waves and structures in turbulent channel flow

Science.gov (United States)

Sirovich, L.; Ball, K. S.; Keefe, L. R.

1990-01-01

A direct simulation of turbulent flow in a channel is analyzed by the method of empirical eigenfunctions (Karhunen-Loeve procedure, proper orthogonal decomposition). This analysis reveals the presence of propagating plane waves in the turbulent flow. The velocity of propagation is determined by the flow velocity at the location of maximal Reynolds stress. The analysis further suggests that the interaction of these waves appears to be essential to the local production of turbulence via bursting or sweeping events in the turbulent boundary layer, with the additional suggestion that the fast acting plane waves act as triggers.

Problems of the orthogonalized plane wave method. 1

International Nuclear Information System (INIS)

Farberovich, O.V.; Kurganskii, S.I.; Domashevskaya, E.P.

1979-01-01

The main problems of the orthogonalized plane wave method are discussed including (a) consideration of core states; (b) effect of overlap of wave functions of external core states upon the band structure; (c) calculation of d-type states. The modified orthogonal plane wave method (MOPW method) of Deegan and Twose is applied in a general form to solve the problems of the usual OPW method. For the first time the influence on the spectrum of the main parameters of the MOPW method is studied systematically by calculating the electronic energy spectrum in the transition metals Nb and V. (author)

Tunnelling of plane waves through a square barrier

Energy Technology Data Exchange (ETDEWEB)

Julve, J [IMAFF, Consejo Superior de Investigaciones CientIficas, Serrano 113 bis, Madrid 28006 (Spain); UrrIes, F J de [Departamento de Fisica, Universidad de Alcala de Henares, Alcala de Henares, Madrid (Spain)], E-mail: julve@imaff.cfmac.csic.es, E-mail: fernando.urries@uah.es

2008-08-01

The time evolution of plane waves in the presence of a one-dimensional square quantum barrier is considered. Comparison is made between the cases of an infinite and a cut-off (shutter) initial plane wave. The difference is relevant when the results are applied to the analysis of the tunnelling regime. This work is focused on the analytical calculation of the time-evolved solution and highlights the contribution of the resonant (Gamow) states.

The PSEUDODOJO: Training and grading a 85 element optimized norm-conserving pseudopotential table

Science.gov (United States)

van Setten, M. J.; Giantomassi, M.; Bousquet, E.; Verstraete, M. J.; Hamann, D. R.; Gonze, X.; Rignanese, G.-M.

2018-05-01

First-principles calculations in crystalline structures are often performed with a planewave basis set. To make the number of basis functions tractable two approximations are usually introduced: core electrons are frozen and the diverging Coulomb potential near the nucleus is replaced by a smoother expression. The norm-conserving pseudopotential was the first successful method to apply these approximations in a fully ab initio way. Later on, more efficient and more exact approaches were developed based on the ultrasoft and the projector augmented wave formalisms. These formalisms are however more complex and developing new features in these frameworks is usually more difficult than in the norm-conserving framework. Most of the existing tables of norm-conserving pseudopotentials, generated long ago, do not include the latest developments, are not systematically tested or are not designed primarily for high precision. In this paper, we present our PSEUDODOJO framework for developing and testing full tables of pseudopotentials, and demonstrate it with a new table generated with the ONCVPSP approach. The PSEUDODOJO is an open source project, building on the ABIPY package, for developing and systematically testing pseudopotentials. At present it contains 7 different batteries of tests executed with ABINIT, which are performed as a function of the energy cutoff. The results of these tests are then used to provide hints for the energy cutoff for actual production calculations. Our final set contains 141 pseudopotentials split into a standard and a stringent accuracy table. In total around 70,000 calculations were performed to test the pseudopotentials. The process of developing the final table led to new insights into the effects of both the core-valence partitioning and the non-linear core corrections on the stability, convergence, and transferability of norm-conserving pseudopotentials. The PSEUDODOJO hence provides a set of pseudopotentials and general purpose tools

A differentiated plane wave: its passage through a slab

International Nuclear Information System (INIS)

Hannay, J H; Nye, J F

2013-01-01

Differentiating a monochromatic uniform plane electromagnetic wavefield with respect to its direction produces, from a field that is completely lacking in localized specific features, one that contains a straight vortex-like line, a ‘C-line’ of defined circular polarization. There is also a second separate C-line of opposite handedness; indeed, in a sense, a straight line of every polarization is realized. Because of its primitive construction it is analytically simple to study the passage of a differentiated wave obliquely through a plane interface into a medium of different refractive index, to trace its C-line. This was done in an earlier paper. Here we extend the method to passage through a parallel-sided transparent slab. There are multiple reflections within the slab, as in a Fabry–Pérot interferometer. The exiting wave, as a single differentiated plane wave, has a straight oblique C-line. Inside the slab, and in front of it, there is wave interference. The result is a coiled, helix-like, C-line in front of the slab and another inside it. The two coils wrap around separate hyperboloids of one sheet, like cooling towers. The emerging straight C-line is shifted (with respect to a C-line in a notional undisturbed incident plane wave) both in the plane of incidence and transversely to it, and the second C-line behaves similarly. The analysis is exact and could be extended in a straightforward way to a general stratified medium. (paper)

Ground penetrating radar antenna measurements based on plane-wave expansions

DEFF Research Database (Denmark)

Lenler-Eriksen, Hans-Rudolph; Meincke, Peter

2005-01-01

The plane-wave transmitting spectrum of the system consisting of the ground penetrating radar (GPR) antenna and the air-soil interface is measured using a loop buried in the soil. The plane-wave spectrum is used to determine various parameters characterizing the radiation of the GPR antenna...

Plane-Wave Characterization of Antennas Close to a Planar Interface

DEFF Research Database (Denmark)

Meincke, Peter; Hansen, Thorkild

2004-01-01

The plane-wave scattering matrix is used to characterize antennas that are located just above a planar interface that separates two media. The plane-wave transmitting spectrum for the field radiated downwards into the lower medium is expressed directly in terms of the current distribution of the ...

Scattering on plane waves and the double copy

Science.gov (United States)

Adamo, Tim; Casali, Eduardo; Mason, Lionel; Nekovar, Stefan

2018-01-01

Perturbatively around flat space, the scattering amplitudes of gravity are related to those of Yang–Mills by colour-kinematic duality, under which gravitational amplitudes are obtained as the ‘double copy’ of the corresponding gauge theory amplitudes. We consider the question of how to extend this relationship to curved scattering backgrounds, focusing on certain ‘sandwich’ plane waves. We calculate the 3-point amplitudes on these backgrounds and find that a notion of double copy remains in the presence of background curvature: graviton amplitudes on a gravitational plane wave are the double copy of gluon amplitudes on a gauge field plane wave. This is non-trivial in that it requires a non-local replacement rule for the background fields and the momenta and polarization vectors of the fields scattering on the backgrounds. It must also account for new ‘tail’ terms arising from scattering off the background. These encode a memory effect in the scattering amplitudes, which naturally double copies as well.

Parallel Multi-Focusing Using Plane Wave Decomposition

DEFF Research Database (Denmark)

Misaridis, Thanassis; Munk, Peter; Jensen, Jørgen Arendt

2003-01-01

of desired 2-D sensitivity functions is specified, for multi-focusing in a number of directions. The field along these directions is decomposed to a sufficiently large (for accurate specification) number of plane waves, which are then back-propagated to all transducer elements. The contributions of all plane...... waves result in one time function per element. The numerical solution is presented and discussed. It contains pulses with a variation in central frequency and time-varying apodization across the aperture (dynamic apodization). The RMS difference between the transmitted field using the calculated pulse...... of the transmitted pulses is based on the directivity spectrum method, a generalization of the angular spectrum method, a generalization of the angular spectrum method, containing no evanescent waves. The underlying theory is based on the Fourier slice theorem, and field reconstruction from projections. First a set...

The Fermi pseudo-potential in one dimension

International Nuclear Information System (INIS)

Coutinho, F A B; Nogami, Y; Tomio, Lauro; Toyama, F M

2004-01-01

Wu and Yu recently examined point interactions in one dimension in the form of the Fermi pseudo-potential. On the other hand there are point interactions in the form of self-adjoint extensions (SAEs) of the kinetic energy operator. We examine the relationship between the point interactions in these two forms in the one-channel and two-channel cases. In the one-channel case the pseudo-potential leads to the standard three-parameter family of SAEs. In the two-channel case the pseudo-potential furnishes a ten-parameter family of SAEs

Quantum scattering beyond the plane-wave approximation

Science.gov (United States)

Karlovets, Dmitry

2017-12-01

While a plane-wave approximation in high-energy physics works well in a majority of practical cases, it becomes inapplicable for scattering of the vortex particles carrying orbital angular momentum, of Airy beams, of the so-called Schrödinger cat states, and their generalizations. Such quantum states of photons, electrons and neutrons have been generated experimentally in recent years, opening up new perspectives in quantum optics, electron microscopy, particle physics, and so forth. Here we discuss the non-plane-wave effects in scattering brought about by the novel quantum numbers of these wave packets. For the well-focused electrons of intermediate energies, already available at electron microscopes, the corresponding contribution can surpass that of the radiative corrections. Moreover, collisions of the cat-like superpositions of such focused beams with atoms allow one to probe effects of the quantum interference, which have never played any role in particle scattering.

Revised Huang-Yang multipolar pseudopotential

International Nuclear Information System (INIS)

Derevianko, Andrei

2005-01-01

A number of authors have recently pointed out inconsistencies of results obtained with the Huang-Yang multipolar pseudopotential for low-energy scattering [K. Huang and K. C. Yang, Phys. Rev. 105, 767 (1957); later revised by Huang, Statistical Mechanics (Wiley, New York, 1963)]. The conceptual validity of their original derivation has been questioned. Here I show that these inconsistencies are rather due to an algebraic mistake made by Huang and Yang. With the corrected error, I present the revised version of the multipolar pseudopotential

Ion-acoustic cnoidal waves in a quantum plasma

International Nuclear Information System (INIS)

Mahmood, S.; Haas, F.

2014-01-01

Nonlinear ion-acoustic cnoidal wave structures are studied in an unmagnetized quantum plasma. Using the reductive perturbation method, a Korteweg-de Vries equation is derived for appropriate boundary conditions and nonlinear periodic wave solutions are obtained. The corresponding analytical solution and numerical plots of the ion-acoustic cnoidal waves and solitons in the phase plane are presented using the Sagdeev pseudo-potential approach. The variations in the nonlinear potential of the ion-acoustic cnoidal waves are studied at different values of quantum parameter H e which is the ratio of electron plasmon energy to electron Fermi energy defined for degenerate electrons. It is found that both compressive and rarefactive ion-acoustic cnoidal wave structures are formed depending on the value of the quantum parameter. The dependence of the wavelength and frequency on nonlinear wave amplitude is also presented

Xα method with pseudopotentials

International Nuclear Information System (INIS)

Szasz, L.

1980-01-01

The Xα method for an atom or molecule is transformed into an all-electron pseudopotential formalism. The equations of the Xα method are exactly transformed into pseudo-orbital equations and the resulting pseudopotentials are replaced by simple density-dependent potentials derived from Thomas-Fermi model. It is shown that the new formalism satisfies the virial theorem. As the first application it is shown that the model explains the shell-structure of atoms by the property that the pseudo-orbitals for the (ns), (np), (nd) etc. electrons are, in a very good approximation, the solutions of the same equation and have their maxima at the same point thereby creating the peaks in the radial density characterizing the shell structure. (orig.)

Blackfolds, plane waves and minimal surfaces

Science.gov (United States)

Armas, Jay; Blau, Matthias

2015-07-01

Minimal surfaces in Euclidean space provide examples of possible non-compact horizon geometries and topologies in asymptotically flat space-time. On the other hand, the existence of limiting surfaces in the space-time provides a simple mechanism for making these configurations compact. Limiting surfaces appear naturally in a given space-time by making minimal surfaces rotate but they are also inherent to plane wave or de Sitter space-times in which case minimal surfaces can be static and compact. We use the blackfold approach in order to scan for possible black hole horizon geometries and topologies in asymptotically flat, plane wave and de Sitter space-times. In the process we uncover several new configurations, such as black helicoids and catenoids, some of which have an asymptotically flat counterpart. In particular, we find that the ultraspinning regime of singly-spinning Myers-Perry black holes, described in terms of the simplest minimal surface (the plane), can be obtained as a limit of a black helicoid, suggesting that these two families of black holes are connected. We also show that minimal surfaces embedded in spheres rather than Euclidean space can be used to construct static compact horizons in asymptotically de Sitter space-times.

Blackfolds, plane waves and minimal surfaces

Energy Technology Data Exchange (ETDEWEB)

Armas, Jay [Physique Théorique et Mathématique, Université Libre de Bruxelles and International Solvay Institutes, ULB-Campus Plaine CP231, B-1050 Brussels (Belgium); Albert Einstein Center for Fundamental Physics, University of Bern,Sidlerstrasse 5, 3012 Bern (Switzerland); Blau, Matthias [Albert Einstein Center for Fundamental Physics, University of Bern,Sidlerstrasse 5, 3012 Bern (Switzerland)

2015-07-29

Minimal surfaces in Euclidean space provide examples of possible non-compact horizon geometries and topologies in asymptotically flat space-time. On the other hand, the existence of limiting surfaces in the space-time provides a simple mechanism for making these configurations compact. Limiting surfaces appear naturally in a given space-time by making minimal surfaces rotate but they are also inherent to plane wave or de Sitter space-times in which case minimal surfaces can be static and compact. We use the blackfold approach in order to scan for possible black hole horizon geometries and topologies in asymptotically flat, plane wave and de Sitter space-times. In the process we uncover several new configurations, such as black helicoids and catenoids, some of which have an asymptotically flat counterpart. In particular, we find that the ultraspinning regime of singly-spinning Myers-Perry black holes, described in terms of the simplest minimal surface (the plane), can be obtained as a limit of a black helicoid, suggesting that these two families of black holes are connected. We also show that minimal surfaces embedded in spheres rather than Euclidean space can be used to construct static compact horizons in asymptotically de Sitter space-times.

Diffraction of love waves by two parallel perfectly weak half planes

International Nuclear Information System (INIS)

Asghar, S.; Zaman, F.D.; Ayub, M.

1986-04-01

We consider the diffraction of Love waves by two parallel perfectly weak half planes in a layer overlying a half space. The problem is formulated in terms of the Wiener-Hopf equations in the transformed plane. The transmitted waves are then calculated using the Wiener-Hopf procedure and inverse transforms. (author)

Plane-wave Least-squares Reverse Time Migration

KAUST Repository

Dai, Wei; Schuster, Gerard T.

2012-01-01

convergence for least-squares migration even when the migration velocity is not completely accurate. To significantly reduce computation cost, linear phase shift encoding is applied to hundreds of shot gathers to produce dozens of planes waves. A

Regularized plane-wave least-squares Kirchhoff migration

KAUST Repository

Wang, Xin; Dai, Wei; Schuster, Gerard T.

2013-01-01

A Kirchhoff least-squares migration (LSM) is developed in the prestack plane-wave domain to increase the quality of migration images. A regularization term is included that accounts for mispositioning of reflectors due to errors in the velocity

Dirac particle in a plane wave field and the semi-classical approximation

Energy Technology Data Exchange (ETDEWEB)

Bourouaine, S. [Department of Physics, Faculty of Sciences, Mentouri University, Constantine (Algeria)

2005-04-01

In this paper we investigate the influence of photon represented by plane wave field on Dirac particle in the context of path integral approach given by Fradkin and Gitman formalism. In our case, although the action relative to Dirac particle in plane wave field seems to be non quadratic, the result obtained by semi-classical approach is the same as that found by an exact calculation. Hence; when we add the plane wave field to any quadratic actions related to Fradkin and Gitman approach, the total action behaves like quadratic. (Abstract Copyright [2005], Wiley Periodicals, Inc.)

Dirac particle in a plane wave field and the semi-classical approximation

International Nuclear Information System (INIS)

Bourouaine, S.

2005-01-01

In this paper we investigate the influence of photon represented by plane wave field on Dirac particle in the context of path integral approach given by Fradkin and Gitman formalism. In our case, although the action relative to Dirac particle in plane wave field seems to be non quadratic, the result obtained by semi-classical approach is the same as that found by an exact calculation. Hence; when we add the plane wave field to any quadratic actions related to Fradkin and Gitman approach, the total action behaves like quadratic. (Abstract Copyright [2005], Wiley Periodicals, Inc.)

A new GTD slope diffraction coefficient for plane wave illumination of a wedge

DEFF Research Database (Denmark)

Lumholt, Michael; Breinbjerg, Olav

1997-01-01

Two wedge problems including slope diffraction are solved: one in which the incident field is a non-uniform plane wave, and one in which it is an inhomogeneous plane wave. The two solutions lead to the same GTD slope diffraction coefficient. This coefficient reveals the existence of a coupling...... effect between a transverse magnetic (or transverse electric) incident plane wave and the transverse electric (or transverse magnetic) slope-diffracted field. The coupling effect is not described by the existing GTD slope diffraction coefficient...

Diffraction of love waves by two staggered perfectly weak half-planes

International Nuclear Information System (INIS)

Asghar, S.; Zaman, F.D.; Sajida Asghar

1989-01-01

Love wave travelling in a layer of uniform thickness overlying a half-space is assumed to be incident on two parallel but staggered perfectly weak half-planes lying in the upper layer. The diffracted fields is calculated using the modified Wiener-Hopf technique and contour integration method. The diffracted waves satisfy the dispersion relations appropriate to different regions formed by the perfectly weak half-planes

Actinides and lanthanides under pressure: the pseudopotential approach

International Nuclear Information System (INIS)

Richard, N.

2002-01-01

In the Density Functional Theory Framework, the pseudopotential formalism offers a broader scope of study than other theoretical methods such as global relaxation of the parameters of the cell or ab initio molecular dynamics simulations. This method has been widely used to study light elements or transition metals but never to study f elements. We have generated two non local norm conserving Trouillier-Martins pseudopotentials (one in LDA and one in GGA) for the cerium. To check the validity of the pseudopotentials, we have calculated the equilibrium volume and the incompressibility modulus and compared our results to previous all-electron calculations. If the GGA and non linear core corrections are used, the equation of state is in a good agreement with the experimental equation of state. A static study of the previously proposed high pressure phases give a transitions fcc-a''(I)-bct. Using the pseudopotentials we have generated, an ab initio molecular dynamics simulation at constant pressure, in the region between 5 and 12 GPa where the stable phase of cerium is not well defined, lead us to predict that a centred monoclinic structure, as the a''(I) phase previously observed in some experiments, is the most stable phase. We have also generated pseudopotentials for the light actinides (Th, Pa, U and Np). We have study their phase transitions under pressure at zero temperature. We compared our results with all electron results. The structure parameters have always been relaxed in this study. And for the first time in pseudopotential calculation, the spin-orbit coupling has been taken into account. The curves describing the variation of the volume or the incompressibility modulus depending on the elements and the phase transitions are always in agreement with the one found in the all electron calculations. (author)

Synchrotron-radiation plane-wave topography

International Nuclear Information System (INIS)

Riglet, P.; Sauvage, M.; Petroff, J.F.; Epelboin, Y.

1980-01-01

A computer program based on the Takagi-Taupin differential equations for X-ray propagation in distorted crystals has been developed in order to simulate dislocation images in the Bragg case. The program is valid both for thin and thick crystals. Simulated images of misfit dislocations formed either in a thin epilayer or in a thick substrate are compared with experimental images obtained by synchrotron-radiation plane-wave topography. The influence of the various strain components on the image features is discussed. (author)

Tan's distributions and Fermi-Huang pseudopotential in momentum space

DEFF Research Database (Denmark)

Valiente, Manuel

2012-01-01

form of the Fourier-transformed pseudopotential remains very simple. Operator forms for the so-called Tan's selectors, which, together with Fermi-Huang pseudopotential, largely simplify the derivation of Tan's universal relations for the Fermi gas, are here derived and are also very simple. A momentum...

Superresolution Imaging Using Resonant Multiples and Plane-wave Migration Velocity Analysis

KAUST Repository

Guo, Bowen

2017-08-28

Seismic imaging is a technique that uses seismic echoes to map and detect underground geological structures. The conventional seismic image has the resolution limit of λ/2, where λ is the wavelength associated with the seismic waves propagating in the subsurface. To exceed this resolution limit, this thesis develops a new imaging method using resonant multiples, which produces superresolution images with twice or even more the spatial resolution compared to the conventional primary reflection image. A resonant multiple is defined as a seismic reflection that revisits the same subsurface location along coincident reflection raypath. This reverberated raypath is the reason for superresolution imaging because it increases the differences in reflection times associated with subtle changes in the spatial location of the reflector. For the practical implementation of superresolution imaging, I develop a post-stack migration technique that first enhances the signal-to-noise ratios (SNRs) of resonant multiples by a moveout-correction stacking method, and then migrates the post-stacked resonant multiples with the associated Kirchhoff or wave-equation migration formula. I show with synthetic and field data examples that the first-order resonant multiple image has about twice the spatial resolution compared to the primary reflection image. Besides resolution, the correct estimate of the subsurface velocity is crucial for determining the correct depth of reflectors. Towards this goal, wave-equation migration velocity analysis (WEMVA) is an image-domain method which inverts for the velocity model that maximizes the similarity of common image gathers (CIGs). Conventional WEMVA based on subsurface-offset, angle domain or time-lag CIGs requires significant computational and memory resources because it computes higher dimensional migration images in the extended image domain. To mitigate this problem, I present a new WEMVA method using plane-wave CIGs. Plane-wave CIGs reduce the

3D plane-wave least-squares Kirchhoff migration

KAUST Repository

Wang, Xin; Dai, Wei; Huang, Yunsong; Schuster, Gerard T.

2014-01-01

A three dimensional least-squares Kirchhoff migration (LSM) is developed in the prestack plane-wave domain to increase the quality of migration images and the computational efficiency. Due to the limitation of current 3D marine acquisition

Helical waves in easy-plane antiferromagnets

Science.gov (United States)

Semenov, Yuriy G.; Li, Xi-Lai; Xu, Xinyi; Kim, Ki Wook

2017-12-01

Effective spin torques can generate the Néel vector oscillations in antiferromagnets (AFMs). Here, it is theoretically shown that these torques applied at one end of a normal AFM strip can excite a helical type of spin wave in the strip whose properties are drastically different from characteristic spin waves. An analysis based on both a Néel vector dynamical equation and the micromagnetic simulation identifies the direction of magnetic anisotropy and the damping factor as the two key parameters determining the dynamics. Helical wave propagation requires the hard axis of the easy-plane AFM to be aligned with the traveling direction, while the damping limits its spatial extent. If the damping is neglected, the calculation leads to a uniform periodic domain wall structure. On the other hand, finite damping decelerates the helical wave rotation around the hard axis, ultimately causing stoppage of its propagation along the strip. With the group velocity staying close to spin-wave velocity at the wave front, the wavelength becomes correspondingly longer away from the excitation point. In a sufficiently short strip, a steady-state oscillation can be established whose frequency is controlled by the waveguide length as well as the excitation energy or torque.

Pitch angle scattering of an energetic magnetized particle by a circularly polarized electromagnetic wave

International Nuclear Information System (INIS)

Bellan, P. M.

2013-01-01

The interaction between a circularly polarized wave and an energetic gyrating particle is described using a relativistic pseudo-potential that is a function of the frequency mismatch. Analysis of the pseudo-potential provides a means for interpreting numerical results. The pseudo-potential profile depends on the initial mismatch, the normalized wave amplitude, and the initial angle between the wave magnetic field and the particle perpendicular velocity. For zero initial mismatch, the pseudo-potential consists of only one valley, but for finite mismatch, there can be two valleys separated by a hill. A large pitch angle scattering of the energetic electron can occur in the two-valley situation but fast scattering can also occur in a single valley. Examples relevant to magnetospheric whistler waves show that the energetic electron pitch angle can be deflected 5°towards the loss cone when transiting a 10 ms long coherent wave packet having realistic parameters.

Several localized waves induced by linear interference between a nonlinear plane wave and bright solitons

Science.gov (United States)

Qin, Yan-Hong; Zhao, Li-Chen; Yang, Zhan-Ying; Yang, Wen-Li

2018-01-01

We investigate linear interference effects between a nonlinear plane wave and bright solitons, which are admitted by a pair-transition coupled two-component Bose-Einstein condensate. We demonstrate that the interference effects can induce several localized waves possessing distinctive wave structures, mainly including anti-dark solitons, W-shaped solitons, multi-peak solitons, Kuznetsov-Ma like breathers, and multi-peak breathers. Specifically, the explicit conditions for them are clarified by a phase diagram based on the linear interference properties. Furthermore, the interactions between these localized waves are discussed. The detailed analysis indicates that the soliton-soliton interaction induced phase shift brings the collision between these localized waves which can be inelastic for solitons involving collision and can be elastic for breathers. These characters come from the fact that the profile of solitons depends on the relative phase between bright solitons and a plane wave, and the profile of breathers does not depend on the relative phase. These results would motivate more discussions on linear interference between other nonlinear waves. Specifically, the solitons or breathers obtained here are not related to modulational instability. The underlying reasons are discussed in detail. In addition, possibilities to observe these localized waves are discussed in a two species Bose-Einstein condensate.

In-Vivo Synthetic Aperture and Plane Wave High Frame Rate Cardiac Imaging

DEFF Research Database (Denmark)

Stuart, Matthias Bo; Jensen, Jonas; Brandt, Andreas Hjelm

2014-01-01

A comparison of synthetic aperture imaging using spherical and plane waves with low number of emission events is presented. For both wave types, a 90 degree sector is insonified using 15 emission events giving a frame rate of 200 frames per second. Field II simulations of point targets show simil.......43 for spherical and 0.70 for plane waves. All measures are well within FDA limits for cardiac imaging. In-vivo images of the heart of a healthy 28-year old volunteer are shown....

Trapped waves on the mid-latitude β-plane

Science.gov (United States)

Paldor, Nathan; Sigalov, Andrey

2008-08-01

A new type of approximate solutions of the Linearized Shallow Water Equations (LSWE) on the mid-latitude β-plane, zonally propagating trapped waves with Airy-like latitude-dependent amplitude, is constructed in this work, for sufficiently small radius of deformation. In contrast to harmonic Poincare and Rossby waves, these newly found trapped waves vanish fast in the positive half-axis, and their zonal phase speed is larger than that of the corresponding harmonic waves for sufficiently large meridional domains. Our analysis implies that due to the smaller radius of deformation in the ocean compared with that in the atmosphere, the trapped waves are relevant to observations in the ocean whereas harmonic waves typify atmospheric observations. The increase in the zonal phase speed of trapped Rossby waves compared with that of harmonic ones is consistent with recent observations that showed that Sea Surface Height features propagated westwards faster than the phase speed of harmonic Rossby waves.

An Apparatus for Constructing an Electromagnetic Plane Wave Model

Science.gov (United States)

Kneubil, Fabiana Botelho; Loures, Marcus Vinicius Russo; Amado, William

2015-01-01

In this paper we report on an activity aimed at building an electromagnetic wave. This was part of a class on the concept of mass offered to a group of 20 pre-service Brazilian physics teachers. The activity consisted of building a plane wave using an apparatus in which it is possible to fit some rods representing electric and magnetic fields into…

Plane Wave Medical Ultrasound Imaging Using Adaptive Beamforming

DEFF Research Database (Denmark)

Holfort, Iben Kraglund; Gran, Fredrik; Jensen, Jørgen Arendt

2008-01-01

In this paper, the adaptive, minimum variance (MV) beamformer is applied to medical ultrasound imaging. The Significant resolution and contrast gain provided by the adaptive, minimum variance (MV) beamformer, introduces the possibility of plane wave (PW) ultrasound imaging. Data is obtained using...

The Uniform geometrical Theory of Diffraction for elastodynamics: Plane wave scattering from a half-plane.

Science.gov (United States)

Djakou, Audrey Kamta; Darmon, Michel; Fradkin, Larissa; Potel, Catherine

2015-11-01

Diffraction phenomena studied in electromagnetism, acoustics, and elastodynamics are often modeled using integrals, such as the well-known Sommerfeld integral. The far field asymptotic evaluation of such integrals obtained using the method of steepest descent leads to the classical Geometrical Theory of Diffraction (GTD). It is well known that the method of steepest descent is inapplicable when the integrand's stationary phase point coalesces with its pole, explaining why GTD fails in zones where edge diffracted waves interfere with incident or reflected waves. To overcome this drawback, the Uniform geometrical Theory of Diffraction (UTD) has been developed previously in electromagnetism, based on a ray theory, which is particularly easy to implement. In this paper, UTD is developed for the canonical elastodynamic problem of the scattering of a plane wave by a half-plane. UTD is then compared to another uniform extension of GTD, the Uniform Asymptotic Theory (UAT) of diffraction, based on a more cumbersome ray theory. A good agreement between the two methods is obtained in the far field.

From plane waves to local Gaussians for the simulation of correlated periodic systems

International Nuclear Information System (INIS)

Booth, George H.; Tsatsoulis, Theodoros; Grüneis, Andreas; Chan, Garnet Kin-Lic

2016-01-01

We present a simple, robust, and black-box approach to the implementation and use of local, periodic, atom-centered Gaussian basis functions within a plane wave code, in a computationally efficient manner. The procedure outlined is based on the representation of the Gaussians within a finite bandwidth by their underlying plane wave coefficients. The core region is handled within the projected augment wave framework, by pseudizing the Gaussian functions within a cutoff radius around each nucleus, smoothing the functions so that they are faithfully represented by a plane wave basis with only moderate kinetic energy cutoff. To mitigate the effects of the basis set superposition error and incompleteness at the mean-field level introduced by the Gaussian basis, we also propose a hybrid approach, whereby the complete occupied space is first converged within a large plane wave basis, and the Gaussian basis used to construct a complementary virtual space for the application of correlated methods. We demonstrate that these pseudized Gaussians yield compact and systematically improvable spaces with an accuracy comparable to their non-pseudized Gaussian counterparts. A key advantage of the described method is its ability to efficiently capture and describe electronic correlation effects of weakly bound and low-dimensional systems, where plane waves are not sufficiently compact or able to be truncated without unphysical artifacts. We investigate the accuracy of the pseudized Gaussians for the water dimer interaction, neon solid, and water adsorption on a LiH surface, at the level of second-order Møller–Plesset perturbation theory.

From plane waves to local Gaussians for the simulation of correlated periodic systems

Energy Technology Data Exchange (ETDEWEB)

Booth, George H., E-mail: george.booth@kcl.ac.uk [Department of Physics, King’s College London, Strand, London WC2R 2LS (United Kingdom); Tsatsoulis, Theodoros; Grüneis, Andreas, E-mail: a.grueneis@fkf.mpg.de [Max Planck Institute for Solid State Research, Heisenbergstraße 1, 70569 Stuttgart (Germany); Chan, Garnet Kin-Lic [Frick Laboratory, Department of Chemistry, Princeton University, Princeton, New Jersey 08544 (United States)

2016-08-28

We present a simple, robust, and black-box approach to the implementation and use of local, periodic, atom-centered Gaussian basis functions within a plane wave code, in a computationally efficient manner. The procedure outlined is based on the representation of the Gaussians within a finite bandwidth by their underlying plane wave coefficients. The core region is handled within the projected augment wave framework, by pseudizing the Gaussian functions within a cutoff radius around each nucleus, smoothing the functions so that they are faithfully represented by a plane wave basis with only moderate kinetic energy cutoff. To mitigate the effects of the basis set superposition error and incompleteness at the mean-field level introduced by the Gaussian basis, we also propose a hybrid approach, whereby the complete occupied space is first converged within a large plane wave basis, and the Gaussian basis used to construct a complementary virtual space for the application of correlated methods. We demonstrate that these pseudized Gaussians yield compact and systematically improvable spaces with an accuracy comparable to their non-pseudized Gaussian counterparts. A key advantage of the described method is its ability to efficiently capture and describe electronic correlation effects of weakly bound and low-dimensional systems, where plane waves are not sufficiently compact or able to be truncated without unphysical artifacts. We investigate the accuracy of the pseudized Gaussians for the water dimer interaction, neon solid, and water adsorption on a LiH surface, at the level of second-order Møller–Plesset perturbation theory.

Fermi surface changes in dilute magnesium alloys: a pseudopotential band structure model

International Nuclear Information System (INIS)

Fung, W.K.

1976-01-01

The de Haas-van Alphen effect has been used to study the Fermi surface of pure magnesium and its dilute alloys containing lithium and indium. The quantum oscillations in magnetization were detected by means of a torque magnetometer in magnetic field up to 36 kilogauss and temperature range of 4.2 0 to 1.7 0 K. The results provide information on the effects of lithium and indium solutes on the Fermi surface of magnesium in changes of extremal cross sections and effective masses as well as the relaxation times associated with the orbits. The nonlocal pseudopotential model proposed by Kimball, Stark and Mueller has been fitted to the Fermi surface of magnesium and extended to include the dilute alloys, fitting all the observed de Haas-van Alphen frequencies with an accuracy of better than 1 percent. A modified rigid band interpretation including both Fermi energy and local band edge changes computed from the model, gives an overall satisfactory description of the observed frequency shifts. With the pseudo-wavefunctions provided by the nonlocal model, the relaxation times in terms of Dingle temperatures for several orbits have been predicted using Sorbello's multiple-plane-wave phase shift model. The calculation with phase shifts obtained from a model potential yields a greater anisotropy than has been observed experimentally, while a two-parameter phase shift model provides a good fit to the experimental results

The memory effect for plane gravitational waves

Science.gov (United States)

Zhang, P.-M.; Duval, C.; Gibbons, G. W.; Horvathy, P. A.

2017-09-01

We give an account of the gravitational memory effect in the presence of the exact plane wave solution of Einstein's vacuum equations. This allows an elementary but exact description of the soft gravitons and how their presence may be detected by observing the motion of freely falling particles. The theorem of Bondi and Pirani on caustics (for which we present a new proof) implies that the asymptotic relative velocity is constant but not zero, in contradiction with the permanent displacement claimed by Zel'dovich and Polnarev. A non-vanishing asymptotic relative velocity might be used to detect gravitational waves through the "velocity memory effect", considered by Braginsky, Thorne, Grishchuk, and Polnarev.

Traveling Wave Modes of a Plane Layered Anelastic Earth

Science.gov (United States)

2016-05-20

grant, “Coupled Modes in Elastic Bottoms” (1) is the publication “Traveling wave modes of a plane layered anelastic earth ” accepted for...anelastic earth Robert I. Odom Applied Physics Laboratory and Department of Earth and Space Sciences University of Washington, 1013 NE 40th St., Seattle...contrast to a similar standing wave problem for the earth free oscillations (Tromp and Dahlen, 1990). Attenuation is commonly incorporated into synthetic

Systematic pseudopotentials from reference eigenvalue sets for DFT calculations: Pseudopotential files

Directory of Open Access Journals (Sweden)

Pablo Rivero

2015-06-01

Full Text Available We present in this article a pseudopotential (PP database for DFT calculations in the context of the SIESTA code [1–3]. Comprehensive optimized PPs in two formats (psf files and input files for ATM program are provided for 20 chemical elements for LDA and GGA exchange-correlation potentials. Our data represents a validated database of PPs for SIESTA DFT calculations. Extensive transferability tests guarantee the usefulness of these PPs.

X. cap alpha. method with pseudopotentials

Energy Technology Data Exchange (ETDEWEB)

Szasz, L. (Fordham Univ., New York (USA). Dept. of Physics)

1980-06-01

The X..cap alpha.. method for an atom or molecule is transformed into an all-electron pseudopotential formalism. The equations of the X..cap alpha.. method are exactly transformed into pseudo-orbital equations and the resulting pseudopotentials are replaced by simple density-dependent potentials derived from Thomas-Fermi model. It is shown that the new formalism satisfies the virial theorem. As the first application, it is shown that the model explains the shell-structure of atoms by the property that the pseudo-orbitals for the (ns), (np), (nd), etc. electrons are, in a very good approximation, the solutions of the same equation and have their maxima at the same point thereby creating the peaks in the radial density characterizing the shell structure.

Multiphoton processes in the field of two-frequency circularly polarized plane electromagnetic waves

International Nuclear Information System (INIS)

Yu, An

1997-01-01

The authors solve Dirac's equation for an electron in the field of a two-frequency plane electromagnetic wave, deriving general formulae for the probabilities of radiation of a photon by the electron, and for the probabilities for pair production by a photon when the two-frequency wave is circularly polarized. In contrast to the case of a monochromatic-plane electromagnetic wave, when an electron is in the field of a two-frequency circularly polarized wave, besides the absorption of multiphotons and emission of simple harmonics of the individual waves, stimulated multiphoton emission processes and various composite harmonic-photon emission processes are occurred: when a high-energy photon is in a such a field, multiphoton processes also follow the pair production processes

Relativistic nuclear magnetic resonance J-coupling with ultrasoft pseudopotentials and the zeroth-order regular approximation

International Nuclear Information System (INIS)

Green, Timothy F. G.; Yates, Jonathan R.

2014-01-01

We present a method for the first-principles calculation of nuclear magnetic resonance (NMR) J-coupling in extended systems using state-of-the-art ultrasoft pseudopotentials and including scalar-relativistic effects. The use of ultrasoft pseudopotentials is allowed by extending the projector augmented wave (PAW) method of Joyce et al. [J. Chem. Phys. 127, 204107 (2007)]. We benchmark it against existing local-orbital quantum chemical calculations and experiments for small molecules containing light elements, with good agreement. Scalar-relativistic effects are included at the zeroth-order regular approximation level of theory and benchmarked against existing local-orbital quantum chemical calculations and experiments for a number of small molecules containing the heavy row six elements W, Pt, Hg, Tl, and Pb, with good agreement. Finally, 1 J(P-Ag) and 2 J(P-Ag-P) couplings are calculated in some larger molecular crystals and compared against solid-state NMR experiments. Some remarks are also made as to improving the numerical stability of dipole perturbations using PAW

Scattering of spinning test particles by gravitational plane waves

International Nuclear Information System (INIS)

Bini, D.; Gemelli, G.

1997-01-01

The authors study the motion of spinning particles in the gravitational plane-wave background and discuss particular solutions under a suitable choice of supplementary conditions. An analysis of the discontinuity of the motion across the wavefront is presented too

Technique for measurements of plane waves of uniaxial strain

International Nuclear Information System (INIS)

Graham, R.A.

1977-01-01

The measurement of plane waves in uniaxial strain, in which large surface areas are loaded and the measurements are restricted to a central region that is not influenced by lateral boundaries, is discussed. Measuring techniques are covered and instruments are discussed

Study of the electrons elastic scattering by atoms through pseudopotentials

International Nuclear Information System (INIS)

Bettega, M.H.F.

1990-01-01

Pseudopotentials allow an extraordinary simplification in the calculation of the electronic structure of atoms, molecules and crystals. Though they have been used extensively for electronic structure calculations, little is known of their applicability to scattering. A study of the pseudopotentials of Bachelet, Hamann and Schuter in the electron scattering by atoms was made, calculating phase-shifts and cross sections for angular momenta 1=0,1 and 2 and energy up to 5 R y. The results for the pseudopotential were compared all-electron calculations. The agreement is very good in a broad energy band. A simplification of the calculation of scattering by complex molecules where an all-electron calculation is impossible is aimed. (author)

Soft Gravitons & the Memory Effect for Plane Gravitational Waves

OpenAIRE

Zhang, P. -M.; Duval, C.; Gibbons, G. W.; Horvathy, P. A.

2017-01-01

The "gravitational memory effect" due to an exact plane wave provides us with an elementary description of the diffeomorphisms associated with soft gravitons. It is explained how the presence of the latter may be detected by observing the motion of freely falling particles or other forms of gravitational wave detection. Numerical calculations confirm the relevance of the first, second and third time integrals of the Riemann tensor pointed out earlier. Solutions for various profiles are constr...

Use of pseudopotentials in atom-atom (or molecule) collisions

International Nuclear Information System (INIS)

Pascale, J.

1985-09-01

Knowledge of interactions between ions, atoms or molecules is fundamental for interpretating or predicting collisional processes which may occur under various circumstances. The aim of this paper is to demonstrate the usefulness of using semiempirical effective interactions (more particularly, emphasis will be put on the pseudopotential approach) in the study of atom-atom (or molecule) collisions. We would like to show that if the semiempirical effective interactions are carefully defined, their use in molecular-structure calculations and in collision problems can give quite accurate results. We will limit our examples to one-electron systems. We consider the M-atom-He systems as a first example. For these systems, recent molecular-structure calculations have been carried out using an 1-dependent semiempirical pseudopotential approach and they have been tested against numerous experimental data in extensive calculations of cross sections for intra-and-inter-doublet transitions in the M-atom in collisions with He. Our second example will concern the M-H 2 systems, for which semiempirical pseudopotential molecular-structure calculations have been performed very recently using an one-electron two-center model. The results of these calculations are quite encouraging and we foresee the use of the pseudopotential approach in future studies of some reactive scattering processes

Phase function of a spherical particle when scattering an inhomogeneous electromagnetic plane wave

DEFF Research Database (Denmark)

Frisvad, Jeppe Revall

2018-01-01

of the complex hypergeometric function 2F1 for every term of a series expansion. In this work, I develop a simpler solution based on associated Legendre functions with argument zero. It is similar to the solution for homogeneous plane waves but with new explicit expressions for the angular dependency of the far......In absorbing media, electromagnetic plane waves are most often inhomogeneous. Existing solutions for the scattering of an inhomogeneous plane wave by a spherical particle provide no explicit expressions for the scattering components. In addition, current analytical solutions require evaluation......-field scattering components, that is, the phase function. I include recurrence formulae for practical evaluation and provide numerical examples to evaluate how well the new expressions match previous work in some limiting cases. The predicted difference in the scattering phase function due to inhomogeneity...

Scattering of three-dimensional plane waves in a self-reinforced half-space lying over a triclinic half-space

Science.gov (United States)

Gupta, Shishir; Pramanik, Abhijit; Smita; Pramanik, Snehamoy

2018-06-01

The phenomenon of plane waves at the intersecting plane of a triclinic half-space and a self-reinforced half-space is discussed with possible applications during wave propagation. Analytical expressions of the phase velocities of reflection and refraction for quasi-compressional and quasi-shear waves under initial stress are discussed carefully. The closest form of amplitude proportions on reflection and refraction factors of three quasi-plane waves are developed mathematically by applying appropriate boundary conditions. Graphics are sketched to exhibit the consequences of initial stress in the three-dimensional plane wave on reflection and refraction coefficients. Some special cases that coincide with the fundamental properties of several layers are designed to express the reflection and refraction coefficients.

Energy Relations for Plane Waves Reflected from Moving Media

DEFF Research Database (Denmark)

Daly, P.; Gruenberg, Harry

1967-01-01

When a plane wave is obliquely incident from vacuum on a semi-infinite moving medium, the energy flow carried by the incident wave, is in general, not carried away by the reflected and transmitted waves. This is only the case when the medium velocity is parallel to its vacuum interface. Otherwise...... there is a net inflow or outflow of electromagnetic energy, which can be accounted for by the change of stored energy in the system, and the work done by the mechanical forces acting on the medium. A detailed energy balance is drawn up for two different media moving normal to their vacuum interfaces: (a...

Geometrical optics in the near field: local plane-interface approach with evanescent waves.

Science.gov (United States)

Bose, Gaurav; Hyvärinen, Heikki J; Tervo, Jani; Turunen, Jari

2015-01-12

We show that geometrical models may provide useful information on light propagation in wavelength-scale structures even if evanescent fields are present. We apply a so-called local plane-wave and local plane-interface methods to study a geometry that resembles a scanning near-field microscope. We show that fair agreement between the geometrical approach and rigorous electromagnetic theory can be achieved in the case where evanescent waves are required to predict any transmission through the structure.

Forcing scheme in pseudopotential lattice Boltzmann model for multiphase flows.

Science.gov (United States)

Li, Q; Luo, K H; Li, X J

2012-07-01

The pseudopotential lattice Boltzmann (LB) model is a widely used multiphase model in the LB community. In this model, an interaction force, which is usually implemented via a forcing scheme, is employed to mimic the molecular interactions that cause phase segregation. The forcing scheme is therefore expected to play an important role in the pseudoepotential LB model. In this paper, we aim to address some key issues about forcing schemes in the pseudopotential LB model. First, theoretical and numerical analyses will be made for Shan-Chen's forcing scheme [Shan and Chen, Phys. Rev. E 47, 1815 (1993)] and the exact-difference-method forcing scheme [Kupershtokh et al., Comput. Math. Appl. 58, 965 (2009)]. The nature of these two schemes and their recovered macroscopic equations will be shown. Second, through a theoretical analysis, we will reveal the physics behind the phenomenon that different forcing schemes exhibit different performances in the pseudopotential LB model. Moreover, based on the analysis, we will present an improved forcing scheme and numerically demonstrate that the improved scheme can be treated as an alternative approach to achieving thermodynamic consistency in the pseudopotential LB model.

Far-field divergence of a vectorial plane wave diffracted by a circular aperture from the vectorial structure

International Nuclear Information System (INIS)

Zhou Guo-Quan

2011-01-01

Based on the vectorial structure of an electromagnetic wave, the analytical and concise expressions for the TE and TM terms of a vectorial plane wave diffracted by a circular aperture are derived in the far-field. The expressions of the energy flux distributions of the TE term, the TM term and the diffracted plane wave are also presented. The ratios of the power of the TE and TM terms to that of the diffracted plane wave are examined in the far-field. In addition, the far-field divergence angles of the TE term, the TM term and the diffracted plane wave, which are related to the energy flux distribution, are investigated. The different energy flux distributions of the TE and TM terms result in the discrepancy of their divergence angles. The influences of the linearly polarized angle and the radius of the circular aperture on the far-field divergence angles of the TE term, the TM term and the diffracted plane wave are discussed in detail. This research may promote the recognition of the optical propagation through a circular aperture. (electromagnetism, optics, acoustics, heat transfer, classical mechanics, and fluid dynamics)

Phase stability of random brasses: pseudopotential theory revisited

International Nuclear Information System (INIS)

Rahman, S.M.M.

1987-06-01

We review the theoretical development concerning the phase stability of random brasses. The introductory discussion of the subject embraces the rules of metallurgy in general, but we emphasize on the roles of electron-per-atom ratio in the major bulk of our discussion. Starting from the so-called rigid-band model the discussion goes up to the recent higher-order pseudopotential theory. The theoretical refinements within the pseudopotential framework are discussed briefly. The stability criteria of the random phases are analysed both in the static lattice and dynamic lattice approximations. (author). 71 refs, figs and tabs

Correlated electron pseudopotentials for 3d-transition metals

International Nuclear Information System (INIS)

Trail, J. R.; Needs, R. J.

2015-01-01

A recently published correlated electron pseudopotentials (CEPPs) method has been adapted for application to the 3d-transition metals, and to include relativistic effects. New CEPPs are reported for the atoms Sc − Fe, constructed from atomic quantum chemical calculations that include an accurate description of correlated electrons. Dissociation energies, molecular geometries, and zero-point vibrational energies of small molecules are compared with all electron results, with all quantities evaluated using coupled cluster singles doubles and triples calculations. The CEPPs give better results in the correlated-electron calculations than Hartree-Fock-based pseudopotentials available in the literature

Pseudopotentials for quantum-Monte-Carlo-calculations; Pseudopotentiale fuer Quanten-Monte-Carlo-Rechnungen

Energy Technology Data Exchange (ETDEWEB)

Burkatzki, Mark Thomas

2008-07-01

The author presents scalar-relativistic energy-consistent Hartree-Fock pseudopotentials for the main-group and 3d-transition-metal elements. The pseudopotentials do not exhibit a singularity at the nucleus and are therefore suitable for quantum Monte Carlo (QMC) calculations. The author demonstrates their transferability through extensive benchmark calculations of atomic excitation spectra as well as molecular properties. In particular, the author computes the vibrational frequencies and binding energies of 26 first- and second-row diatomic molecules using post Hartree-Fock methods, finding excellent agreement with the corresponding all-electron values. The author shows that the presented pseudopotentials give superior accuracy than other existing pseudopotentials constructed specifically for QMC. The localization error and the efficiency in QMC are discussed. The author also presents QMC calculations for selected atomic and diatomic 3d-transitionmetal systems. Finally, valence basis sets of different sizes (VnZ with n=D,T,Q,5 for 1st and 2nd row; with n=D,T for 3rd to 5th row; with n=D,T,Q for the 3d transition metals) optimized for the pseudopotentials are presented. (orig.)

Simulation of Guided Wave Interaction with In-Plane Fiber Waviness

Science.gov (United States)

Leckey, Cara A. C.; Juarez, Peter D.

2016-01-01

Reducing the timeline for certification of composite materials and enabling the expanded use of advanced composite materials for aerospace applications are two primary goals of NASA's Advanced Composites Project (ACP). A key a technical challenge area for accomplishing these goals is the development of rapid composite inspection methods with improved defect characterization capabilities. Ongoing work at NASA Langley is focused on expanding ultrasonic simulation capabilities for composite materials. Simulation tools can be used to guide the development of optimal inspection methods. Custom code based on elastodynamic finite integration technique is currently being developed and implemented to study ultrasonic wave interaction with manufacturing defects, such as in-plane fiber waviness (marcelling). This paper describes details of validation comparisons performed to enable simulation of guided wave propagation in composites containing fiber waviness. Simulation results for guided wave interaction with in-plane fiber waviness are also discussed. The results show that the wavefield is affected by the presence of waviness on both the surface containing fiber waviness, as well as the opposite surface to the location of waviness.

Spin waves in two-dimensional ferromagnet with large easy-plane anisotropy

International Nuclear Information System (INIS)

Fridman, Yu.A.; Spirin, D.V.

2002-01-01

Spin waves in easy-plane two-dimensional ferromagnet when anisotropy is much stronger than exchange are investigated. The spectra of magnons, the spin-spin and quadrupolar correlation functions have been derived. It is shown that in such a system there exist spin waves at low temperatures. Some properties of the quadrupolar ordering in ferromagnets are discussed

Quadrupole mass detector in the field of weak plane gravitational waves

International Nuclear Information System (INIS)

Borisova, L.B.

1978-01-01

Studied is the behaviour of the system which consists of two test particles connected by a string (quadrupole mass detector) and placed in the field of weak plane monochromatic gravitational waves. It is shown that at cross orientation of the detector the gravitational wave effecting such a system excites oscillations in it with the frequency equal to that of the gravitational wave source. The role of the driving force is played by the periodical change with the time of the equilibrium position. The gravitational wave does not influence the detector at its longitudinal orientation

A projection-free method for representing plane-wave DFT results in an atom-centered basis

International Nuclear Information System (INIS)

Dunnington, Benjamin D.; Schmidt, J. R.

2015-01-01

Plane wave density functional theory (DFT) is a powerful tool for gaining accurate, atomic level insight into bulk and surface structures. Yet, the delocalized nature of the plane wave basis set hinders the application of many powerful post-computation analysis approaches, many of which rely on localized atom-centered basis sets. Traditionally, this gap has been bridged via projection-based techniques from a plane wave to atom-centered basis. We instead propose an alternative projection-free approach utilizing direct calculation of matrix elements of the converged plane wave DFT Hamiltonian in an atom-centered basis. This projection-free approach yields a number of compelling advantages, including strict orthonormality of the resulting bands without artificial band mixing and access to the Hamiltonian matrix elements, while faithfully preserving the underlying DFT band structure. The resulting atomic orbital representation of the Kohn-Sham wavefunction and Hamiltonian provides a gateway to a wide variety of analysis approaches. We demonstrate the utility of the approach for a diverse set of chemical systems and example analysis approaches

A parallel orbital-updating based plane-wave basis method for electronic structure calculations

International Nuclear Information System (INIS)

Pan, Yan; Dai, Xiaoying; Gironcoli, Stefano de; Gong, Xin-Gao; Rignanese, Gian-Marco; Zhou, Aihui

2017-01-01

Highlights: • Propose three parallel orbital-updating based plane-wave basis methods for electronic structure calculations. • These new methods can avoid the generating of large scale eigenvalue problems and then reduce the computational cost. • These new methods allow for two-level parallelization which is particularly interesting for large scale parallelization. • Numerical experiments show that these new methods are reliable and efficient for large scale calculations on modern supercomputers. - Abstract: Motivated by the recently proposed parallel orbital-updating approach in real space method , we propose a parallel orbital-updating based plane-wave basis method for electronic structure calculations, for solving the corresponding eigenvalue problems. In addition, we propose two new modified parallel orbital-updating methods. Compared to the traditional plane-wave methods, our methods allow for two-level parallelization, which is particularly interesting for large scale parallelization. Numerical experiments show that these new methods are more reliable and efficient for large scale calculations on modern supercomputers.

Lectures on strings in flat space and plane waves from N = 4 super Yang Mills

International Nuclear Information System (INIS)

Maldacena, J.

2003-01-01

In these lecture notes we explain how the string spectrum in flat space and plane waves arises from the large N limit of U(N) N = 4 super Yang Mills. We reproduce the spectrum by summing a subset of the planar Feynman diagrams. We also describe some other aspects of string propagation on plane wave backgrounds. (author)

Path integral for Dirac particle in plane wave field

International Nuclear Information System (INIS)

Zeggari, S.; Boudjedaa, T.; Chetouani, L.

2001-01-01

The problem of a relativistic spinning particle in interaction with an electromagnetic plane wave field is treated via path integrals. The dynamics of the spin of the particle is described using the supersymmetric action proposed by Fradkin and Gitman. The problem has been solved by using two identities, one bosonic and the other fermionic, which are related directly to the classical equations of motion. The exact expression of the relative Green's function is given and the result agrees with those of the literature. Further, the suitably normalized wave functions are also extracted. (orig.)

Path integral for Dirac particle in plane wave field

Energy Technology Data Exchange (ETDEWEB)

Zeggari, S.; Boudjedaa, T.; Chetouani, L. [Mentouri Univ., Constantine (Algeria). Dept. of Physique

2001-10-01

The problem of a relativistic spinning particle in interaction with an electromagnetic plane wave field is treated via path integrals. The dynamics of the spin of the particle is described using the supersymmetric action proposed by Fradkin and Gitman. The problem has been solved by using two identities, one bosonic and the other fermionic, which are related directly to the classical equations of motion. The exact expression of the relative Green's function is given and the result agrees with those of the literature. Further, the suitably normalized wave functions are also extracted. (orig.)

On the comparsion of the Spherical Wave Expansion-to-Plane Wave Expansion and the Sources Reconstruction Method for Antenna Diagnostics

DEFF Research Database (Denmark)

Alvarez, Yuri; Cappellin, Cecilia; Las-Heras, Fernando

2008-01-01

A comparison between two recently developed methods for antenna diagnostics is presented. On one hand, the Spherical Wave Expansion-to-Plane Wave Expansion (SWE-PWE), based on the relationship between spherical and planar wave modes. On the other hand, the Sources Reconstruction Method (SRM), based...

Relativity and pseudopotentials in the Hartree-Fock-Slater method

International Nuclear Information System (INIS)

Snijders, J.G.

1979-01-01

The methodological problems involved in electronic structure determinations of compounds containing heavy elements by the Hartree-Fock-Slater scheme are investigated. It is shown that the effect of the inner electrons can be simulated by a so called pseudopotential, so that only the valence electrons have to be treated explicitly which constitutes a considerable reduction of computation time. It is further shown that a pseudopotential calculation is able to achieve an accuracy that is comparable to the results of a calculation including the core. (Auth.)

Can plane wave modes be physical modes in soliton models?

International Nuclear Information System (INIS)

Aldabe, F.

1995-08-01

I show that plane waves may not be used as asymptotic states in soliton models because they describe unphysical states. When asymptotic states are taken to the physical there is not T-matrix of O(1). (author). 9 refs

Effect of weak nonlinearities on the plane waves in a plasma stream

International Nuclear Information System (INIS)

Seshadri, S.R.

1976-01-01

The effect of weak nonlinearities on the monochromatic plane waves in a cold infinite plasma stream is investigated for the case in which the waves are progressing parallel to the drift velocity. The fast and the slow space-charge waves undergo amplitude-dependent frequency and wave number shifts. There is a long time slow modulation of the amplitude of the electromagnetic mode which becomes unstable to this nonlinear wave modulation. The importance of using the relativistically correct equation of motion for predicting correctly the modulational stability of the electromagnetic mode is pointed out. (author)

Plane waves and spherical means applied to partial differential equations

CERN Document Server

John, Fritz

2004-01-01

Elementary and self-contained, this heterogeneous collection of results on partial differential equations employs certain elementary identities for plane and spherical integrals of an arbitrary function, showing how a variety of results on fairly general differential equations follow from those identities. The first chapter deals with the decomposition of arbitrary functions into functions of the type of plane waves. Succeeding chapters introduce the first application of the Radon transformation and examine the solution of the initial value problem for homogeneous hyperbolic equations with con

Simplified description of out-of-plane waves in thin annular elastic plates

DEFF Research Database (Denmark)

Zadeh, Maziyar Nesari; Sorokin, Sergey

2013-01-01

Dispersion relations are derived for the out-of-plane wave propagation in planar elastic plates with constant curvature using the classical Kirchhoff thin plate theory. The dispersion diagrams and the mode shapes are compared with their counterparts for a straight plate strip and the role...... of curvature is assessed for plates with unconstrained edges. Elementary Bernoulli–Euler theory for a beam of rectangular cross-section with the circular shape of its axis is also employed to analyze the wave guide properties of this structure in its out-of-plane deformation. The applicability range...... of the elementary beam theory is validated. The wave finite element method in the formulation of the three-dimensional elasticity theory is used to ensure that the comparison of dispersion diagrams is performed in the frequency range, where the classical thin plate theory is valid. Thus, the paper summarizes...

Augmented-plane-wave calculations on small molecules

International Nuclear Information System (INIS)

Serena, P.A.; Baratoff, A.; Soler, J.M.

1993-01-01

We have performed ab initio calculations on a wide range of small molecules, demonstrating the accuracy and flexibility of an alternative method for calculating the electronic structure of molecules, solids, and surfaces. It is based on the local-density approximation (LDA) for exchange and correlation and the nonlinear augmented-plane-wave method. Very accurate atomic forces are obtained directly. This allows for implementation of Car-Parrinello-like techniques to determine simultaneously the self-consistent electron wave functions and the equilibrium atomic positions within an iterative scheme. We find excellent agreement with the best existing LDA-based calculations and remarkable agreement with experiment for the equilibrium geometries, vibrational frequencies, and dipole moments of a wide variety of molecules, including strongly bound homopolar and polar molecules, hydrogen-bound and electron-deficient molecules, and weakly bound alkali and noble-metal dimers, although binding energies are overestimated

Theory of steady-state plane tunneling-assisted impact ionization waves

International Nuclear Information System (INIS)

Kyuregyan, A. S.

2013-01-01

The effect of band-to-band and trap-assisted tunneling on the properties of steady-state plane ionization waves in p + -n-n + structures is theoretically analyzed. It is shown that such tunneling-assisted impact ionization waves do not differ in a qualitative sense from ordinary impact ionization waves propagating due to the avalanche multiplication of uniformly distributed seed electrons and holes. The quantitative differences of tunneling-assisted impact ionization waves from impact ionization waves are reduced to a slightly different relation between the wave velocity u and the maximum field strength E M at the front. It is shown that disregarding impact ionization does not exclude the possibility of the existence of tunneling-assisted ionization waves; however, their structure radically changes, and their velocity strongly decreases for the same E M . A comparison of the dependences u(E M ) for various ionization-wave types makes it possible to determine the conditions under which one of them is dominant. In conclusion, unresolved problems concerning the theory of tunneling-assisted impact ionization waves are discussed and the directions of further studies are outlined

Invertible propagator for plane wave illumination of forward-scattering structures.

Science.gov (United States)

Samelsohn, Gregory

2017-05-10

Propagation of directed waves in forward-scattering media is considered. It is assumed that the evolution of the wave field is governed by the standard parabolic wave equation. An efficient one-step momentum-space propagator, suitable for a tilted plane wave illumination of extended objects, is derived. It is expressed in terms of a propagation operator that transforms (the complex exponential of) a linogram of the illuminated object into a set of its diffraction patterns. The invertibility of the propagator is demonstrated, which permits a multiple-shot scatter correction to be performed, and makes the solution especially attractive for either projective or tomographic imaging. As an example, high-resolution tomograms are obtained in numerical simulations implemented for a synthetic phantom, with both refractive and absorptive inclusions.

Pseudopotential transformation of correlated-pair equations

International Nuclear Information System (INIS)

Szasz, L.; Brown, L.

1975-01-01

A pseudopotential transformation for correlated-pair equations is derived that yields solutions that are pseudowavefunctions, i.e., they do not have to be orthogonal to the core functions. The approximate solutions for the transformation will be much simpler to compute, but they do not involve a loss of accuracy

Phase function of a spherical particle when scattering an inhomogeneous electromagnetic plane wave.

Science.gov (United States)

Frisvad, Jeppe Revall

2018-04-01

In absorbing media, electromagnetic plane waves are most often inhomogeneous. Existing solutions for the scattering of an inhomogeneous plane wave by a spherical particle provide no explicit expressions for the scattering components. In addition, current analytical solutions require evaluation of the complex hypergeometric function F 1 2 for every term of a series expansion. In this work, I develop a simpler solution based on associated Legendre functions with argument zero. It is similar to the solution for homogeneous plane waves but with new explicit expressions for the angular dependency of the far-field scattering components, that is, the phase function. I include recurrence formulas for practical evaluation and provide numerical examples to evaluate how well the new expressions match previous work in some limiting cases. The predicted difference in the scattering phase function due to inhomogeneity is not negligible for light entering an absorbing medium at an oblique angle. The presented theory could thus be useful for predicting scattering behavior in dye-based random lasing and in solar cell absorption enhancement.

REFLECT: a program to integrate the wave equation through a plane stratified plasma

International Nuclear Information System (INIS)

Greene, J.W.

1975-01-01

A program was developed to integrate the wave equation through a plane stratified plasma with a general density distribution. The reflection and transmission of a plane wave are computed as a function of the angle of incidence. The polarization of the electric vector is assumed to be perpendicular to the plane of incidence. The model for absorption by classical inverse bremsstrahlung avoids the improper extrapolation of underdense formulae that are singular at the plasma critical surface. Surprisingly good agreement with the geometric-optics analysis of a linear layer was found. The system of ordinary differential equations is integrated by the variable-step, variable-order Adams method in the Lawrence Livermore Laboratory Gear package. Parametric studies of the absorption are summarized, and some possibilities for further development of the code are discussed. (auth)

Research Area 3 - Mathematical Sciences: Multiscale Modeling of the Mechanics of Advanced Energetic Materials Relevant to Detonation Prediction

Science.gov (United States)

2015-08-24

for initiation. We have used first principle calculations (plane wave Density Functional Theory with projector augmented-wave (PAW) pseudopotentials...RDX -what are conformers?- • Estimation of energy barriers using the Nudged Elastic Band method. • Various conformations stabilized by the Grant

Plane-wave spectrum approach for the calculation of electromagnetic absorption under near-field exposure conditions

International Nuclear Information System (INIS)

Chatterjee, I.; Gandhi, O.P.; Hagmann, M.J.; Riazi, A.

1980-01-01

The exposure of humans to electromagnetic near fields has not been sufficiently emphasized by researcher. We have used the plane-wave-spectrum approach to evaluate the electromagnetic field and determine the energy deposited in a lossy, homogeneous, semi-infinite slab placed in the near field of a source leaking radiation. Values of the fields and absorbed energy in the target are obtained by vector summation of the contributions of all the plane waves into which the prescribed field is decomposed. Use of a fast Fourier transform algorithm contributes to the high efficiency of the computations. The numerical results show that, for field distributions that are nearly constant over a physical extent of at least a free-space wavelength, the energy coupled into the target is approximately equal to the resulting from plane-wave exposed

The Relativistic Transformation for an Electromagnetic Plane Wave with General Time Dependence

Science.gov (United States)

Smith, Glenn S.

2012-01-01

In special relativity, the transformation between inertial frames for an electromagnetic plane wave is usually derived for the time-harmonic case (the field is a sinusoid of infinite duration), even though all practical waves are of finite duration and may not even contain a dominant sinusoid. This paper presents an alternative derivation in which…

Excitation of plane Lamb wave in plate-like structures under applied surface loading

Science.gov (United States)

Zhou, Kai; Xu, Xinsheng; Zhao, Zhen; Yang, Zhengyan; Zhou, Zhenhuan; Wu, Zhanjun

2018-02-01

Lamb waves play an important role in structure health monitoring (SHM) systems. The excitation of Lamb waves has been discussed for a long time with absorbing results. However, little effort has been made towards the precise characterization of Lamb wave excitation by various transducer models with mathematical foundation. In this paper, the excitation of plane Lamb waves with plane strain assumption in isotropic plate structures under applied surface loading is solved with the Hamiltonian system. The response of the Lamb modes excited by applied loading is expressed analytically. The effect of applied loading is divided into the product of two parts as the effect of direction and the effect of distribution, which can be changed by selecting different types of transducer and the corresponding transducer configurations. The direction of loading determines the corresponding displacement of each mode. The effect of applied loading on the in-plane and normal directions depends on the in-plane and normal displacements at the surface respectively. The effect of the surface loading distribution on the Lamb mode amplitudes is mainly reflected by amplitude versus frequency or wavenumber. The frequencies at which the maxima and minima of the S0 or A0 mode response occur depend on the distribution of surface loading. The numerical results of simulations conducted on an infinite aluminum plate verify the theoretical prediction of not only the direction but also the distribution of applied loading. A pure S0 or A0 mode can be excited by selecting the appropriate direction and distribution at the corresponding frequency.

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.

Photonic band structures solved by a plane-wave-based transfer-matrix method.

Science.gov (United States)

Li, Zhi-Yuan; Lin, Lan-Lan

2003-04-01

Transfer-matrix methods adopting a plane-wave basis have been routinely used to calculate the scattering of electromagnetic waves by general multilayer gratings and photonic crystal slabs. In this paper we show that this technique, when combined with Bloch's theorem, can be extended to solve the photonic band structure for 2D and 3D photonic crystal structures. Three different eigensolution schemes to solve the traditional band diagrams along high-symmetry lines in the first Brillouin zone of the crystal are discussed. Optimal rules for the Fourier expansion over the dielectric function and electromagnetic fields with discontinuities occurring at the boundary of different material domains have been employed to accelerate the convergence of numerical computation. Application of this method to an important class of 3D layer-by-layer photonic crystals reveals the superior convergency of this different approach over the conventional plane-wave expansion method.

Photonic band structures solved by a plane-wave-based transfer-matrix method

International Nuclear Information System (INIS)

Li Zhiyuan; Lin Lanlan

2003-01-01

Transfer-matrix methods adopting a plane-wave basis have been routinely used to calculate the scattering of electromagnetic waves by general multilayer gratings and photonic crystal slabs. In this paper we show that this technique, when combined with Bloch's theorem, can be extended to solve the photonic band structure for 2D and 3D photonic crystal structures. Three different eigensolution schemes to solve the traditional band diagrams along high-symmetry lines in the first Brillouin zone of the crystal are discussed. Optimal rules for the Fourier expansion over the dielectric function and electromagnetic fields with discontinuities occurring at the boundary of different material domains have been employed to accelerate the convergence of numerical computation. Application of this method to an important class of 3D layer-by-layer photonic crystals reveals the superior convergency of this different approach over the conventional plane-wave expansion method

Measurement of Plane-Wave Spectra of Ground Penetrating Radar Antennas

DEFF Research Database (Denmark)

Lenler-Eriksen, Hans-Rudolph; Meincke, Peter

2005-01-01

The plane-wave transmitting spectrum of a ground penetrating radar (GPR) loop antenna close to the air-soil interface is measured by means of a probe buried in soil. Probe correction is implemented based upon knowledge about the complex permittivity of the soil and the current distribution...

Tissue elasticity of in vivo skeletal muscles measured in the transverse and longitudinal planes using shear wave elastography.

Science.gov (United States)

Chino, Kentaro; Kawakami, Yasuo; Takahashi, Hideyuki

2017-07-01

The aim of the present study was to measure in vivo skeletal muscle elasticity in the transverse and longitudinal planes using shear wave elastography and then to compare the image stability, measurement values and measurement repeatability between these imaging planes. Thirty-one healthy males participated in this study. Tissue elasticity (shear wave velocity) of the medial gastrocnemius, rectus femoris, biceps brachii and rectus abdominis was measured in both the transverse and longitudinal planes using shear wave elastography. Image stability was evaluated by the standard deviation of the colour distribution in the shear wave elastography image. Measurement repeatability was assessed by the coefficient of variance obtained from three measurement values. Image stability of all tested muscles was significantly higher in the longitudinal plane (Pplanes (P>0·05), except in the biceps brachii (P = 0·001). Measurement values of the medial gastrocnemius, rectus femoris and biceps brachii were significantly different between the imaging planes (Pplane, which indicates that imaging plane should be considered when measuring skeletal muscle tissue elasticity by shear wave elastography. © 2015 Scandinavian Society of Clinical Physiology and Nuclear Medicine. Published by John Wiley & Sons Ltd.

Existence and Stability of Spatial Plane Waves for the Incompressible Navier-Stokes in R^3

Science.gov (United States)

Correia, Simão; Figueira, Mário

2018-03-01

We consider the three-dimensional incompressible Navier-Stokes equation on the whole space. We observe that this system admits a L^∞ family of global spatial plane wave solutions, which are connected with the two-dimensional equation. We then proceed to prove local well-posedness over a space which includes L^3(R^3) and these solutions. Finally, we prove L^3-stability of spatial plane waves, with no condition on their size.

Nonlinear Waves in the Terrestrial Quasiparallel Foreshock.

Science.gov (United States)

Hnat, B; Kolotkov, D Y; O'Connell, D; Nakariakov, V M; Rowlands, G

2016-12-02

We provide strongly conclusive evidence that the cubic nonlinearity plays an important part in the evolution of the large amplitude magnetic structures in the terrestrial foreshock. Large amplitude nonlinear wave trains at frequencies above the proton cyclotron frequency are identified after nonharmonic slow variations are filtered out by applying the empirical mode decomposition. Numerical solutions of the derivative nonlinear Schrödinger equation, predicted analytically by the use of a pseudopotential approach, are found to be consistent with the observed wave forms. The approximate phase speed of these nonlinear waves, indicated by the parameters of numerical solutions, is of the order of the local Alfvén speed. We suggest that the feedback of the large amplitude fluctuations on background plasma is reflected in the evolution of the pseudopotential.

First-principle optimal local pseudopotentials construction via optimized effective potential method

International Nuclear Information System (INIS)

Mi, Wenhui; Zhang, Shoutao; Wang, Yanchao; Ma, Yanming; Miao, Maosheng

2016-01-01

The local pseudopotential (LPP) is an important component of orbital-free density functional theory, a promising large-scale simulation method that can maintain information on a material’s electron state. The LPP is usually extracted from solid-state density functional theory calculations, thereby it is difficult to assess its transferability to cases involving very different chemical environments. Here, we reveal a fundamental relation between the first-principles norm-conserving pseudopotential (NCPP) and the LPP. On the basis of this relationship, we demonstrate that the LPP can be constructed optimally from the NCPP for a large number of elements using the optimized effective potential method. Specially, our method provides a unified scheme for constructing and assessing the LPP within the framework of first-principles pseudopotentials. Our practice reveals that the existence of a valid LPP with high transferability may strongly depend on the element.

Empirical pseudo-potential studies on electronic structure

Indian Academy of Sciences (India)

Theoretical investigations of electronic structure of quantum dots is of current interest in nanophase materials. Empirical theories such as effective mass approximation, tight binding methods and empirical pseudo-potential method are capable of explaining the experimentally observed optical properties. We employ the ...

An Analytical Method of Auxiliary Sources Solution for Plane Wave Scattering by Impedance Cylinders

DEFF Research Database (Denmark)

Larsen, Niels Vesterdal; Breinbjerg, Olav

2004-01-01

Analytical Method of Auxiliary Sources solutions for plane wave scattering by circular impedance cylinders are derived by transformation of the exact eigenfunction series solutions employing the Hankel function wave transformation. The analytical Method of Auxiliary Sources solution thus obtained...

Quantum fields interacting with colliding plane waves: the stress-energy tensor and backreaction

International Nuclear Information System (INIS)

Dorca, M.; Verdaguer, E.

1997-01-01

Following a previous work on the quantization of a massless scalar field in a space-time representing the head on collision of two plane waves which focus into a Killing-Cauchy horizon, we compute the renormalized expectation value of the stress-energy tensor of the quantum field near that horizon in the physical state which corresponds to the Minkowski vacuum before the collision of the waves. It is found that for minimally coupled and conformally coupled scalar fields the respective stress-energy tensors are unbounded in the horizon. The specific form of the divergences suggests that when the semiclassical Einstein equations describing the backreaction of the quantum fields on the space-time geometry are taken into account, the horizon will acquire a curvature singularity. Thus the Killing-Cauchy horizon which is known to be unstable under ''generic'' classical perturbations is also unstable by vacuum polarization. The calculation is done following the point-splitting regularization technique. The dynamical colliding wave space-time has four quite distinct space-time regions, namely, one flat region, two single plane wave regions, and one interaction region. Exact mode solutions of the quantum field equation cannot be found exactly, but the blueshift suffered by the initial modes in the plane wave and interaction regions makes the use of the WKB expansion a suitable method of solution. To ensure the correct regularization of the stress-energy tensor, the initial flat modes propagated into the interaction region must be given to a rather high adiabatic order of approximation. (orig.)

Radiation of Electron in the Field of Plane Light Wave

International Nuclear Information System (INIS)

Zelinsky, A.; Drebot, I.V.; Grigorev, Yu.N.; Zvonareva, O.D.; Tatchyn, R.

2006-01-01

Results of integration of a Lorentz equation for a relativistic electron moving in the field of running, plane, linear polarized electromagnetic wave are presented in the paper. It is shown that electron velocities in the field of the wave are almost periodic functions of time. For calculations of angular spectrum of electron radiation intensity expansion of the electromagnetic field in a wave zone into generalized Fourier series was used. Expressions for the radiation intensity spectrum are presented in the paper. Derived results are illustrated for electron and laser beam parameters of NSC KIPT X-ray generator NESTOR. It is shown that for low intensity of the interacting electromagnetic wave the results of energy and angular spectrum calculations in the frame of classical electrodynamics completely coincide with calculation results produced using quantum electrodynamics. Simultaneously, derived expressions give possibilities to investigate dependence of energy and angular Compton radiation spectrum on phase of interaction and the interacting wave intensity

On plane-wave relativistic electrodynamics in plasmas and in vacuum

International Nuclear Information System (INIS)

Fiore, Gaetano

2014-01-01

We revisit the exact microscopic equations (in differential, and equivalent integral form) ruling a relativistic cold plasma after the plane-wave Ansatz, without customary approximations. We show that in the Eulerian description the motion of a very diluted plasma initially at rest and excited by an arbitrary transverse plane electromagnetic travelling-wave has a very simple and explicit dependence on the transverse electromagnetic potential; for a non-zero density plasma the above motion is a good approximation of the real one as long as the back-reaction of the charges on the electromagnetic field can be neglected, i.e. for a time lapse decreasing with the plasma density, and can be used as initial step in an iterative resolution scheme. As one of many possible applications, we use these results to describe how the ponderomotive force of a very intense and short plane laser pulse hitting normally the surface of a plasma boosts the surface electrons into the ion background. In response to this penetration, the electrons are pulled back by the electric force exerted by the ions and the other displaced electrons and may leave the plasma with high energy in the direction opposite to that of propagation of the pulse ‘slingshot effect’ (Fiore G et al 2013 arXiv:1309.1400). (paper)

High-temperature electronic structure with the Korringa-Kohn-Rostoker Green's function method

Science.gov (United States)

Starrett, C. E.

2018-05-01

Modeling high-temperature (tens or hundreds of eV), dense plasmas is challenging due to the multitude of non-negligible physical effects including significant partial ionization and multisite effects. These effects cause the breakdown or intractability of common methods and approximations used at low temperatures, such as pseudopotentials or plane-wave basis sets. Here we explore the Korringa-Kohn-Rostoker Green's function method at these high-temperature conditions. The method is all electron, does not rely on pseudopotentials, and uses a spherical harmonic basis set, and so avoids the aforementioned limitations. It is found to be accurate for solid density aluminum and iron plasmas when compared to a plane-wave method at low temperature, while being able to access high temperatures.

The PSML format and library for norm-conserving pseudopotential data curation and interoperability

Science.gov (United States)

García, Alberto; Verstraete, Matthieu J.; Pouillon, Yann; Junquera, Javier

2018-06-01

Norm-conserving pseudopotentials are used by a significant number of electronic-structure packages, but the practical differences among codes in the handling of the associated data hinder their interoperability and make it difficult to compare their results. At the same time, existing formats lack provenance data, which makes it difficult to track and document computational workflows. To address these problems, we first propose a file format (PSML) that maps the basic concepts of the norm-conserving pseudopotential domain in a flexible form and supports the inclusion of provenance information and other important metadata. Second, we provide a software library (libPSML) that can be used by electronic structure codes to transparently extract the information in the file and adapt it to their own data structures, or to create converters for other formats. Support for the new file format has been already implemented in several pseudopotential generator programs (including ATOM and ONCVPSP), and the library has been linked with SIESTA and ABINIT, allowing them to work with the same pseudopotential operator (with the same local part and fully non-local projectors) thus easing the comparison of their results for the structural and electronic properties, as shown for several example systems. This methodology can be easily transferred to any other package that uses norm-conserving pseudopotentials, and offers a proof-of-concept for a general approach to interoperability.

A ''quadratized'' augmented plane wave method

International Nuclear Information System (INIS)

Smrcka, L.

1982-02-01

The exact radial solution inside the muffin-tin sphere is replaced by its Taylor expansion with respect to the energy, truncated after the quadratic term. Making use of it the energy independent augmented plane waves are formed which lead to the secular equations linear in energy. The method resembles the currently used linearized APW method but yields higher accuracy. The analysis of solution inside one muffin-tin sphere shows that the eigenvalue error is proportional to (E-E 0 ) 6 as compared with (E-E 0 ) 4 for LAPW. The error of eigenfunctions is (E-E 0 ) 3 ((E-E 0 ) 2 for LAPW). These conclusions are confirmed by direct numerical calculation of band structure of Cu and Al. (author)

Back radiation suppression through a semi-transparent round ground plane for a mm-Wave monopole antenna

KAUST Repository

Klionovski, Kirill; Farooqui, Muhammad Fahad; Shamim, Atif

2017-01-01

Omnidirectional radiation pattern with minimum backward radiation is highly desirable for millimeter-wave telecommunication antennas. In this work, we propose a round, semitransparent ground plane of radius 0.8λ with uniform impedance distribution that can reduce the back radiation of a monopole antenna by 8.8 dB as compared with a similar sized metallic ground plane. The value of uniform impedance is obtained through analytical optimization by using asymptotic expressions in the Kirchhoff approximation of the radiation pattern of a toroidal wave scattered by a round semitransparent ground plane. The semitransparent ground plane has been realized using a low-cost carbon paste on a Kapton film. Experimental results match closely with those of simulations and validate the overall concept.

Back radiation suppression through a semi-transparent round ground plane for a mm-Wave monopole antenna

KAUST Repository

Klionovski, Kirill

2017-10-25

Omnidirectional radiation pattern with minimum backward radiation is highly desirable for millimeter-wave telecommunication antennas. In this work, we propose a round, semitransparent ground plane of radius 0.8λ with uniform impedance distribution that can reduce the back radiation of a monopole antenna by 8.8 dB as compared with a similar sized metallic ground plane. The value of uniform impedance is obtained through analytical optimization by using asymptotic expressions in the Kirchhoff approximation of the radiation pattern of a toroidal wave scattered by a round semitransparent ground plane. The semitransparent ground plane has been realized using a low-cost carbon paste on a Kapton film. Experimental results match closely with those of simulations and validate the overall concept.

The ionic structure of liquid sodium obtained by numerical simulation from 'first principles' and ab initio 'norm-conserving' pseudopotentials

International Nuclear Information System (INIS)

Harchaoui, N; Hellal, S; Grosdidier, B; Gasser, J G

2008-01-01

The physical properties of disordered matter depend on the 'atomic structure' i.e. the arrangement of the atoms. This arrangement is described by the structure factor S (q) in reciprocal space and by the pair correlation function g(r) in real space. The structure factor is obtained experimentally while the numerical simulation enables us to obtain the pair correlation function. Liquid sodium is one of the elements the most studied and one can wonder about new scientific contribution appropriateness. The majority of theoretical calculations are compared with the experiment of Waseda. However two other posterior measurements have been published and give different results, in particular with regard to the height of the first peak of the structure factor. Three models of pseudopotential are considered to describe the electron-ion interaction. The first is a local pseudopotential with the alternative known as 'individual' of the model suggested by Fiolhais et al. The second model considered is that of Bachelet et al. This one, ab-initio and 'norm conserving', is non local. The last model is that proposed by Shaw known as 'first principles' and 'energy dependent'. Various static dielectric functions characteristic of the effects of exchange and correlation have been used and developed by Hellal et al. We calculated the form factors (pseudopotential in reciprocal space) and deduce the normalized energy-wave-number characteristic F N (q), the interatomic pair potential V eff (r), then the pair correlation function g(r) by molecular dynamics. The structure factor S(q) is obtained by Fourier transform and is compared with the experiment. Our calculations with the Bachelet and Shaw pseudopotentials are close to the last experiments of Greenfield et al. and of Huijben et al. Our results are discussed

Propagation of magnetostatic spin waves in an yttrium iron garnet film for out-of-plane magnetic fields

Science.gov (United States)

Bang, Wonbae; Lim, Jinho; Trossman, Jonathan; Tsai, C. C.; Ketterson, John B.

2018-06-01

We have observed the propagation of spin waves across a thin yttrium iron garnet film on (1 1 1) gadolinium gallium garnet for magnetic fields inclined with respect to the film plane. Two principle planes were studied: that for H in the plane defined by the wave vector k and the plane normal, n, with limiting forms corresponding to the Backward Volume and Forward Volume modes, and that for H in the plane perpendicular to k, with limiting forms corresponding to the Damon-Eshbach and Forward Volume modes. By exciting the wave at one edge of the film and observing the field dependence of the phase of the received signal at the opposing edge we determined the frequency vs. wavevector relation, ω = ω (k), of various propagating modes in the film. Avoided crossings are observed in the Damon-Eshbach and Forward Volume regimes when the propagating mode intersects the higher, exchange split, volume modes, leading to an extinction of the propagating mode; analysis of the resulting behavior allows a determination of the exchange parameter. The experimental results are compared with theoretical simulations.

Plane wave fast color flow mode imaging

DEFF Research Database (Denmark)

Bolic, Ibrahim; Udesen, Jesper; Gran, Fredrik

2006-01-01

A new Plane wave fast color flow imaging method (PWM) has been investigated, and performance evaluation of the PWM based on experimental measurements has been made. The results show that it is possible to obtain a CFM image using only 8 echo-pulse emissions for beam to flow angles between 45...... degrees and 75 degrees. Compared to the conventional ultrasound imaging the frame rate is similar to 30 - 60 times higher. The bias, B-est of the velocity profile estimate, based on 8 pulse-echo emissions, is between 3.3% and 6.1% for beam to flow angles between 45 degrees and 75 degrees, and the standard...

BeS

African Journals Online (AJOL)

ADOWIE PERE

ABSTRACT: An ab initio plane-wave Pseudopotential calculations using the density functional theory (DFT) ... From these computations the lattice constants, crystal structures, phonon ..... frequency modes of optical branch at Γ point are in.

Study of Atoms and Molecules with Auxiliary-Field Quantum Monte Carlo

Science.gov (United States)

Purwanto, Wirawan; Suewattana, Malliga; Krakauer, Henry; Zhang, Shiwei; Walter, Eric J.

2006-03-01

We study the ground-state properties of second-row atoms and molecules using the phaseless auxiliary-field quantum Monte Carlo (AF QMC) method. This method projects the many-body ground state from a trial wave function by means of random walks in the Slater-determinant space. We use a single Slater-determinant trial wave function obtained from density-functional theory (DFT) or Hartree-Fock (HF) calculations. The calculations were done with a plane-wave basis and supercells with periodic boundary condition. We investigate the finite-size effects and the accuracy of pseudopotentials within DFT, HF, and AF QMC frameworks. Pseudopotentials generated from both LDA (OPIUM) and HF are employed. We find that the many-body QMC calculations show a greater sensitivity to the accuracy of the pseudopotentials. With reliable pseudopotentials, the ionization potentials and dissociation energies obtained using AF QMC are in excellent agreement with the experimental results. S. Zhang and H. Krakauer, Phys. Rev. Lett. 90, 136401 (2003) http://opium.sourceforge.net I. Ovcharenko, A. Aspuru-Guzik, and W. A. Lester, J. Chem. Phys. 114, 7790 (2001)

Progress in parallel implementation of the multilevel plane wave time domain algorithm

KAUST Repository

Liu, Yang; Bagci, Hakan; Michielssen, Eric

2013-01-01

The computational complexity and memory requirements of classical schemes for evaluating transient electromagnetic fields produced by Ns dipoles active for Nt time steps scale as O(NtN s 2) and O(Ns 2), respectively. The multilevel plane wave time

Proposal of coherent Cherenkov radiation matched to circular plane wave for intense terahertz light source

International Nuclear Information System (INIS)

Sei, Norihiro; Sakai, Takeshi; Hayakawa, Ken; Tanaka, Toshinari; Hayakawa, Yasushi; Nakao, Keisuke; Nogami, Kyoko; Inagaki, Manabu

2015-01-01

Highlights: • We proposed a new intense terahertz-wave source based on coherent Cherenkov radiation (CCR). • A hollow conical dielectric is used to generate the CCR beam. • The wave front of the CCR beam can be matched to the basal plane. • The peak-power of the CCR beam is above 1 MW per micropulse with a short interval of 350 ps. - Abstract: We propose a high-peak-power terahertz-wave source based on an electron accelerator. By passing an electron beam through a hollow conical dielectric with apex facing the incident electron beam, the wave front of coherent Cherenkov radiation generated on the inner surface of the hollow conical dielectric matches the basal plane. Using the electron beam generated at the Laboratory for Electron Beam Research and Application at Nihon University, the calculated power of coherent Cherenkov radiation that matched the circular plane (CCR-MCP) was above 1 MW per micropulse with a short interval of 350 ps, for wavelengths ranging from 0.5 to 5 mm. The electron beam is not lost for generating the CCR-MCP beam by using the hollow conical dielectric. It is possible to combine the CCR-MCP beams with other light sources based on an accelerator

Propagation of plane waves in a rotating magneto-thermoelastic fiber-reinforced medium under G-N theory

Directory of Open Access Journals (Sweden)

Maity N.

2017-06-01

Full Text Available The article is concernedwith the possibility of plane wave propagation in a rotating elastic medium under the action of magnetic and thermal fields. The material is assumed to be fibre-reinforced with increased stiffness, strength and load bearing capacity. Green and Nagdhi’s concepts of generalized thermoelastic models II and III have been followed in the governing equations expressed in tensor notation. The effects of various parameters of the applied fields on the plane wave velocity have been shown graphically.

Globally-Optimized Local Pseudopotentials for (Orbital-Free) Density Functional Theory Simulations of Liquids and Solids.

Science.gov (United States)

Del Rio, Beatriz G; Dieterich, Johannes M; Carter, Emily A

2017-08-08

The accuracy of local pseudopotentials (LPSs) is one of two major determinants of the fidelity of orbital-free density functional theory (OFDFT) simulations. We present a global optimization strategy for LPSs that enables OFDFT to reproduce solid and liquid properties obtained from Kohn-Sham DFT. Our optimization strategy can fit arbitrary properties from both solid and liquid phases, so the resulting globally optimized local pseudopotentials (goLPSs) can be used in solid and/or liquid-phase simulations depending on the fitting process. We show three test cases proving that we can (1) improve solid properties compared to our previous bulk-derived local pseudopotential generation scheme; (2) refine predicted liquid and solid properties by adding force matching data; and (3) generate a from-scratch, accurate goLPS from the local channel of a non-local pseudopotential. The proposed scheme therefore serves as a full and improved LPS construction protocol.

Plane-wave scattering by self-complementary metasurfaces in terms of electromagnetic duality and Babinet's principle

Science.gov (United States)

Nakata, Yosuke; Urade, Yoshiro; Nakanishi, Toshihiro; Kitano, Masao

2013-11-01

We investigate theoretically electromagnetic plane-wave scattering by self-complementary metasurfaces. By using Babinet's principle extended to metasurfaces with resistive elements, we show that the frequency-independent transmission and reflection are realized for normal incidence of a circularly polarized plane wave onto a self-complementary metasurface, even if there is diffraction. Next, we consider two special classes of self-complementary metasurfaces. We show that self-complementary metasurfaces with rotational symmetry can act as coherent perfect absorbers, and those with translational symmetry compatible with their self-complementarity can split the incident power equally, even for oblique incidences.

Nonlinear acoustic waves in nonthermal plasmas with negative and positive dust

International Nuclear Information System (INIS)

Verheest, Frank

2009-01-01

Using a Sagdeev pseudopotential formalism where nonlinear structures are stationary in a co-moving frame, large dust-acoustic solitary waves and double layers have been studied in plasmas with negative and positive cold dust, in the presence of nonthermal electrons and ions. This has been done in a systematic way, to delimit the compositional parameter space in which such modes can be found. The existence domain of negative/positive solitary waves is limited by infinite compression of the negative/positive dust or by the occurrence of negative/positive double layers. These double layers require a sufficient nonthermality of the electrons/ions and the presence of enough positive/negative dust. There are parameter ranges where both negative and positive solitary structures coexist, sometimes both of the solitary wave type, sometimes one a solitary wave and the other a double layer. Typical Sagdeev pseudopotentials and solitary wave profiles have been presented.

[A new method to orthodontically correct dental occlusal plane canting: wave-shaped arch].

Science.gov (United States)

Zheng, X; Hu, X X; Ma, N; Chen, X H

2017-02-18

To introduce a technique of second order wave-shaped arch wire to orthodontically treat dental occlusal plane canting (DOPC) with left-right interactive anchorage, and to test its clinical efficacy. Among the permanent dentition malocclusion patients who showed no obvious facial asymmetry, we screened for patients who showed anterior occlusal plane canting (AOPC) after routine orthodontic examination, treatment planning, MBT fixed appliance installation and serial arch wires alignment. Each patient had been clinically appraised in frontal view by 2 orthodontists and the patient him/herself; if all 3 agreed that the AOPC was obvious, the patient was included. By this means, we included 37 patients, including 10 males and 27 females; the average age was (21.9±5.2) years. To correct AOPC, opposite direction equal curvature second order rocking-chair curve was bent on each side of 0.46 mm×0.56 mm stainless steel edgewise wire. With reference to normal occlusal plane, a curve toward the occlusal surface was made to extrude under-erupted teeth on one side while a curve toward the gingiva was made to intrude over-erupted teeth on the other side, so that the arch wire was made into a wave shape in vertical dimension. Before and after application of wave-shaped arch wire, frontal facial photographs were taken when the patient's mouth was open slightly with lips retracted to show anterior occlusal plane (AOP) clearly. An AOP was constructed by connecting the center of the slot in the medial edge of canine bracket on each side in the photograph. The angles between the bipupillary plane(BPP) and the constructed AOP were measured in ImageJ1-48v software and the angle differences before and after treatment were compared with paired Wilcoxon test in SPSS 10.0 software. The wave-shaped arch could correct AOPC effectively in 3 to 10 months time with an average of 5.5±1.7 months; the angles between AOP and BBP before treatment ranged from 2.90° to 6.12° with a median of 4.01�

ONETEP: linear-scaling density-functional theory with plane-waves

International Nuclear Information System (INIS)

Haynes, P D; Mostof, A A; Skylaris, C-K; Payne, M C

2006-01-01

This paper provides a general overview of the methodology implemented in onetep (Order-N Electronic Total Energy Package), a parallel density-functional theory code for largescale first-principles quantum-mechanical calculations. The distinctive features of onetep are linear-scaling in both computational effort and resources, obtained by making well-controlled approximations which enable simulations to be performed with plane-wave accuracy. Titanium dioxide clusters of increasing size designed to mimic surfaces are studied to demonstrate the accuracy and scaling of onetep

An extended Fourier modal method for plane-wave scattering from finite structures

NARCIS (Netherlands)

Pisarenco, M.; Maubach, J.M.L.; Setija, I.D.; Mattheij, R.M.M.

2010-01-01

This paper extends the area of application of the Fourier modal method from periodic structures to aperiodic ones, in particular for plane-wave illumination at arbitrary angles. This is achieved by placing perfectly matched layers at the lateral sides of the computational domain and reformulating

Formation of whispering gallery modes by scattering of an electromagnetic plane wave by two cylinders

Energy Technology Data Exchange (ETDEWEB)

Abramov, Arnold, E-mail: qulaser@gmail.com [Kuang-Chi Institute of Advanced Technology, Shenzhen, 518057 (China); Kostikov, Alexander [Donbass State Engineering Academy, 84303, Kramatorsk, Donetsk (Ukraine)

2017-03-26

We report the effect of scattering of electromagnetic plane waves by two cylinders on whispering gallery mode (WGM) formation in a cylinder. WGM can occur because of the presence of additional cylinder scatterers at specific location, while WGMs can only form in a single cylinder for specific cylinder radius and/or wavelength values, the matching accuracy required would be much greater than that required in our model for the additional cylinders locations. Analysis of the general solution to the problem showed that the effect can be explained by the interference of waves scattered by additional cylinders and incident on the main cylinder. - Highlights: • We consider scattering of electromagnetic plane waves by two cylinders. • WGMs occur because of the presence of additional cylinder at specific location. • The accuracy for the locations is much less than required for specific values of single cylinder. • The interference of waves scattered by additional cylinders and incident on the main is responsible for the effect.

Plane shock wave studies of geologic media

International Nuclear Information System (INIS)

Anderson, G.D.; Larson, D.B.

1977-01-01

Plane shock wave experiments have been conducted on eight geologic materials in an effort to determine the importance of time-dependent mechanical behavior. Of the eight rocks studied, only Westerly granite and nugget sandstone appear to show time independence. In the slightly porous materials (1-5 percent), Blair dolomite and sodium chloride, and in the highly porous (15 to 40 percent) rock, Mt. Helen tuff and Indiana limestone, time-dependent behavior is associated with the time required to close the available porosity. In water-saturated rocks the time dependence arises because the water that is present shows no indication of transformation to the higher pressure ice phases, thus suggesting the possibility that a metastable form of water exists under dynamic conditions

The influence of air-filled structures on wave propagation and beam formation of a pygmy sperm whale (Kogia breviceps) in horizontal and vertical planes.

Science.gov (United States)

Song, Zhongchang; Zhang, Yu; Thornton, Steven W; Li, Songhai; Dong, Jianchen

2017-10-01

The wave propagation, sound field, and transmission beam pattern of a pygmy sperm whale (Kogia breviceps) were investigated in both the horizontal and vertical planes. Results suggested that the signals obtained at both planes were similarly characterized with a high peak frequency and a relatively narrow bandwidth, close to the ones recorded from live animals. The sound beam measured outside the head in the vertical plane was narrower than that of the horizontal one. Cases with different combinations of air-filled structures in both planes were used to study the respective roles in controlling wave propagation and beam formation. The wave propagations and beam patterns in the horizontal and vertical planes elucidated the important reflection effect of the spermaceti and vocal chambers on sound waves, which was highly significant in forming intensive forward sound beams. The air-filled structures, the forehead soft tissues and skull structures formed wave guides in these two planes for emitted sounds to propagate forward.

The study of structural phase transitions and static properties using transition metal model pseudopotential (TMMP) for Ca and Sr

Energy Technology Data Exchange (ETDEWEB)

Rakhecha, Shalu, E-mail: shalurakhecha@yahoo.com; Vyas, P. R.; Gohel, V. B. [Department of Physics, School of Sciences, Gujarat University, Ahmedabad - 380009, Gujarat (India); Bhatt, N. K. [Department of Physics, Sardar Patel University, Vallabh Vidyanagar - 388120, Gujarat (India)

2016-05-06

In the present communication, we have computed static and dynamic properties (binding energy-E, bulk modulus-B and second moment- <ω{sup 2}>) as well as first order pressure induced phase transition (FCC-BCC) using local form of pseudopotential for Calcium and Strontium. The form of pseudopotential used for the computation is directly extracted from Generalized Pseudopotential Theory (GPT) which contains three parameters (r{sub c}, r{sub d} and β). We have suggested a simple method using which pseudopotential is determined by single parameter (β). Our computed results for binding energy and bulk modulii are in excellent agreement with experimental findings and are better than other theoretical results. The present study confirms that s-d hybridization is accounted properly in the presently used pseudopotential and can be extended for the study of lattice mechanical properties of these metals.

Acoustic backscattering and radiation force on a rigid elliptical cylinder in plane progressive waves.

Science.gov (United States)

Mitri, F G

2016-03-01

This work proposes a formal analytical theory using the partial-wave series expansion (PWSE) method in cylindrical coordinates, to calculate the acoustic backscattering form function as well as the radiation force-per-length on an infinitely long elliptical (non-circular) cylinder in plane progressive waves. The major (or minor) semi-axis of the ellipse coincides with the direction of the incident waves. The scattering coefficients for the rigid elliptical cylinder are determined by imposing the Neumann boundary condition for an immovable surface and solving a resulting system of linear equations by matrix inversion. The present method, which utilizes standard cylindrical (Bessel and Hankel) wave functions, presents an advantage over the solution for the scattering that is ordinarily expressed in a basis of elliptical Mathieu functions (which are generally non-orthogonal). Furthermore, an integral equation showing the direct connection of the radiation force function with the square of the scattering form function in the far-field from the scatterer (applicable for plane waves only), is noted and discussed. An important application of this integral equation is the adequate evaluation of the radiation force function from a bistatic measurement (i.e., in the polar plane) of the far-field scattering from any 2D object of arbitrary shape. Numerical predictions are evaluated for the acoustic backscattering form function and the radiation force function, which is the radiation force per unit length, per characteristic energy density, and per unit cross-sectional surface of the ellipse, with particular emphasis on the aspect ratio a/b, where a and b are the semi-axes, as well as the dimensionless size parameter kb, without the restriction to a particular range of frequencies. The results are particularly relevant in acoustic levitation, acousto-fluidics and particle dynamics applications. Copyright © 2015 Elsevier B.V. All rights reserved.

Quantum mechanics of lattice gas automata: One-particle plane waves and potentials

International Nuclear Information System (INIS)

Meyer, D.A.

1997-01-01

Classical lattice gas automata effectively simulate physical processes, such as diffusion and fluid flow (in certain parameter regimes), despite their simplicity at the microscale. Motivated by current interest in quantum computation we recently defined quantum lattice gas automata; in this paper we initiate a project to analyze which physical processes these models can effectively simulate. Studying the single particle sector of a one-dimensional quantum lattice gas we find discrete analogs of plane waves and wave packets, and then investigate their behavior in the presence of inhomogeneous potentials. copyright 1997 The American Physical Society

Benchmark density functional theory calculations for nanoscale conductance

DEFF Research Database (Denmark)

Strange, Mikkel; Bækgaard, Iben Sig Buur; Thygesen, Kristian Sommer

2008-01-01

We present a set of benchmark calculations for the Kohn-Sham elastic transmission function of five representative single-molecule junctions. The transmission functions are calculated using two different density functional theory methods, namely an ultrasoft pseudopotential plane-wave code...

Large amplitude solitary waves in a multicomponent plasma with negative ions

International Nuclear Information System (INIS)

Nakamura, Y.; Tsukabayashi, I.; Ludwig, G.O.; Ferreira, J.L.

1987-09-01

When the concentration of negative ions is larger than a critical value, a small compressive pulse evolves into a subsonic wave train and a large pulse develops into a solitary wave. The threshold amplitude and velocity of the solitary waves are measured and compared with predictions using the pseudopotential method. (author) [pt

On the energy-momentum density of gravitational plane waves

International Nuclear Information System (INIS)

Dereli, T; Tucker, R W

2004-01-01

By embedding Einstein's original formulation of general relativity into a broader context, we show that a dynamic covariant description of gravitational stress-energy emerges naturally from a variational principle. A tensor T G is constructed from a contraction of the Bel tensor with a symmetric covariant second degree tensor field Φ and has a form analogous to the stress-energy tensor of the Maxwell field in an arbitrary spacetime. For plane-fronted gravitational waves helicity-2 polarized (graviton) states can be identified carrying non-zero energy and momentum

String interactions in a plane-fronted parallel-wave spacetime

International Nuclear Information System (INIS)

Gopakumar, Rajesh

2002-01-01

We argue that string interactions in a plane-fronted parallel-wave spacetime are governed by an effective coupling g eff =g s (μp + α ' )f(μp + α ' ) where f(μp + α ' ) is proportional to the light-cone energy of the string states involved in the interaction. This simply follows from generalities of a matrix string description of this background. g eff nicely interpolates between the expected result (g s ) for flat space (small μp + α ' ) and a recently conjectured expression from the perturbative gauge theory side (large μp + α ' )

Analytic representation for first-principles pseudopotentials

International Nuclear Information System (INIS)

Lam, P.K.; Cohen, M.L.; Zunger, A.

1980-01-01

The first-principles pseudopotentials developed by Zunger and Cohen are fit with a simple analytic form chosen to model the main physical properties of the potentials. The fitting parameters for the first three rows of the Periodic Table are presented, and the quality of the fit is discussed. The parameters reflect chemical trends of the elements. We find that a minimum of three parameters is required to reproduce the regularities of the Periodic Table. Application of these analytic potentials is also discussed

Full Development Of Pseudopotentials That Work For All Elements ...

African Journals Online (AJOL)

(1982) as well as the prescription of Pattnaik et al.(1979) which eliminated the numerical instability problems. The liquid metal resistivity is evaluated using Simpson's rule. Keywords: Pseudopotential, liquid metal resistivity, matrix element, linear coefficients, inverse orthogonality transformation. Nigerian Journal of Physics ...

Test of parameter-free local pseudopotential for the study of dynamical elastic constants - Cu as a prototype

Science.gov (United States)

Bhatia, K. G.; Vyas, S. M.; Patel, A. B.; Bhatt, N. K.; Vyas, P. R.; Gohel, V. B.

2018-05-01

Using parameter-free (first principles local) pseudopotential, in the present communication we have calculated dynamical elastic constants (C11, C12 and C44), bulk modulus (B), shear modulus (µp), Young's modulus (Y) and Poisson's ratio (σ) in long wavelength limit. Our computed results are well agreed for C44 and B with experiment and with other theoretical results obtained within framework of second order perturbation pseudopotential theory. From the present study we conclude that pseudopotential used contain s-p hybridization and no extra term is required to account core-core repulsion.

Pseudopotentials for calculating the bulk and surface properties of solids

International Nuclear Information System (INIS)

Cohen, M.L.

1983-01-01

A survey is presented describing research in condensed matter physics using pseudopotentials to calculate electronic, structural, and vibrational properties of solids. Semiconductors are emphasized, and both bulk and surface calculations are discussed. (author) [pt

On completeness and orthogonality of solutions of relativistic wave equations on zero plane

International Nuclear Information System (INIS)

Gitman, D.M.; Shakhmatov, V.M.; Shvartsman, Sh.M.

1975-01-01

The work considers the possible redeterminations of the scalar product for the relativistic wave fields, such as the Klein-Gordon and Dirac ones. It has been shown that a whole class of new exact solutions, for which the usual scalar product on the plane x 0 =const. could not be previously determinated, allows a correct scalar product on the zero plane x 0 -x 3 =const. The relations of orthogonality and completeness with respect to the above scalar product have been proved. Possible applications of the obtained results are discussed

Electronic structure prediction via data-mining the empirical pseudopotential method

Energy Technology Data Exchange (ETDEWEB)

Zenasni, H; Aourag, H [LEPM, URMER, Departement of Physics, University Abou Bakr Belkaid, Tlemcen 13000 (Algeria); Broderick, S R; Rajan, K [Department of Materials Science and Engineering, Iowa State University, Ames, Iowa 50011-2230 (United States)

2010-01-15

We introduce a new approach for accelerating the calculation of the electronic structure of new materials by utilizing the empirical pseudopotential method combined with data mining tools. Combining data mining with the empirical pseudopotential method allows us to convert an empirical approach to a predictive approach. Here we consider tetrahedrally bounded III-V Bi semiconductors, and through the prediction of form factors based on basic elemental properties we can model the band structure and charge density for these semi-conductors, for which limited results exist. This work represents a unique approach to modeling the electronic structure of a material which may be used to identify new promising semi-conductors and is one of the few efforts utilizing data mining at an electronic level. (Abstract Copyright [2010], Wiley Periodicals, Inc.)

Effect of the forcing term in the pseudopotential lattice Boltzmann modeling of thermal flows.

Science.gov (United States)

Li, Qing; Luo, K H

2014-05-01

The pseudopotential lattice Boltzmann (LB) model is a popular model in the LB community for simulating multiphase flows. Recently, several thermal LB models, which are based on the pseudopotential LB model and constructed within the framework of the double-distribution-function LB method, were proposed to simulate thermal multiphase flows [G. Házi and A. Márkus, Phys. Rev. E 77, 026305 (2008); L. Biferale, P. Perlekar, M. Sbragaglia, and F. Toschi, Phys. Rev. Lett. 108, 104502 (2012); S. Gong and P. Cheng, Int. J. Heat Mass Transfer 55, 4923 (2012); M. R. Kamali et al., Phys. Rev. E 88, 033302 (2013)]. The objective of the present paper is to show that the effect of the forcing term on the temperature equation must be eliminated in the pseudopotential LB modeling of thermal flows. First, the effect of the forcing term on the temperature equation is shown via the Chapman-Enskog analysis. For comparison, alternative treatments that are free from the forcing-term effect are provided. Subsequently, numerical investigations are performed for two benchmark tests. The numerical results clearly show that the existence of the forcing-term effect will lead to significant numerical errors in the pseudopotential LB modeling of thermal flows.

Back Radiation Suppression through a Semitransparent Ground Plane for a mm-Wave Patch Antenna

KAUST Repository

Klionovski, Kirill

2017-06-21

Omnidirectional radiation pattern with minimum backward radiation is highly desirable for base station antennas to minimize the multipath effects. Semitransparent ground planes have been used to reduce the backward radiation, but mostly with complicated non-uniform impedance distribution. In this work, we propose, for the first time, a round semitransparent ground plane of radius 0.8 λ with uniform impedance distribution that can improve the front-to-back ratio of a wideband patch antenna by 11.6 dB as compared to a similar sized metallic ground plane. The value of uniform impedance is obtained through analytical optimization by using asymptotic expressions in the Kirchhoff approximation of the radiation pattern of a toroidal wave scattered by a round semitransparent ground plane. The semitransparent ground plane has been realized using a low-cost carbon paste on a Kapton film. Experimental results match closely with those of simulations and validate the overall concept.

A wavenumber approach to analysing the active control of plane waves with arrays of secondary sources

Science.gov (United States)

Elliott, Stephen J.; Cheer, Jordan; Bhan, Lam; Shi, Chuang; Gan, Woon-Seng

2018-04-01

The active control of an incident sound field with an array of secondary sources is a fundamental problem in active control. In this paper the optimal performance of an infinite array of secondary sources in controlling a plane incident sound wave is first considered in free space. An analytic solution for normal incidence plane waves is presented, indicating a clear cut-off frequency for good performance, when the separation distance between the uniformly-spaced sources is equal to a wavelength. The extent of the near field pressure close to the source array is also quantified, since this determines the positions of the error microphones in a practical arrangement. The theory is also extended to oblique incident waves. This result is then compared with numerical simulations of controlling the sound power radiated through an open aperture in a rigid wall, subject to an incident plane wave, using an array of secondary sources in the aperture. In this case the diffraction through the aperture becomes important when its size is compatible with the acoustic wavelength, in which case only a few sources are necessary for good control. When the size of the aperture is large compared to the wavelength, and diffraction is less important but more secondary sources need to be used for good control, the results then become similar to those for the free field problem with an infinite source array.

Observation of proton chorus waves close to the equatorial plane by Cluster

Science.gov (United States)

Grison, B.; Pickett, J. S.; Santolik, O.; Robert, P.; Cornilleau-Wehrlin, N.; Engebretson, M. J.; Constantinescu, D. O.

2009-12-01

Whistler mode chorus waves are a widely studied phenomena. They are present in numerous regions of the magnetosphere and are presumed to originate in the magnetic equatorial region. In a spectrogram they are characterized by narrowband features with rise (or fall) in frequency over short periods of time. Being whistler mode waves around a few tenths of the electron cyclotron frequency they interact mainly with electrons. In the present study we report observations by the Cluster spacecraft of what we call proton chorus waves. They have spectral features with rising frequency, similar to the electron chorus waves, but they are detected in a frequency range that starts roughly at 0.50fH+ up to fH+ (the local proton gyro-frequency). The lower part of their spectrum seems to originate from monochromatic Pc 1 waves (1.5 Hz). Proton chorus waves are detected close to the magnetic equatorial plane in both hemispheres during the same event. Our interpretation of these waves as proton chorus is supported by polarization analysis with the Roproc procedures and the Prassadco software using both the magnetic (STAFF-SC) and electric (EFW) parts of the fluctuations spectrum.

Solution of the Bethe-Salpeter equation in the field of a plane electromagnetic wave

International Nuclear Information System (INIS)

Starostin, V.S.

1988-01-01

A solution is obtained of the Bethe--Salpeter equation for positronium in the field of linearly and circularly polarized plane electromagnetic waves at frequencies much higher than atomic. It is not assumed that the field is weak

Initial value problem for colliding gravitational plane waves. III

International Nuclear Information System (INIS)

Hauser, I.; Ernst, F.J.

1990-01-01

The development of a homogeneous Hilbert problem (HHP) approach to the initial value problem (IVP) for colliding gravitational plane waves with noncollinear polarization that began in two earlier papers [I. Hauser and F. J. Ernst, J. Math. Phys. 30, 872 (1989) and 30, 2322 (1989)] is continued. After formulating the HHP, the description of how one can apply it to generate a new family of solutions of the colliding wave problem that generalizes a three-parameter family constructed by Ernst, Garcia, and Hauser [J. Math. Phys. 29, 681 (1988)] using a double-Harrison transformation is given. Then the proof that the solution of the new HHP indeed solves the IVP that is posed is presented. A matrix Fredholm equation of the second kind that is equivalent to the HHP is also deduced. This will be used in a sequel to complete the proof of existence of solutions of the HHP and the proof that certain assumed differentiability hypotheses are in fact valid

Actinides and lanthanides under pressure: the pseudopotential approach; Actinides et terres rares sous pression: approche pseudopotentiel

Energy Technology Data Exchange (ETDEWEB)

Richard, N

2002-07-01

In the Density Functional Theory Framework, the pseudopotential formalism offers a broader scope of study than other theoretical methods such as global relaxation of the parameters of the cell or ab initio molecular dynamics simulations. This method has been widely used to study light elements or transition metals but never to study f elements. We have generated two non local norm conserving Trouillier-Martins pseudopotentials (one in LDA and one in GGA) for the cerium. To check the validity of the pseudopotentials, we have calculated the equilibrium volume and the incompressibility modulus and compared our results to previous all-electron calculations. If the GGA and non linear core corrections are used, the equation of state is in a good agreement with the experimental equation of state. A static study of the previously proposed high pressure phases give a transitions fcc-a''(I)-bct. Using the pseudopotentials we have generated, an ab initio molecular dynamics simulation at constant pressure, in the region between 5 and 12 GPa where the stable phase of cerium is not well defined, lead us to predict that a centred monoclinic structure, as the a''(I) phase previously observed in some experiments, is the most stable phase. We have also generated pseudopotentials for the light actinides (Th, Pa, U and Np). We have study their phase transitions under pressure at zero temperature. We compared our results with all electron results. The structure parameters have always been relaxed in this study. And for the first time in pseudopotential calculation, the spin-orbit coupling has been taken into account. The curves describing the variation of the volume or the incompressibility modulus depending on the elements and the phase transitions are always in agreement with the one found in the all electron calculations. (author)

Path integral for spinning particle in the plane wave field: Global and local projections

International Nuclear Information System (INIS)

Boudiaf, N.; Boudjedaa, T.; Chetouani, L.

2001-01-01

The Green function related to the problem of a Dirac particle interacting with a plane wave is calculated via the path integral formalism proposed recently by Alexandrou et al. according to the two so-called global and local projections. With the help of the incorporation of two simple identities, it is shown that the contribution to the calculation of the integrals comes essentially from classical solutions projected along the direction of wave propagation. (orig.)

Computational dosimetry in embryos exposed to electromagnetic plane waves over the frequency range of 10 MHz-1.5 GHz

International Nuclear Information System (INIS)

Kawai, Hiroki; Nagaoka, Tomoaki; Watanabe, Soichi; Saito, Kazuyuki; Takahashi, Masaharu; Ito, Koichi

2010-01-01

This paper presents calculated specific absorption rate (SAR) dosimetry in 4 and 8 week Japanese pregnant-woman models exposed to plane waves over the frequency range of 10 MHz-1.5 GHz. Two types of 2 mm spatial-resolution pregnant-woman models comprised a woman model, which is similar to the average-sized Japanese adult female in height and weight, with a cubic (4 week) embryo or spheroidal (8 week) one. The averaged SAR in the embryos exposed to vertically and horizontally polarized plane waves at four kinds of propagation directions are calculated from 10 MHz to 1.5 GHz. The results indicate that the maximum average SAR in the embryos exposed to plane waves is lower than 0.08 W kg -1 when the incident power density is at the reference level of ICNIRP guideline for general public environment. (note)

Diffraction of an inhomogeneous plane wave by an impedance wedge in a lossy medium

CSIR Research Space (South Africa)

Manara, G

1998-11-01

Full Text Available The diffraction of an inhomogeneous plane wave by an impedance wedge embedded in a lossy medium is analyzed. The rigorous integral representation for the field is asymptotically evaluated in the context of the uniform geometrical theory...

Stability of plane wave solutions of the two-space-dimensional nonlinear Schroedinger equation

International Nuclear Information System (INIS)

Martin, D.U.; Yuen, H.C.; Saffman, P.G.

1980-01-01

The stability of plane, periodic solutions of the two-dimensional nonlinear Schroedinger equation to infinitesimal, two-dimensional perturbation has been calculated and verified numerically. For standing wave disturbances, instability is found for both odd and even modes; as the period of the unperturbed solution increases, the instability associated with the odd modes remains but that associated with the even mode disappears, which is consistent with the results of Zakharov and Rubenchik, Saffman and Yuen and Ablowitz and Segur on the stability of solitons. In addition, we have identified travelling wave instabilities for the even mode perturbations which are absent in the long-wave limit. Extrapolation to the case of an unperturbed solution with infinite period suggests that these instabilities may also be present for the soliton. In other words, the soliton is unstable to odd, standing-wave perturbations, and very likely also to even, travelling-wave perturbations. (orig.)

Optimization of exit-plane waves restored from HRTEM through-focal series

International Nuclear Information System (INIS)

Erni, Rolf; Rossell, Marta D.; Nakashima, Philip N.H.

2010-01-01

Atomic-resolution transmission electron microscopy has largely benefited from the implementation of aberration correctors in the imaging part of the microscope. Though the dominant geometrical axial aberrations can in principle be corrected or suitably adjusted, the impact of higher-order aberrations, which are mainly due to the implementation of non-round electron optical elements, on the imaging process remains unclear. Based on a semi-empirical criterion, we analyze the impact of residual aperture aberrations on the quality of exit-plane waves that are retrieved from through-focal series recorded using an aberration-corrected and monochromated instrument which was operated at 300 kV and enabled for an information transfer of ∼0.05 nm. We show that the impact of some of the higher-order aberrations in retrieved exit-plane waves can be balanced by a suitable adjustment of symmetry equivalent lower-order aberrations. We find that proper compensation and correction of 1st and 2nd order aberrations is critical, and that the required accuracy is difficult to achieve. This results in an apparent insensitivity towards residual higher-order aberrations. We also investigate the influence of the detector characteristics on the image contrast. We find that correction for the modulation transfer function results in a contrast gain of up to 40%.

Improved Plane-Wave Ultrasound Beamforming by Incorporating Angular Weighting and Coherent Compounding in Fourier Domain.

Science.gov (United States)

Chen, Chuan; Hendriks, Gijs A G M; van Sloun, Ruud J G; Hansen, Hendrik H G; de Korte, Chris L

2018-05-01

In this paper, a novel processing framework is introduced for Fourier-domain beamforming of plane-wave ultrasound data, which incorporates coherent compounding and angular weighting in the Fourier domain. Angular weighting implies spectral weighting by a 2-D steering-angle-dependent filtering template. The design of this filter is also optimized as part of this paper. Two widely used Fourier-domain plane-wave ultrasound beamforming methods, i.e., Lu's f-k and Stolt's f-k methods, were integrated in the framework. To enable coherent compounding in Fourier domain for the Stolt's f-k method, the original Stolt's f-k method was modified to achieve alignment of the spectra for different steering angles in k-space. The performance of the framework was compared for both methods with and without angular weighting using experimentally obtained data sets (phantom and in vivo), and data sets (phantom) provided by the IEEE IUS 2016 plane-wave beamforming challenge. The addition of angular weighting enhanced the image contrast while preserving image resolution. This resulted in images of equal quality as those obtained by conventionally used delay-and-sum (DAS) beamforming with apodization and coherent compounding. Given the lower computational load of the proposed framework compared to DAS, to our knowledge it can, therefore, be concluded that it outperforms commonly used beamforming methods such as Stolt's f-k, Lu's f-k, and DAS.

Worldline path integrals for a Dirac particle in a weak gravitational plane wave

International Nuclear Information System (INIS)

Haouat, S.; Chetouani, L.

2008-01-01

The problem of a relativistic spinning particle interacting with a weak gravitational plane wave in (3+1) dimensions is formulated in the frame work of covariant supersymmetric path integrals. The relative Green function is expressed through a functional integral over bosonic trajectories that describe the external motion and fermionic variables that describe the spin degrees of freedom. The (3+1) dimensional problem is reduced to the (1+1) dimensional one by using an identity. Next, the relative propagator is exactly calculated and the wave functions are extracted. (orig.)

A standing wave linear ultrasonic motor operating in in-plane expanding and bending modes.

Science.gov (United States)

Chen, Zhijiang; Li, Xiaotian; Ci, Penghong; Liu, Guoxi; Dong, Shuxiang

2015-03-01

A novel standing wave linear ultrasonic motor operating in in-plane expanding and bending modes was proposed in this study. The stator (or actuator) of the linear motor was made of a simple single Lead Zirconate Titanate (PZT) ceramic square plate (15 × 15 × 2 mm(3)) with a circular hole (D = 6.7 mm) in the center. The geometric parameters of the stator were computed with the finite element analysis to produce in-plane bi-mode standing wave vibration. The calculated results predicted that a driving tip attached at midpoint of one edge of the stator can produce two orthogonal, approximate straight-line trajectories, which can be used to move a slider in linear motion via frictional forces in forward or reverse direction. The investigations showed that the proposed linear motor can produce a six times higher power density than that of a previously reported square plate motor.

Fully local orbital-free calculation of electronic structure using pseudopotentials

NARCIS (Netherlands)

Pino, R.; Markvoort, Albert. J.; Santen, van R.A.; Hilbers, P.A.J.

2003-01-01

An exactly solvable orbital-free technique is applied to the calculation of the electronic structure of polyatomic systems. The Thomas–Fermi kinetic energy, local exchange, local electrostatic energy functionals, and pseudopotentials are used. Given the potential, the cost of the calculation of the

Atomistic simulation of the mechanical properties of β-SiC based on the first-principles

Energy Technology Data Exchange (ETDEWEB)

Zhang, Renhui, E-mail: zrh_111@126.com [Research Center of Material and Chemical Engineering, School of Material and Chemical Engineering, Tongren University, Tongren 554300 (China); Leng, Senlin, E-mail: 764546880@qq.com [Research Center of Material and Chemical Engineering, School of Material and Chemical Engineering, Tongren University, Tongren 554300 (China); Yang, Yingchang; Shi, Wei [Research Center of Material and Chemical Engineering, School of Material and Chemical Engineering, Tongren University, Tongren 554300 (China); Lu, Zhibin, E-mail: zblu@licp.cas.cn [Lanzhou Institute of Chemical Physics, Lanzhou 730000 (China)

2017-05-01

On the basis of the pseudopotential plane-wave method and the local-density-functional theory, this work studied the energetics and stress-strain relationship of β-SiC, where uniform uniaxial compression and tension were considered along (001), (110) and (111) planes. The calculated results were in consistence with the experimental data. The present work should be conducive to understanding the mechanical property of β-SiC.

Multiple projection optical diffusion tomography with plane wave illumination

International Nuclear Information System (INIS)

Markel, Vadim A; Schotland, John C

2005-01-01

We describe a new data collection scheme for optical diffusion tomography in which plane wave illumination is combined with multiple projections in the slab imaging geometry. Multiple projection measurements are performed by rotating the slab around the sample. The advantage of the proposed method is that the measured data are more compatible with the dynamic range of most commonly used detectors. At the same time, multiple projections improve image quality by mutually interchanging the depth and transverse directions, and the scanned (detection) and integrated (illumination) surfaces. Inversion methods are derived for image reconstructions with extremely large data sets. Numerical simulations are performed for fixed and rotated slabs

Compressive and rarefactive solitary waves in nonthermal two-component plasmas

International Nuclear Information System (INIS)

Verheest, Frank; Hellberg, Manfred A.

2010-01-01

Using a Sagdeev pseudopotential formalism where nonlinear structures are stationary in a comoving frame, large ion-acoustic solitary waves and double layers have been studied in plasmas with positive ions and nonthermal electrons. The velocity range of positive, compressive solitary waves is limited by the ion density reaching infinite compression, whereas negative, rarefactive solitary waves and double layers can exist when the electron nonthermality exceeds a certain minimum. There are even regions of coexistence, the limits of which can be elucidated by considering the properties of the special Sagdeev pseudopotential at the acoustic speed. In particular, when the compositional parameters and Mach numbers admit only compressive or rarefactive solitary structures, these have to be superacoustic, their amplitude vanishing at the acoustic speed. When both compressive and rarefactive modes can occur, one of them is Korteweg-de Vries (KdV)-like, the other having a non-KdV character, with a finite amplitude at the acoustic speed.

Plane wave diffraction by a finite plate with impedance boundary conditions.

Science.gov (United States)

Nawaz, Rab; Ayub, Muhammad; Javaid, Akmal

2014-01-01

In this study we have examined a plane wave diffraction problem by a finite plate having different impedance boundaries. The Fourier transforms were used to reduce the governing problem into simultaneous Wiener-Hopf equations which are then solved using the standard Wiener-Hopf procedure. Afterwards the separated and interacted fields were developed asymptotically by using inverse Fourier transform and the modified stationary phase method. Detailed graphical analysis was also made for various physical parameters we were interested in.

Acoustic multipath arrivals in the horizontal plane due to approaching nonlinear internal waves.

Science.gov (United States)

Badiey, Mohsen; Katsnelson, Boris G; Lin, Ying-Tsong; Lynch, James F

2011-04-01

Simultaneous measurements of acoustic wave transmissions and a nonlinear internal wave packet approaching an along-shelf acoustic path during the Shallow Water 2006 experiment are reported. The incoming internal wave packet acts as a moving frontal layer reflecting (or refracting) sound in the horizontal plane. Received acoustic signals are filtered into acoustic normal mode arrivals. It is shown that a horizontal multipath interference is produced. This has previously been called a horizontal Lloyd's mirror. The interference between the direct path and the refracted path depends on the mode number and frequency of the acoustic signal. A mechanism for the multipath interference is shown. Preliminary modeling results of this dynamic interaction using vertical modes and horizontal parabolic equation models are in good agreement with the observed data.

Pramana – Journal of Physics | Indian Academy of Sciences

Indian Academy of Sciences (India)

Pseudopotential plane-wave method (PP–PW) based on density functional theory (DFT) and density functional perturbation theory (DFPT) within the Teter and Pade exchangecorrelation functional form of the local spin density approximation (LSDA) is applied to study the effect of pressure on the elastic and piezoelectric ...

Application of structural symmetries in the plane-wave-based transfer-matrix method for three-dimensional photonic crystal waveguides

International Nuclear Information System (INIS)

Li Zhiyuan; Ho Kaiming

2003-01-01

The plane-wave-based transfer-matrix method (TMM) exhibits a peculiar advantage of being capable of solving eigenmodes involved in an infinite photonic crystal and electromagnetic (EM) wave propagation in finite photonic crystal slabs or even semi-infinite photonic crystal structures within the same theoretical framework. In addition, this theoretical approach can achieve much improved numerical convergency in solution of photonic band structures than the conventional plane-wave expansion method. In this paper we employ this TMM in combination with a supercell technique to handle two important kinds of three-dimensional (3D) photonic crystal waveguide structures. The first one is waveguides created in a 3D layer-by-layer photonic crystal that possesses a complete band gap, the other more popular one is waveguides built in a two-dimensional photonic crystal slab. These waveguides usually have mirror-reflection symmetries in one or two directions perpendicular to their axis. We have taken advantage of these structural symmetries to reduce the numerical burden of the TMM solution of the guided modes. The solution to the EM problems under these mirror-reflection symmetries in both the real space and the plane-wave space is discussed in a systematic way and in great detail. Both the periodic boundary condition and the absorbing boundary condition are employed to investigate structures with or without complete 3D optical confinement. The fact that the EM field components investigated in the TMM are collinear with the symmetric axes of the waveguide brings great convenience and clarity in exploring the eigenmode symmetry in both the real space and the plane-wave space. The classification of symmetry involved in the guided modes can help people to better understand the coupling of the photonic crystal waveguides with external channels such as dielectric slab or wire waveguides

Ab initio study on structural stability of uranium carbide

International Nuclear Information System (INIS)

Sahoo, B.D.; Joshi, K.D.; Gupta, Satish C.

2013-01-01

First principles calculations have been performed using plane wave pseudopotential and full potential linearized augmented plane wave (FP-LAPW) methods to analyze structural, elastic and dynamic stability of UC under hydrostatic compression. Our calculations within pseudopotential method suggest that the rocksalt (B1) structure will transform to body centered orthorhombic (bco) structure at ∼21.5 GPa. The FP-LAPW calculations put this transition at 23 GPa. The transition pressures determined from our calculations though agree reasonably with the experimental value of 27 GPa, the high pressure bco structure suggested by theory differs slightly from the experimentally reported pseudo bco phase. The elastic stability analysis of B1 phase suggests that the B1 to bco transition is driven by the failure of C 44 modulus. This finding is further substantiated by the lattice dynamic calculations which demonstrate that the B1 phase becomes dynamically unstable around the transition pressure and the instability is of long wavelength nature

Extending the precision and efficiency of the all-electron full-potential linearized augmented plane-wave density-functional theory method

International Nuclear Information System (INIS)

Michalicek, Gregor

2015-01-01

Density functional theory (DFT) is the most widely-used first-principles theory for analyzing, describing and predicting the properties of solids based on the fundamental laws of quantum mechanics. The success of the theory is a consequence of powerful approximations to the unknown exchange and correlation energy of the interacting electrons and of sophisticated electronic structure methods that enable the computation of the density functional equations on a computer. A widely used electronic structure method is the full-potential linearized augmented plane-wave (FLAPW) method, that is considered to be one of the most precise methods of its kind and often referred to as a standard. Challenged by the demand of treating chemically and structurally increasingly more complex solids, in this thesis this method is revisited and extended along two different directions: (i) precision and (ii) efficiency. In the full-potential linearized augmented plane-wave method the space of a solid is partitioned into nearly touching spheres, centered at each atom, and the remaining interstitial region between the spheres. The Kohn-Sham orbitals, which are used to construct the electron density, the essential quantity in DFT, are expanded into a linearized augmented plane-wave basis, which consists of plane waves in the interstitial region and angular momentum dependent radial functions in the spheres. In this thesis it is shown that for certain types of materials, e.g., materials with very broad electron bands or large band gaps, or materials that allow the usage of large space-filling spheres, the variational freedom of the basis in the spheres has to be extended in order to represent the Kohn-Sham orbitals with high precision over a large energy spread. Two kinds of additional radial functions confined to the spheres, so-called local orbitals, are evaluated and found to successfully eliminate this error. A new efficient basis set is developed, named linearized augmented lattice

Plane wave diffraction by a finite plate with impedance boundary conditions.

Directory of Open Access Journals (Sweden)

Rab Nawaz

Full Text Available In this study we have examined a plane wave diffraction problem by a finite plate having different impedance boundaries. The Fourier transforms were used to reduce the governing problem into simultaneous Wiener-Hopf equations which are then solved using the standard Wiener-Hopf procedure. Afterwards the separated and interacted fields were developed asymptotically by using inverse Fourier transform and the modified stationary phase method. Detailed graphical analysis was also made for various physical parameters we were interested in.

Measurement Verification of Plane Wave Synthesis Technique Based on Multi-probe MIMO-OTA Setup

DEFF Research Database (Denmark)

Fan, Wei; Carreño, Xavier; Nielsen, Jesper Ødum

2012-01-01

Standardization work for MIMO OTA testing methods is currently ongoing, where a multi-probe anechoic chamber based solution is an important candidate. In this paper, the probes located on an OTA ring are used to synthesize a plane wave field in the center of the OTA ring. This paper investigates...

Diffraction of a plane electromagnetic wave on a dielectric plate of variable density. [Field equatios, diffracted-wave angular distributions

Energy Technology Data Exchange (ETDEWEB)

Aivazyan, Yu M; Mergelyan, O S; Poulatov, M P

1974-01-01

Aproblem for the diffraction of a plane electromagnetic wave on a dielectric plate between two other dielectrics is solved. The dielectric constant of the plate depends periodically on three coordinates. From this solution it is possible to obtain the equations for fields and the angular distribution of diffracted waves for the particular cases of a crystal plate and a dielectric surface fluted in all directions. If the expansion is made in the variable of the electron density in crystals, the results will correspond to the problem for the X-ray diffraction on a crystal lattice, the values of the coefficient ..cap alpha -->..sub(tau) being determined by the lattice parameters.

Large amplitude ion-acoustic solitary waves and double layers in multicomponent plasma with positrons

International Nuclear Information System (INIS)

Sabry, R.

2009-01-01

A finite amplitude theory for ion-acoustic solitary waves and double layers in multicomponent plasma consisting of hot positrons, cold ions, and electrons with two-electron temperature distributions is presented. Conditions are obtained under which large amplitude stationary ion-acoustic solitary waves and double layers can exist. For the physical parameters of interest, the ion-acoustic solitary wave (double layers) profiles and the relationship between the maximum soliton (double layers) amplitude and the Mach number are found. Also, we have presented the region of existence of the large amplitude ion-acoustic waves by analyzing the structure of the pseudopotential. For the selected range of parameters, it is found that only positive solitary waves and double layers can exist. An analysis for the small amplitude limit through the Sagdeev pseudopotential analysis and the reductive perturbation theory shows the existence of positive and negative ion-acoustic solitary waves and double layers. The effects of positron concentration and temperature ratio on the characteristics of the solitary ion-acoustic waves and double layers (namely, the amplitude and width) are discussed in detail. The relevance of this investigation to space and laboratory plasmas is pointed out.

Trajectories of electrons with large longitudinal momenta in the phase plane during surfatron acceleration by an electromagnetic wave

Energy Technology Data Exchange (ETDEWEB)

Mkrtichyan, G. S., E-mail: hay-13@mail.ru [Peoples’ Friendship University of Russia (Russian Federation)

2015-07-15

The trajectories of electrons with large longitudinal momenta in the phase plane in the course of their surfatron acceleration by an electromagnetic wave propagating in space plasma across the external magnetic field are analyzed. Electrons with large longitudinal momenta are trapped immediately if the initial wave phase Ψ(0) on the particle trajectory is positive. For negative values of Ψ(0), no electrons trapping by the wave is observed over the available computational times. According to numerical calculations, the trajectories of trapped particles in the phase plane have a singular point of the stable focus type and the behavior of the trajectory corresponds to the motion in a complex nonstationary effective potential well. For some initial phases, electrons are confined in the region of the accelerating electric field for relatively short time, the energy gain being about 50–130% and more.

Fast solution of elliptic partial differential equations using linear combinations of plane waves.

Science.gov (United States)

Pérez-Jordá, José M

2016-02-01

Given an arbitrary elliptic partial differential equation (PDE), a procedure for obtaining its solution is proposed based on the method of Ritz: the solution is written as a linear combination of plane waves and the coefficients are obtained by variational minimization. The PDE to be solved is cast as a system of linear equations Ax=b, where the matrix A is not sparse, which prevents the straightforward application of standard iterative methods in order to solve it. This sparseness problem can be circumvented by means of a recursive bisection approach based on the fast Fourier transform, which makes it possible to implement fast versions of some stationary iterative methods (such as Gauss-Seidel) consuming O(NlogN) memory and executing an iteration in O(Nlog(2)N) time, N being the number of plane waves used. In a similar way, fast versions of Krylov subspace methods and multigrid methods can also be implemented. These procedures are tested on Poisson's equation expressed in adaptive coordinates. It is found that the best results are obtained with the GMRES method using a multigrid preconditioner with Gauss-Seidel relaxation steps.

Generating gravity waves with matter and electromagnetic waves

International Nuclear Information System (INIS)

Barrabes, C.; Hogan, P A.

2008-01-01

If a homogeneous plane lightlike shell collides head on with a homogeneous plane electromagnetic shock wave having a step-function profile then no backscattered gravitational waves are produced. We demonstrate, by explicit calculation, that if the matter is accompanied by a homogeneous plane electromagnetic shock wave with a step-function profile then backscattered gravitational waves appear after the collision

Linear augmented plane wave method for self-consistent calculations

International Nuclear Information System (INIS)

Takeda, T.; Kuebler, J.

1979-01-01

O.K. Andersen has recently introduced a linear augmented plane wave method (LAPW) for the calculation of electronic structure that was shown to be computationally fast. A more general formulation of an LAPW method is presented here. It makes use of a freely disposable number of eigenfunctions of the radial Schroedinger equation. These eigenfunctions can be selected in a self-consistent way. The present formulation also results in a computationally fast method. It is shown that Andersen's LAPW is obtained in a special limit from the present formulation. Self-consistent test calculations for copper show the present method to be remarkably accurate. As an application, scalar-relativistic self-consistent calculations are presented for the band structure of FCC lanthanum. (author)

Electromagnetic forces and torques in nanoparticles irradiated by plane waves

International Nuclear Information System (INIS)

Garcia de Abajo, F.J.

2004-01-01

Optical tweezers and optical lattices are making it possible to control small particles by means of electromagnetic forces and torques. In this context, a method is presented in this work to calculate electromagnetic forces and torques for arbitrarily-shaped objects in the presence of other objects illuminated by a plane wave. The method is based upon an expansion of the electromagnetic field in terms of multipoles around each object, which are in turn used to derive forces and torques analytically. The calculation of multipole coefficients are obtained numerically by means of the boundary element method. Results are presented for both spherical and non-spherical objects

Explicit formulas for Neumann coefficients in the plane-wave geometry

International Nuclear Information System (INIS)

He Yanghui; Schwarz, John H.; Spradlin, Marcus; Volovich, Anastasia

2003-01-01

We obtain explicit formulas for the Neumann coefficients and associated quantities that appear in the three-string vertex for type IIB string theory in a plane-wave background, for any value of the mass parameter μ. The derivation involves constructing the inverse of a certain infinite-dimensional matrix, in terms of which the Neumann coefficients previously had been written only implicitly. We derive asymptotic expansions for large μ and find unexpectedly simple results, which are valid to all orders in 1/μ. Using BMN duality, these give predictions for certain gauge theory quantities to all orders in the modified 't Hooft coupling λ ' . A specific example is presented

Magnitude of pseudopotential localization errors in fixed node diffusion quantum Monte Carlo.

Science.gov (United States)

Krogel, Jaron T; Kent, P R C

2017-06-28

Growth in computational resources has lead to the application of real space diffusion quantum Monte Carlo to increasingly heavy elements. Although generally assumed to be small, we find that when using standard techniques, the pseudopotential localization error can be large, on the order of an electron volt for an isolated cerium atom. We formally show that the localization error can be reduced to zero with improvements to the Jastrow factor alone, and we define a metric of Jastrow sensitivity that may be useful in the design of pseudopotentials. We employ an extrapolation scheme to extract the bare fixed node energy and estimate the localization error in both the locality approximation and the T-moves schemes for the Ce atom in charge states 3+ and 4+. The locality approximation exhibits the lowest Jastrow sensitivity and generally smaller localization errors than T-moves although the locality approximation energy approaches the localization free limit from above/below for the 3+/4+ charge state. We find that energy minimized Jastrow factors including three-body electron-electron-ion terms are the most effective at reducing the localization error for both the locality approximation and T-moves for the case of the Ce atom. Less complex or variance minimized Jastrows are generally less effective. Our results suggest that further improvements to Jastrow factors and trial wavefunction forms may be needed to reduce localization errors to chemical accuracy when medium core pseudopotentials are applied to heavy elements such as Ce.

Surface effects on anti-plane shear waves propagating in magneto-electro-elastic nanoplates

International Nuclear Information System (INIS)

Wu, Bin; Zhang, Chunli; Chen, Weiqiu; Zhang, Chuanzeng

2015-01-01

Material surfaces may have a remarkable effect on the mechanical behavior of magneto-electro-elastic (or multiferroic) structures at nanoscale. In this paper, a surface magneto-electro-elasticity theory (or effective boundary condition formulation), which governs the motion of the material surface of magneto-electro-elastic nanoplates, is established by employing the state-space formalism. The properties of anti-plane shear (SH) waves propagating in a transversely isotropic magneto-electro-elastic plate with nanothickness are investigated by taking surface effects into account. The size-dependent dispersion relations of both antisymmetric and symmetric SH waves are presented. The thickness-shear frequencies and the asymptotic characteristics of the dispersion relations considering surface effects are determined analytically as well. Numerical results show that surface effects play a very pronounced role in elastic wave propagation in magneto-electro-elastic nanoplates, and the dispersion properties depend strongly on the chosen surface material parameters of magneto-electro-elastic nanoplates. As a consequence, it is possible to modulate the waves in magneto-electro-elastic nanoplates through surface engineering. (paper)

Ab initio phonon dispersions of face centered cubic Pb: effects of spin-orbit coupling

International Nuclear Information System (INIS)

Dal Corso, Andrea

2008-01-01

I present the ab initio phonon dispersions of face centered cubic Pb calculated within the framework of density functional perturbation theory, with plane waves and a fully relativistic ultrasoft pseudopotential which includes spin-orbit coupling effects. I find that, within the local density approximation, the theory gives phonon frequencies close to the experimental inelastic neutron scattering data. Many of the anomalies present in these dispersions are well reproduced by the fully relativistic pseudopotential theory and can be shown to appear only for small values of the smearing parameter that controls the sharpness of the Fermi surface.

Can continuous scans in orthogonal planes improve diagnostic performance of shear wave elastography for breast lesions?

Science.gov (United States)

Yang, Pan; Peng, Yulan; Zhao, Haina; Luo, Honghao; Jin, Ya; He, Yushuang

2015-01-01

Static shear wave elastography (SWE) is used to detect breast lesions, but slice and plane selections result in discrepancies. To evaluate the intraobserver reproducibility of continuous SWE, and whether quantitative elasticities in orthogonal planes perform better in the differential diagnosis of breast lesions. One hundred and twenty-two breast lesions scheduled for ultrasound-guided biopsy were recruited. Continuous SWE scans were conducted in orthogonal planes separately. Quantitative elasticities and histopathology results were collected. Reproducibility in the same plane and diagnostic performance in different planes were evaluated. The maximum and mean elasticities of the hardest portion, and standard deviation of whole lesion, had high inter-class correlation coefficients (0.87 to 0.95) and large areas under receiver operation characteristic curve (0.887 to 0.899). Without loss of accuracy, sensitivities had increased in orthogonal planes compared with single plane (from 73.17% up to 82.93% at most). Mean elasticity of whole lesion and lesion-to-parenchyma ratio were significantly less reproducible and less accurate. Continuous SWE is highly reproducible for the same observer. The maximum and mean elasticities of the hardest portion and standard deviation of whole lesion are most reliable. Furthermore, the sensitivities of the three parameters are improved in orthogonal planes without loss of accuracies.

Analytical Time-Domain Solution of Plane Wave Propagation Across a Viscoelastic Rock Joint

Science.gov (United States)

Zou, Yang; Li, Jianchun; Laloui, Lyesse; Zhao, Jian

2017-10-01

The effects of viscoelastic filled rock joints on wave propagation are of great significance in rock engineering. The solutions in time domain for plane longitudinal ( P-) and transverse ( S-) waves propagation across a viscoelastic rock joint are derived based on Maxwell and Kelvin models which are, respectively, applied to describe the viscoelastic deformational behaviour of the rock joint and incorporated into the displacement discontinuity model (DDM). The proposed solutions are verified by comparing with the previous studies on harmonic waves, which are simulated by sinusoidal incident P- and S-waves. Comparison between the predicted transmitted waves and the experimental data for P-wave propagation across a joint filled with clay is conducted. The Maxwell is found to be more appropriate to describe the filled joint. The parametric studies show that wave propagation is affected by many factors, such as the stiffness and the viscosity of joints, the incident angle and the duration of incident waves. Furthermore, the dependences of the transmission and reflection coefficients on the specific joint stiffness and viscosity are different for the joints with Maxwell and Kelvin behaviours. The alternation of the reflected and transmitted waveforms is discussed, and the application scope of this study is demonstrated by an illustration of the effects of the joint thickness. The solutions are also extended for multiple parallel joints with the virtual wave source method and the time-domain recursive method. For an incident wave with arbitrary waveform, it is convenient to adopt the present approach to directly calculate wave propagation across a viscoelastic rock joint without additional mathematical methods such as the Fourier and inverse Fourier transforms.

Accuracy and Precision of Plane Wave Vector Flow Imaging for Laminar and Complex Flow In Vivo

DEFF Research Database (Denmark)

Jensen, Jonas; Traberg, Marie Sand; Villagómez Hoyos, Carlos Armando

2017-01-01

In this study, a comparison between velocity fields for a plane wave 2-D vector flow imaging (VFI) method and a computational fluid dynamics (CFD) simulation is made. VFI estimates are obtained from the scan of a flow phantom, which mimics the complex flow conditions in the carotid artery....... Furthermore, the precision of the VFI method is investigated under laminar and complex flow conditions in vivo. The carotid bifurcation of a healthy volunteer was scanned using both fast plane wave ultrasound and magnetic resonance imaging (MRI). The acquired MRI geometry of the bifurcation was used...... difference within 15 %, however, it was 23 % in the external branch. For the in vivo scan, the precision in terms of mean standard deviation (SD) of estimates aligned to the cardiac cycle was highest in the center of the common carotid artery (SD 4.7◦ for angles) and lowest in the external branch and close...

ABINIT: Plane-Wave-Based Density-Functional Theory on High Performance Computers

Science.gov (United States)

Torrent, Marc

2014-03-01

For several years, a continuous effort has been produced to adapt electronic structure codes based on Density-Functional Theory to the future computing architectures. Among these codes, ABINIT is based on a plane-wave description of the wave functions which allows to treat systems of any kind. Porting such a code on petascale architectures pose difficulties related to the many-body nature of the DFT equations. To improve the performances of ABINIT - especially for what concerns standard LDA/GGA ground-state and response-function calculations - several strategies have been followed: A full multi-level parallelisation MPI scheme has been implemented, exploiting all possible levels and distributing both computation and memory. It allows to increase the number of distributed processes and could not be achieved without a strong restructuring of the code. The core algorithm used to solve the eigen problem (``Locally Optimal Blocked Congugate Gradient''), a Blocked-Davidson-like algorithm, is based on a distribution of processes combining plane-waves and bands. In addition to the distributed memory parallelization, a full hybrid scheme has been implemented, using standard shared-memory directives (openMP/openACC) or porting some comsuming code sections to Graphics Processing Units (GPU). As no simple performance model exists, the complexity of use has been increased; the code efficiency strongly depends on the distribution of processes among the numerous levels. ABINIT is able to predict the performances of several process distributions and automatically choose the most favourable one. On the other hand, a big effort has been carried out to analyse the performances of the code on petascale architectures, showing which sections of codes have to be improved; they all are related to Matrix Algebra (diagonalisation, orthogonalisation). The different strategies employed to improve the code scalability will be described. They are based on an exploration of new diagonalization

Useful Solutions for Plane Wave Diffraction by Dielectric Slabs and Wedges

Directory of Open Access Journals (Sweden)

Gianluca Gennarelli

2012-01-01

Full Text Available This work presents an overview of available uniform asymptotic physical optics solutions for evaluating the plane wave diffraction by some canonical geometries of large interest: dielectric slabs and wedges. Such solutions are based on a physical optics approximation of the electric and magnetic equivalent surface currents in the involved scattering integrals. The resulting diffraction coefficients are expressed in terms of the geometrical optics response of the considered structure and the standard transition function of the Uniform Geometrical Theory of Diffraction. Numerical tests and comparisons make evident the effectiveness and reliability of the presented solutions.

Dispersive photonic crystals from the plane wave method

Energy Technology Data Exchange (ETDEWEB)

Guevara-Cabrera, E.; Palomino-Ovando, M.A. [Facultad de Ciencias Físico Matemáticas, Benemérita Universidad Autónoma de Puebla, Apdo. Post. 165, Puebla, Pue. 72000, México (Mexico); Flores-Desirena, B., E-mail: bflores@fcfm.buap.mx [Facultad de Ciencias Físico Matemáticas, Benemérita Universidad Autónoma de Puebla, Apdo. Post. 165, Puebla, Pue. 72000, México (Mexico); Gaspar-Armenta, J.A. [Departamento de Investigación en Física de la Universidad de Sonora Apdo, Post 5-088, Hermosillo Sonora 83190, México (Mexico)

2016-03-01

Nowadays photonic crystals are widely used in many different applications. One of the most used methods to compute their band structure is the plane wave method (PWM). However, it can only be applied directly to non-dispersive media and be extended to systems with a few model dielectric functions. We explore an extension of the PWM to photonic crystals containing dispersive materials, that solves an eigenvalue equation for the Bloch wave vectors. First we compare our calculation with analytical results for one dimensional photonic crystals containing Si using experimental values of its optical parameters, and obtainig very well agreement, even for the spectrum region with strong absorption. Then, using the same method, we computed the band structure for a two dimensional photonic crystal without absorption, formed by an square array of MgO cylinders in air. The optical parameters for MgO were modeled with the Lorentz dielectric function. Finally, we studied an array of MgO cylinders in a metal, using Drude model without absorption, for the metal dielectric function. For this last case, we study the gap–midgap ratio as a function of the filling fraction for both the square and triangular lattice. The gap–midgap ratio is larger for the triangular lattice, with a maximum value of 10% for a filling fraction of 0.6. Our results show that the method can be applied to dispersive materials, and then to a wide range of applications where photonic crystals can be used.

Flow features that arise due to the interaction of a plane shock wave with concave profiles

CSIR Research Space (South Africa)

MacLucas, David A

2012-10-01

Full Text Available The focus of the author's thesis was the aerodynamic flow field that develops as a result of the interaction of a moving plane shock wave with concave profiles. In this presentation, he discusses some of the interesting flow phenomena that arise...

Pseudopotential multi-relaxation-time lattice Boltzmann model for cavitation bubble collapse with high density ratio

International Nuclear Information System (INIS)

Shan Ming-Lei; Zhu Chang-Ping; Yao Cheng; Yin Cheng; Jiang Xiao-Yan

2016-01-01

The dynamics of the cavitation bubble collapse is a fundamental issue for the bubble collapse application and prevention. In the present work, the modified forcing scheme for the pseudopotential multi-relaxation-time lattice Boltzmann model developed by Li Q et al. [Li Q, Luo K H and Li X J 2013 Phys. Rev. E 87 053301] is adopted to develop a cavitation bubble collapse model. In the respects of coexistence curves and Laplace law verification, the improved pseudopotential multi-relaxation-time lattice Boltzmann model is investigated. It is found that the thermodynamic consistency and surface tension are independent of kinematic viscosity. By homogeneous and heterogeneous cavitation simulation, the ability of the present model to describe the cavitation bubble development as well as the cavitation inception is verified. The bubble collapse between two parallel walls is simulated. The dynamic process of a collapsing bubble is consistent with the results from experiments and simulations by other numerical methods. It is demonstrated that the present pseudopotential multi-relaxation-time lattice Boltzmann model is applicable and efficient, and the lattice Boltzmann method is an alternative tool for collapsing bubble modeling. (paper)

Projector Augmented-Wave formulation of response to strain and electric field perturbation within the density-functional perturbation theory

Science.gov (United States)

Martin, Alexandre; Torrent, Marc; Caracas, Razvan

2015-03-01

A formulation of the response of a system to strain and electric field perturbations in the pseudopotential-based density functional perturbation theory (DFPT) has been proposed by D.R Hamman and co-workers. It uses an elegant formalism based on the expression of DFT total energy in reduced coordinates, the key quantity being the metric tensor and its first and second derivatives. We propose to extend this formulation to the Projector Augmented-Wave approach (PAW). In this context, we express the full elastic tensor including the clamped-atom tensor, the atomic-relaxation contributions (internal stresses) and the response to electric field change (piezoelectric tensor and effective charges). With this we are able to compute the elastic tensor for all materials (metals and insulators) within a fully analytical formulation. The comparison with finite differences calculations on simple systems shows an excellent agreement. This formalism has been implemented in the plane-wave based DFT ABINIT code. We apply it to the computation of elastic properties and seismic-wave velocities of iron with impurity elements. By analogy with the materials contained in meteorites, tested impurities are light elements (H, O, C, S, Si).

Increased Frame Rate for Plane Wave Imaging Without Loss of Image Quality

DEFF Research Database (Denmark)

Jensen, Jonas; Stuart, Matthias Bo; Jensen, Jørgen Arendt

2015-01-01

Clinical applications of plane wave imaging necessitate the creation of high-quality images with the highest possible frame rate for improved blood flow tracking and anatomical imaging. However, linear array transducers create grating lobe artefacts, which degrade the image quality especially...... in the near field for λ-pitch transducers. Artefacts can only partly be suppressed by increasing the number of emissions, and this paper demonstrates how the frame rate can be increased without loss of image quality by using λ/2-pitch transducers. The number of emissions and steering angles are optimized...

Acoustic radiation force on cylindrical shells in a plane standing wave

International Nuclear Information System (INIS)

Mitri, F G

2005-01-01

In this paper, the radiation force per length resulting from a plane standing wave incident on an infinitely long cylindrical shell is computed. The cases of elastic and viscoelastic shells immersed in ideal (non-viscous) fluids are considered with particular emphasis on their thickness and the content of their interior hollow spaces. Numerical calculations of the radiation force function Y st are performed. The fluid-loading effect on the radiation force function curves is analysed as well. The results show several features quite different when the interior hollow space is changed from air to water. Moreover, the theory developed here is more general since it includes the results on cylinders

On the determination of general plane stress states in orthotropic materials from ultrasonic velocity data in non symmetry planes

International Nuclear Information System (INIS)

Goncalves Filho, Orlando J.A.

2015-01-01

This work reports the progress in the development of a new experimental protocol for plane stress determination in orthotropic materials based on the ultrasonic velocity of bulk waves propagating in non symmetry planes with oblique incidence. The presence of stress-induced deformation introduces an acoustic anisotropy in the material in addition to that defined by its texture. Orthotropic materials under general plane stress states become acoustically monoclic and its orthotropic planes orthogonal to the stress plane become non symmetry planes. The inverse solution of the generalized Christoffel equation for ultrasonic bulk waves propagating in non symmetry planes of anisotropic bodies is known to be numerically unstable. The suggested protocol deals with this numerical instability without recourse to bulk wave propagation in the stress plane as proposed in the literature. Hence, it should be useful for plane stress analysis of thin wall pressure vessels where ultrasonic measurements in the direction of the wall plane are not possible. For the initial validation of the suggested protocol and verification of the stability of the inversion algorithm, computer simulation of stress determination have been performed from synthetic sets of velocity data obtained by the forward solution of the generalized Christoffel equation. Preliminary results for slightly orthotropic aluminium highlight the potential of the suggested protocol. (author)

A numerical method for determining the radial wave motion correction in plane wave couplers

DEFF Research Database (Denmark)

Cutanda Henriquez, Vicente; Barrera Figueroa, Salvador; Torras Rosell, Antoni

2016-01-01

Microphones are used for realising the unit of sound pressure level, the pascal (Pa). Electro-acoustic reciprocity is the preferred method for the absolute determination of the sensitivity. This method can be applied in different sound fields: uniform pressure, free field or diffuse field. Pressure...... solution is an analytical expression that estimates the difference between the ideal plane wave sound field and a more complex lossless sound field created by a non-planar movement of the microphone’s membranes. Alternatively, a correction may be calculated numerically by introducing a full model...... of the microphone-coupler system in a Boundary Element formulation. In order to obtain a realistic representation of the sound field, viscous losses must be introduced in the model. This paper presents such a model, and the results of the simulations for different combinations of microphones and couplers...

Efficient evaluation of Coulomb integrals in a mixed Gaussian and plane-wave basis

Czech Academy of Sciences Publication Activity Database

Čársky, Petr

2007-01-01

Roč. 107, č. 1 (2007), s. 56-62 ISSN 0020-7608 R&D Projects: GA AV ČR IAA100400501; GA AV ČR 1ET400400413 Grant - others:European Science Foundation (EIPAM)(XE) PESC7-20; U.S. National Science Foundation(US) OISE-0532040 Institutional research plan: CEZ:AV0Z40400503 Keywords : two- electron integrals * mixed plane-wave and Gaussian basis sets * Coulomb integrals Subject RIV: CF - Physical ; The oretical Chemistry Impact factor: 1.368, year: 2007

Relativistic pseudopotential model for superheavy elements: applications to chemistry of eka-Hg and eka-Pb

Energy Technology Data Exchange (ETDEWEB)

Zaitsevskii, Andrei V [Institute of Hydrogen Energetics and Plasma Technologies, Russian Research Centre ' Kurchatov Institute' (Russian Federation); Wuellen, C van [Technische Universitaet Kaiserslautern (Germany); Titov, A V [B P Konstantinov Petersburg Nuclear Physics Institute, Russian Academy of Sciences (Russian Federation)

2009-12-31

Relativistic pseudopotential approach to the electronic structure simulation of superheavy elements (SHE) compounds is presented. Advanced formulations of this approach leaving both valence and outer-core electronic shells for explicit treatment give rise to simple and efficient computational techniques ensuring highly accurate description of most chemical properties of SHE. At present, the errors due to the use of approximate methods for solving the correlation problem for a subsystem of valence electrons are much larger than those stemming from the pseudopotential approximation itself. Recent applications to the studies of the chemistry of elements 112 (eka-Hg) and 114 (eka-Pb) are reviewed; properties of these elements and their lighter homologues, Hg and Pb, are compared.

Positron-acoustic waves in an electron-positron plasma with an electron beam

International Nuclear Information System (INIS)

Nejoh, Y.N.

1996-01-01

The nonlinear wave structures of large-amplitude positron-acoustic waves are studied in an electron-positron plasma in the presence of an electron beam with finite temperature and hot electrons and positrons. The region where positron-acoustic waves exist is presented by analysing the structure of the pseudopotential. The region depends sensitively on the positron density, the positron temperature and the electron beam temperature. It is shown that the maximum amplitude of the wave decreases as the positron temperature increases, and the region of positron-acoustic waves spreads as the positron temperature increases. 11 refs., 5 figs

Cylindrical and spherical space equivalents to the plane wave expansion technique of Maxwell's wave equations

Science.gov (United States)

Gauthier, Robert C.; Alzahrani, Mohammed A.; Jafari, Seyed Hamed

2015-02-01

The plane wave expansion (PWM) technique applied to Maxwell's wave equations provides researchers with a supply of information regarding the optical properties of dielectric structures. The technique is well suited for structures that display a linear periodicity. When the focus is directed towards optical resonators and structures that lack linear periodicity the eigen-process can easily exceed computational resources and time constraints. In the case of dielectric structures which display cylindrical or spherical symmetry, a coordinate system specific set of basis functions have been employed to cast Maxwell's wave equations into an eigen-matrix formulation from which the resonator states associated with the dielectric profile can be obtained. As for PWM, the inverse of the dielectric and field components are expanded in the basis functions (Fourier-Fourier-Bessel, FFB, in cylindrical and Fourier- Bessel-Legendre, BLF, in spherical) and orthogonality is employed to form the matrix expressions. The theoretical development details will be presented indicating how certain mathematical complications in the process have been overcome and how the eigen-matrix can be tuned to a specific mode type. The similarities and differences in PWM, FFB and BLF are presented. In the case of structures possessing axial cylindrical symmetry, the inclusion of the z axis component of propagation constant makes the technique applicable to photonic crystal fibers and other waveguide structures. Computational results will be presented for a number of different dielectric geometries including Bragg ring resonators, cylindrical space slot channel waveguides and bottle resonators. Steps to further enhance the computation process will be reported.

Shape optimization of solid-air porous phononic crystal slabs with widest full 3D bandgap for in-plane acoustic waves

Science.gov (United States)

D'Alessandro, Luca; Bahr, Bichoy; Daniel, Luca; Weinstein, Dana; Ardito, Raffaele

2017-09-01

The use of Phononic Crystals (PnCs) as smart materials in structures and microstructures is growing due to their tunable dynamical properties and to the wide range of possible applications. PnCs are periodic structures that exhibit elastic wave scattering for a certain band of frequencies (called bandgap), depending on the geometric and material properties of the fundamental unit cell of the crystal. PnCs slabs can be represented by plane-extruded structures composed of a single material with periodic perforations. Such a configuration is very interesting, especially in Micro Electro-Mechanical Systems industry, due to the easy fabrication procedure. A lot of topologies can be found in the literature for PnCs with square-symmetric unit cell that exhibit complete 2D bandgaps; however, due to the application demand, it is desirable to find the best topologies in order to guarantee full bandgaps referred to in-plane wave propagation in the complete 3D structure. In this work, by means of a novel and fast implementation of the Bidirectional Evolutionary Structural Optimization technique, shape optimization is conducted on the hole shape obtaining several topologies, also with non-square-symmetric unit cell, endowed with complete 3D full bandgaps for in-plane waves. Model order reduction technique is adopted to reduce the computational time in the wave dispersion analysis. The 3D features of the PnC unit cell endowed with the widest full bandgap are then completely analyzed, paying attention to engineering design issues.

Necessary conditions for the initiation and propagation of nuclear-detonation waves in plane atmospheres

International Nuclear Information System (INIS)

Weaver, T.A.; Wood, L.

1979-01-01

The basic conditions for the initiation of a nuclear-detonation wave in an atmosphere having plane symmetry (e.g., a thin, layered fluid envelope on a planet or star) are developed. Two classes of such a detonation are identified: those in which the temperature of the plasma is comparable to that of the electromagnetic radiation permeating it, and those in which the temperature of the plasma is much higher. Necessary conditions are developed for the propagation of such detonation waves for an arbitrarily great distance. The contribution of fusion chain reactions to these processes is evaluated. By means of these considerations, it is shown that neither the atmosphere nor oceans of the Earth may be made to undergo propagating nuclear detonation under any circumstances

Electro-acoustic solitary waves in dusty plasmas

International Nuclear Information System (INIS)

Mamun, A.A.; Sayed, F.

2005-10-01

present a rigorous theoretical investigation of electro- acoustic [particularly, dust-ion acoustic (DIA) and dust-acoustic (DA)] solitary waves in dusty plasmas. We employ the reductive perturbation method for small but finite amplitude solitary waves as well as the pseudo-potential approach for arbitrary amplitude ones. We also analyze the effects of non-planar geometry and dust charge fluctuations on both DIA and DA solitary waves, the effect of finite ion-temperature on DIA solitary waves, and the effects of dust-fluid temperature and non-isothermal ion distributions on DA solitary waves. It has been reported that these effects do not only significantly modify the basic features of DIA or DA solitary waves, but also introduce some important new features. The basic features and the underlying physics of DIA and DA solitary waves, which are relevant to space and laboratory dusty plasmas, are briefly discussed. (author)

Photonic antenna enhanced middle wave and longwave infrared focal plane array with low noise and high operating temperature, Phase II

Data.gov (United States)

National Aeronautics and Space Administration — Photodetectors and focal plane arrays (FPAs) covering the middle-wave and longwave infrared (MWIR/LWIR) are of great importance in numerous NASA applications,...

Validation of the k-filtering technique for a signal composed of random-phase plane waves and non-random coherent structures

Directory of Open Access Journals (Sweden)

O. W. Roberts

2014-12-01

Full Text Available Recent observations of astrophysical magnetic fields have shown the presence of fluctuations being wave-like (propagating in the plasma frame and those described as being structure-like (advected by the plasma bulk velocity. Typically with single-spacecraft missions it is impossible to differentiate between these two fluctuations, due to the inherent spatio-temporal ambiguity associated with a single point measurement. However missions such as Cluster which contain multiple spacecraft have allowed for temporal and spatial changes to be resolved, using techniques such as k filtering. While this technique does not assume Taylor's hypothesis it requires both weak stationarity of the time series and that the fluctuations can be described by a superposition of plane waves with random phases. In this paper we test whether the method can cope with a synthetic signal which is composed of a combination of non-random-phase coherent structures with a mean radius d and a mean separation λ, as well as plane waves with random phase.

The effect of sources on horizons that may develop when plane gravitational waves collide

International Nuclear Information System (INIS)

Chandrasekhar, Subrahmanyan; Xanthopoulos, B.C.

1987-01-01

Colliding plane gravitational waves that lead to the development of a horizon and a subsequent time-like singularity are coupled with an electromagnetic field, a perfect fluid, and null dust (consisting of massless particles). The coupling of the gravitational waves with an electromagnetic field does not affect, in any essential way, the development of the horizon or the time-like singularity if the polarizations of the colliding gravitational waves are not parallel. If the polarizations are parallel, the space-like singularity which occurs in the vacuum is transformed into a horizon followed by a three-dimensional time-like singularity by the merest presence of the electromagnetic field. The coupling of the gravitational waves with a perfect fluid and null dust affect the development of horizons and singularities in radically different ways: the perfect fluid affects the development decisively in all cases but qualitatively in the same way, while null dust prevents the development of horizons and allows only the development of space-like singularities. The contrasting behaviours of a perfect fluid and of null dust in the framework of general relativity is compared with the behaviours one may expect, under similar circumstances, in the framework of special relativity. (author)

Connection between in-plane upper critical field Hc 2 and gap symmetry in layered d -wave superconductors

Science.gov (United States)

Wang, Jing-Rong; Liu, Guo-Zhu; Zhang, Chang-Jin

2016-07-01

Angle-resolved upper critical field Hc 2 provides an efficient tool to probe the gap symmetry of unconventional superconductors. We revisit the behavior of in-plane Hc 2 in d -wave superconductors by considering both the orbital effect and Pauli paramagnetic effect. After carrying out systematic analysis, we show that the maxima of Hc 2 could be along either nodal or antinodal directions of a d -wave superconducting gap, depending on the specific values of a number of tuning parameters. This behavior is in contrast to the common belief that the maxima of in-plane Hc 2 are along the direction where the superconducting gap takes its maximal value. Therefore, identifying the precise d -wave gap symmetry through fitting experiments results of angle-resolved Hc 2 with model calculations at a fixed temperature, as widely used in previous studies, is difficult and practically unreliable. However, our extensive analysis of angle-resolved Hc 2 show that there is a critical temperature T*: in-plane Hc 2 exhibits its maxima along nodal directions at T change as other parameters vary, but the existence of π /4 shift of Hc 2 at T* appears to be a general feature. Thus a better method to identify the precise d -wave gap symmetry is to measure Hc 2 at a number of different temperatures, and examine whether there is a π /4 shift in its angular dependence at certain T*. We further show that Landau level mixing does not change this general feature. However, in the presence of Fulde-Ferrell-Larkin-Ovchinnikov state, the angular dependence of Hc 2 becomes quite complicated, which makes it more difficult to determine the gap symmetry by measuring Hc 2. Our results indicate that some previous studies on the gap symmetry of CeCu2Si2 are unreliable and need to be reexamined, and also provide a candidate solution to an experimental discrepancy in the angle-resolved Hc 2 in CeCoIn5.

Correction of the near threshold behavior of electron collisional excitation cross-sections in the plane-wave Born approximation

Science.gov (United States)

Kilcrease, D. P.; Brookes, S.

2013-12-01

The modeling of NLTE plasmas requires the solution of population rate equations to determine the populations of the various atomic levels relevant to a particular problem. The equations require many cross sections for excitation, de-excitation, ionization and recombination. A simple and computational fast way to calculate electron collisional excitation cross-sections for ions is by using the plane-wave Born approximation. This is essentially a high-energy approximation and the cross section suffers from the unphysical problem of going to zero near threshold. Various remedies for this problem have been employed with varying degrees of success. We present a correction procedure for the Born cross-sections that employs the Elwert-Sommerfeld factor to correct for the use of plane waves instead of Coulomb waves in an attempt to produce a cross-section similar to that from using the more time consuming Coulomb Born approximation. We compare this new approximation with other, often employed correction procedures. We also look at some further modifications to our Born Elwert procedure and its combination with Y.K. Kim's correction of the Coulomb Born approximation for singly charged ions that more accurately approximate convergent close coupling calculations.

C-plane Reconstructions from Sheaf Acquisition for Ultrasound Electrode Vibration Elastography.

Science.gov (United States)

Ingle, Atul; Varghese, Tomy

2014-09-03

This paper presents a novel algorithm for reconstructing and visualizing ablated volumes using radiofrequency ultrasound echo data acquired with the electrode vibration elastography approach. The ablation needle is vibrated using an actuator to generate shear wave pulses that are tracked in the ultrasound image plane at different locations away from the needle. This data is used for reconstructing shear wave velocity maps for each imaging plane. A C-plane reconstruction algorithm is proposed which estimates shear wave velocity values on a collection of transverse planes that are perpendicular to the imaging planes. The algorithm utilizes shear wave velocity maps from different imaging planes that share a common axis of intersection. These C-planes can be used to generate a 3D visualization of the ablated region. Experimental validation of this approach was carried out using data from a tissue mimicking phantom. The shear wave velocity estimates were within 20% of those obtained from a clinical scanner, and a contrast of over 4 dB was obtained between the stiff and soft regions of the phantom.

Electrical resistivity of noble-metal alloys: Roles of pseudopotential refinements

International Nuclear Information System (INIS)

Mujibar Rahman, S.M.

1983-08-01

The electrical resistivity of liquid noble-metal alloys i.e. CuAu and AgAu is calculated as a function of concentration. The calculations employ transition-metal-pseudopotentials that include nonlocal effects, hybridization and corrections due to orthogonalization hole and use the hard-sphere structure factors; the optimal values of the hard-sphere diameters are being determined by variational calculations. The calculated resistivities are comparable to the experimental values and to the available theoretical results. (author)

The Fermionic Signature Operator and Hadamard States in the Presence of a Plane Electromagnetic Wave

Science.gov (United States)

Finster, Felix; Reintjes, Moritz

2017-05-01

We give a non-perturbative construction of a distinguished state for the quantized Dirac field in Minkowski space in the presence of a time-dependent external field of the form of a plane electromagnetic wave. By explicit computation of the fermionic signature operator, it is shown that the Dirac operator has the strong mass oscillation property. We prove that the resulting fermionic projector state is a Hadamard state.

Perturbation theory for the Bethe-Salpeter equation in the field of a plane electromagnetic wave

International Nuclear Information System (INIS)

Starostin, V.S.; Litskevich, I.K.

1990-01-01

The completeness and orthogonality of the solutions of the Bethe-Salpeter equation is proven. A correct derivation of perturbation-theory equations is given. A generalization that includes the field of a plane electromagnetic wave is proposed. The rate of one-photon annihilation of positronium in this field is calculated. If the one-photon decay is allowed, the stationary states of the system are found (states of light-positronium)

Spin-wave logic devices based on isotropic forward volume magnetostatic waves

International Nuclear Information System (INIS)

Klingler, S.; Pirro, P.; Brächer, T.; Leven, B.; Hillebrands, B.; Chumak, A. V.

2015-01-01

We propose the utilization of isotropic forward volume magnetostatic spin waves in modern wave-based logic devices and suggest a concrete design for a spin-wave majority gate operating with these waves. We demonstrate by numerical simulations that the proposed out-of-plane magnetized majority gate overcomes the limitations of anisotropic in-plane magnetized majority gates due to the high spin-wave transmission through the gate, which enables a reduced energy consumption of these devices. Moreover, the functionality of the out-of-plane majority gate is increased due to the lack of parasitic generation of short-wavelength exchange spin waves

Spin-wave logic devices based on isotropic forward volume magnetostatic waves

Energy Technology Data Exchange (ETDEWEB)

Klingler, S., E-mail: stefan.klingler@wmi.badw-muenchen.de; Pirro, P.; Brächer, T.; Leven, B.; Hillebrands, B.; Chumak, A. V. [Fachbereich Physik and Landesforschungszentrum OPTIMAS, Technische Universität Kaiserslautern, 67663 Kaiserslautern (Germany)

2015-05-25

We propose the utilization of isotropic forward volume magnetostatic spin waves in modern wave-based logic devices and suggest a concrete design for a spin-wave majority gate operating with these waves. We demonstrate by numerical simulations that the proposed out-of-plane magnetized majority gate overcomes the limitations of anisotropic in-plane magnetized majority gates due to the high spin-wave transmission through the gate, which enables a reduced energy consumption of these devices. Moreover, the functionality of the out-of-plane majority gate is increased due to the lack of parasitic generation of short-wavelength exchange spin waves.

Plane-wave diffraction by periodic structures with artificial anisotropic dielectrics

International Nuclear Information System (INIS)

Kazerooni, Azadeh Semsar; Shahabadi, Mahmoud

2010-01-01

Periodic structures with artificial anisotropic dielectrics are studied. The artificial anisotropic dielectric material in this work is made of two alternating isotropic dielectric layers. By a proper choice of the dielectric constant of the layers, we can realize a uniaxial anisotropic medium with controllable anisotropy. The artificial anisotropic dielectric is then used in periodic structures. For these structures, the optical axis of the artificial dielectric is assumed to be parallel or perpendicular to the period of the structure. Diffraction of plane waves by these structures is analyzed by a fully vectorial rigorous matrix method based on a generalized transmission line (TL) formulation. The propagation constants and field distributions are computed and diffraction properties of such structures are studied to show that, by a proper choice of structural parameters, these periodic structures with artificial anisotropic dielectrics can be used as polarizers or polarizing mirrors

A semi-analytical approach towards plane wave analysis of local resonance metamaterials using a multiscale enriched continuum description

NARCIS (Netherlands)

Sridhar, A.; Kouznetsova, V.; Geers, M.G.D.

2017-01-01

This work presents a novel multiscale semi-analytical technique for the acoustic plane wave analysis of (negative) dynamic mass density type local resonance metamaterials with complex micro-structural geometry. A two step solution strategy is adopted, in which the unit cell problem at the

Propagation of plane waves at the interface of an elastic solid half-space and a microstretch thermoelastic diffusion solid half-space

Directory of Open Access Journals (Sweden)

Rajneesh Kumar

Full Text Available The problem of reflection and refraction phenomenon due to plane waves incident obliquely at a plane interface between uniform elastic solid half-space and microstretch thermoelastic diffusion solid half-space has been studied. It is found that the amplitude ratios of various reflected and refracted waves are functions of angle of incidence, frequency of incident wave and are influenced by the microstretch thermoelastic diffusion properties of the media. The expressions of amplitude ratios and energy ratios are obtained in closed form. The energy ratios have been computed numerically for a particular model. The variations of energy ratios with angle of incidence are shown for thermoelastic diffusion media in the context of Lord-Shulman (L-S (1967 and Green-Lindsay (G-L (1972 theories. The conservation of energy at the interface is verified. Some particular cases are also deduced from the present investigation.

Dirac electron in a chiral space-time crystal created by counterpropagating circularly polarized plane electromagnetic waves

Science.gov (United States)

Borzdov, G. N.

2017-10-01

The family of solutions to the Dirac equation for an electron moving in an electromagnetic lattice with the chiral structure created by counterpropagating circularly polarized plane electromagnetic waves is obtained. At any nonzero quasimomentum, the dispersion equation has two solutions which specify bispinor wave functions describing electron states with different energies and mean values of momentum and spin operators. The inversion of the quasimomentum results in two other linearly independent solutions. These four basic wave functions are uniquely defined by eight complex scalar functions (structural functions), which serve as convenient building blocks of the relations describing the electron properties. These properties are illustrated in graphical form over a wide range of quasimomenta. The superpositions of two basic wave functions describing different spin states and corresponding to (i) the same quasimomentum (unidirectional electron states with the spin precession) and (ii) the two equal-in-magnitude but oppositely directed quasimomenta (bidirectional electron states) are also treated.

Wave packet study of the secondary emission of negatively charged, monoatomic ions from sputtered metals

Energy Technology Data Exchange (ETDEWEB)

Sindona, A. [Dipartimento di Fisica, Universita della Calabria, Via P. Bucci 31C, 87036 Rende (Italy) and Istituto Nazionale di Fisica Nucleare (INFN), Gruppo collegato di Cosenza, Via P. Bucci 31C, 87036 Rende (Italy)]. E-mail: sindona@fis.unical.it; Riccardi, P. [Dipartimento di Fisica, Universita della Calabria, Via P. Bucci 31C, 87036 Rende (Italy); Istituto Nazionale di Fisica Nucleare (INFN), Gruppo collegato di Cosenza, Via P. Bucci 31C, 87036 Rende (Italy); Maletta, S. [Dipartimento di Fisica, Universita della Calabria, Via P. Bucci 31C, 87036 Rende (Italy); Rudi, S.A. [Dipartimento di Fisica, Universita della Calabria, Via P. Bucci 31C, 87036 Rende (Italy); Istituto Nazionale di Fisica Nucleare (INFN), Gruppo collegato di Cosenza, Via P. Bucci 31C, 87036 Rende (Italy); Falcone, G. [Dipartimento di Fisica, Universita della Calabria, Via P. Bucci 31C, 87036 Rende (Italy); Istituto Nazionale di Fisica Nucleare (INFN), Gruppo collegato di Cosenza, Via P. Bucci 31C, 87036 Rende (Italy)

2007-05-15

Secondary emission of Ag{sup -} and Au{sup -} particles, following the sputtering of clean Ag(1 0 0) and Au(1 0 0) targets, respectively, is studied with a Crank-Nicholson wave-packet propagation method. A one-electron pseudo-potential is used to describe the plane metal surface, with a projected band gap, the ejected ion, whose charge state is investigated, and its nearest-neighbor substrate ion, put in motion by the collision cascade generated by the primary ion beam. Time-dependent Schroedinger equation is solved backwards in time to determine the evolution of the affinity orbital of the negative particles from an instant when they are unperturbed, at distances of the order of {approx}10{sup 2} a.u. from the surface, to the instant of ejection. The probability that a band electron will be eventually detected in affinity state of the ejected particle is, thus, calculated and compared with the result of another method based on the spectral decomposition of the one-electron Hamiltonian.

Propagation properties of Rossby waves for latitudinal β-plane variations of f and zonal variations of the shallow water speed

Directory of Open Access Journals (Sweden)

C. T. Duba

2012-05-01

Full Text Available Using the shallow water equations for a rotating layer of fluid, the wave and dispersion equations for Rossby waves are developed for the cases of both the standard β-plane approximation for the latitudinal variation of the Coriolis parameter f and a zonal variation of the shallow water speed. It is well known that the wave normal diagram for the standard (mid-latitude Rossby wave on a β-plane is a circle in wave number (ky,kx space, whose centre is displaced −β/2 ω units along the negative kx axis, and whose radius is less than this displacement, which means that phase propagation is entirely westward. This form of anisotropy (arising from the latitudinal y variation of f, combined with the highly dispersive nature of the wave, gives rise to a group velocity diagram which permits eastward as well as westward propagation. It is shown that the group velocity diagram is an ellipse, whose centre is displaced westward, and whose major and minor axes give the maximum westward, eastward and northward (southward group speeds as functions of the frequency and a parameter m which measures the ratio of the low frequency-long wavelength Rossby wave speed to the shallow water speed. We believe these properties of group velocity diagram have not been elucidated in this way before. We present a similar derivation of the wave normal diagram and its associated group velocity curve for the case of a zonal (x variation of the shallow water speed, which may arise when the depth of an ocean varies zonally from a continental shelf.

Phase Plane Analysis Method of Nonlinear Traffic Phenomena

Directory of Open Access Journals (Sweden)

Wenhuan Ai

2015-01-01

Full Text Available A new phase plane analysis method for analyzing the complex nonlinear traffic phenomena is presented in this paper. This method makes use of variable substitution to transform a traditional traffic flow model into a new model which is suitable for the analysis in phase plane. According to the new model, various traffic phenomena, such as the well-known shock waves, rarefaction waves, and stop-and-go waves, are analyzed in the phase plane. From the phase plane diagrams, we can see the relationship between traffic jams and system instability. So the problem of traffic flow could be converted into that of system stability. The results show that the traffic phenomena described by the new method is consistent with that described by traditional methods. Moreover, the phase plane analysis highlights the unstable traffic phenomena we are chiefly concerned about and describes the variation of density or velocity with time or sections more clearly.

Controlling the position of a stabilized detonation wave in a supersonic gas mixture flow in a plane channel

Science.gov (United States)

Levin, V. A.; Zhuravskaya, T. A.

2017-03-01

Stabilization of a detonation wave in a stoichiometric hydrogen-air mixture flowing at a supersonic velocity into a plane symmetric channel with constriction has been studied in the framework of a detailed kinetic mechanism of the chemical interaction. Conditions ensuring the formation of a thrust-producing f low with a stabilized detonation wave in the channel are determined. The inf luence of the inf low Mach number, dustiness of the combustible gas mixture supplied to the channel, and output cross-section size on the position of a stabilized detonation wave in the f low has been analyzed with a view to increasing the efficiency of detonation combustion of the gas mixture. It is established that thrust-producing flow with a stabilized detonation wave can be formed in the channel without any energy consumption.

First-principles calculations of the elastic constants of the cubic, orthorhombic and hexagonal phases of BaF{sub 2}

Energy Technology Data Exchange (ETDEWEB)

Nyawere, P.W.O., E-mail: otienop98@yahoo.ca [Computational Materials Science Group, Department of Physics, University of Eldoret, P.O. Box 1125-30100 Eldoret (Kenya); Department of Computing, Kabarak University, P.O. - Private Bag - 20157 Kabarak (Kenya); The Abdus Salam International Centre for Theoretical Physics, Trieste (Italy); Makau, N.W., E-mail: wanimak@yahoo.com [Computational Materials Science Group, Department of Physics, University of Eldoret, P.O. Box 1125-30100 Eldoret (Kenya); Amolo, G.O., E-mail: georgeamolo862@gmail.com [Computational Materials Science Group, Department of Physics, University of Eldoret, P.O. Box 1125-30100 Eldoret (Kenya)

2014-02-01

All the elastic constants of cubic, orthorhombic and hexagonal phases of BaF{sub 2} have been calculated using first principles methods. We have employed density-functional theory within generalized gradient approximation (GGA) using a plane-wave pseudopotentials method and a plane-wave basis set. The calculated elastic constant values for a cubic phase compare well with recent theoretical and experimental calculations. The bulk modulus derived from the elastic constant calculations of orthorhombic phase of BaF{sub 2} is 94.5 GPa and those of hexagonal phase is 161 GPa. These values are in good agreement with experimental data available. Stability of these phases of BaF{sub 2} is also estimated in different crystallographic directions.

Theoretical x-ray absorption investigation of high pressure ice and compressed graphite

International Nuclear Information System (INIS)

Shaw, Dawn M; Tse, John S

2007-01-01

The x-ray absorption spectra (XAS) of high pressure ices II, VIII, and IX have been computed with the Car-Parrinello plane wave pseudopotential method. XAS for the intermediate structures obtained from uniaxial compression of hexagonal graphite along the c-axis are also studied. Whenever possible, comparisons to available experimental results are made. The reliability of the computational methods for the XAS for these structures is discussed

Eliminating cubic terms in the pseudopotential lattice Boltzmann model for multiphase flow

Science.gov (United States)

Huang, Rongzong; Wu, Huiying; Adams, Nikolaus A.

2018-05-01

It is well recognized that there exist additional cubic terms of velocity in the lattice Boltzmann (LB) model based on the standard lattice. In this work, elimination of these cubic terms in the pseudopotential LB model for multiphase flow is investigated, where the force term and density gradient are considered. By retaining high-order (≥3 ) Hermite terms in the equilibrium distribution function and the discrete force term, as well as introducing correction terms in the LB equation, the additional cubic terms of velocity are entirely eliminated. With this technique, the computational simplicity of the pseudopotential LB model is well maintained. Numerical tests, including stationary and moving flat and circular interface problems, are carried out to show the effects of such cubic terms on the simulation of multiphase flow. It is found that the elimination of additional cubic terms is beneficial to reduce the numerical error, especially when the velocity is relatively large. Numerical results also suggest that these cubic terms mainly take effect in the interfacial region and that the density-gradient-related cubic terms are more important than the other cubic terms for multiphase flow.

Spin effects in nonlinear Compton scattering in a plane-wave laser pulse

International Nuclear Information System (INIS)

Boca, Madalina; Dinu, Victor; Florescu, Viorica

2012-01-01

We study theoretically the electron angular and energy distribution in the non-linear Compton effect in a finite plane-wave laser pulse. We first present analytical and numerical results for unpolarized electrons (described by a Volkov solution of the Dirac equation), in comparison with those corresponding to a spinless particle (obeying the Klein–Gordon equation). Then, in the spin 1/2 case, we include results for the spin flip probability. The regime in which the spin effects are negligible, i.e. the results for the unpolarized spin 1/2 particle coincide practically with those for the spinless particle, is the same as the regime in which the emitted radiation is well described by classical electrodynamics.

Planar plane-wave matrix theory at the four loop order: integrability without BMN scaling

International Nuclear Information System (INIS)

Fischbacher, Thomas; Klose, Thomas; Plefka, Jan

2005-01-01

We study SU(N) plane-wave matrix theory up to fourth perturbative order in its large N planar limit. The effective hamiltonian in the closed su(2) subsector of the model is explicitly computed through a specially tailored computer program to perform large scale distributed symbolic algebra and generation of planar graphs. The number of graphs here was in the deep billions. The outcome of our computation establishes the four-loop integrability of the planar plane-wave matrix model. To elucidate the integrable structure we apply the recent technology of the perturbative asymptotic Bethe ansatz to our model. The resulting S-matrix turns out to be structurally similar but nevertheless distinct to the so far considered long-range spin-chain S-matrices of Inozemtsev, Beisert-Dippel-Staudacher and Arutyunov-Frolov-Staudacher in the AdS/CFT context. In particular our result displays a breakdown of BMN scaling at the four-loop order. That is, while there exists an appropriate identification of the matrix theory mass parameter with the coupling constant of the N=4 superconformal Yang-Mills theory which yields an eighth order lattice derivative for well separated impurities (naively implying BMN scaling) the detailed impurity contact interactions ruin this scaling property at the four-loop order. Moreover we study the issue of 'wrapping' interactions, which show up for the first time at this loop-order through a Konishi descendant length four operator. (author)

Excited state nuclear forces from the Tamm-Dancoff approximation to time-dependent density functional theory within the plane wave basis set framework

Science.gov (United States)

Hutter, Jürg

2003-03-01

An efficient formulation of time-dependent linear response density functional theory for the use within the plane wave basis set framework is presented. The method avoids the transformation of the Kohn-Sham matrix into the canonical basis and references virtual orbitals only through a projection operator. Using a Lagrangian formulation nuclear derivatives of excited state energies within the Tamm-Dancoff approximation are derived. The algorithms were implemented into a pseudo potential/plane wave code and applied to the calculation of adiabatic excitation energies, optimized geometries and vibrational frequencies of three low lying states of formaldehyde. An overall good agreement with other time-dependent density functional calculations, multireference configuration interaction calculations and experimental data was found.

In-plane confinement and waveguiding of surface acoustic waves through line defects in pillars-based phononic crystal

Directory of Open Access Journals (Sweden)

Abdelkrim Khelif

2011-12-01

Full Text Available We present a theoretical analysis of an in-plane confinement and a waveguiding of surface acoustic waves in pillars-based phononic crystal. The artificial crystal is made up of cylindrical pillars placed on a semi-infinite medium and arranged in a square array. With a well-chosen of the geometrical parameters, this pillars-based system can display two kinds of complete band gaps for guided waves propagating near the surface, a low frequency gap based on locally resonant mode of pillars as well as a higher frequency gap appearing at Bragg scattering regime. In addition, we demonstrate a waveguiding of surface acoustic wave inside an extended linear defect created by removing rows of pillars in the perfect crystal. We discuss the transmission and the polarization of such confined mode appearing in the higher frequency band gap. We highlight the strong similarity of such defect mode and the Rayleigh wave of free surface medium. An efficient finite element analysis is used to simulate the propagation of guided waves through silicon pillars on a silicon substrate.

Simulation of angle-resolved photoemission spectra by approximating the final state by a plane wave: From graphene to polycyclic aromatic hydrocarbon molecules

Energy Technology Data Exchange (ETDEWEB)

Puschnig, Peter, E-mail: peter.puschnig@uni-graz.at; Lüftner, Daniel

2015-04-15

Highlights: • Computational study on angular dependent photoemission spectroscopy. • Graphene and polycyclic aromatic hydrocarbon molecules. • Plane wave final state approximation accounts for experimental findings. - Abstract: We present a computational study on the angular-resolved photoemission spectra (ARPES) from a number of polycyclic aromatic hydrocarbons and graphene. Our theoretical approach is based on ab-initio density functional theory and the one-step model where we greatly simplify the evaluation of the matrix element by assuming a plane wave for the final state. Before comparing our ARPES simulations with available experimental data, we discuss how typical approximations for the exchange-correlation energy affect orbital energies. In particular, we show that by employing a hybrid functional, considerable improvement can be obtained over semi-local functionals in terms of band widths and relative energies of π and σ states. Our ARPES simulations for graphene show that the plane wave final state approximation provides indeed an excellent description when compared to experimental band maps and constant binding energy maps. Furthermore, our ARPES simulations for a number of polycyclic aromatic molecules from the oligo-acene, oligo-phenylene, phen-anthrene families as well as for disc-shaped molecules nicely illustrate the evolution of the electronic structure from molecules with increasing size towards graphene.

Stability of the Superconducting d-Wave Pairing Toward the Intersite Coulomb Repulsion in CuO_2 Plane

Science.gov (United States)

Val'kov, V. V.; Dzebisashvili, D. M.; Korovushkin, M. M.; Barabanov, A. F.

2018-06-01

Taking into account the real crystalline structure of the CuO_2 plane and the strong spin-fermion coupling, we study the influence of the intersite Coulomb repulsion between holes on the Cooper instability of the spin-polaron quasiparticles in cuprate superconductors. The analysis shows that only the superconducting d-wave pairing is implemented in the whole region of doping, whereas the solutions of the self-consistent equations for the s-wave pairing are absent. It is shown that intersite Coulomb interaction V_1 between the holes located at the nearest oxygen ions does not affect the d-wave pairing, because its Fourier transform V_q vanishes in the kernel of the corresponding integral equation. The intersite Coulomb interaction V_2 of quasiparticles located at the next-nearest oxygen ions does not vanish in the integral equations, however, but it is also shown that the d-wave pairing is robust toward this interaction for physically reasonable values of V_2.

Observation of large-amplitude ion acoustic solitary waves in a plasma

International Nuclear Information System (INIS)

Nakamura, Yoshiharu

1987-01-01

Propagation of nonlinear ion acoustic waves in a multi-component plasma with negative ions is investigated in a double-plasma device. When the density of negative ions is larger than a critical value, a broad negative pulse evolves to rarefactive solitons, and a positive pulse whose amplitude is less than a certain threshold value becomes a subsonic wave train. In the same plasma, a positive pulse whose amplitude is larger than the threshold develops into a solitary wave. The critical amplitude is measured as a function of the density of negative ions and compared with predictions of the pseudo-potential method. The energy distribution of electrons in the solitary wave is also measured. (author)

FDTD analysis of reflection of electromagnetic wave from a conductive plane covered with inhomogeneous time-varying plasma

International Nuclear Information System (INIS)

Liu Shaobin; Mo Jinjun; Yuan Naichang

2003-01-01

A finite-difference time-domain (FDTD) algorithm is applied to study the electro-magnetic reflection of conduction plane covered with inhomogeneous time-varying plasma, homogeneous plasma and inhomogeneous plasma. The collisions frequency of plasma is a function of electron density and plasma temperature. The number density profile follows a parabolic function. A discussion on the effect of various plasma parameters on the reflection coefficient is presented. Under the one-dimensional case, transient electromagnetic propagation through various plasmas has been obtained, and the reflection coefficients of EM wave through various plasma are calculated under different conditions. The results illustrate that a plasma cloaking system can successfully absorb the incident EM wave

DFT LCAO and plane wave calculations of SrZrO3

International Nuclear Information System (INIS)

Evarestov, R.A.; Bandura, A.V.; Alexandrov, V.E.; Kotomin, E.A.

2005-01-01

The results of the density functional (DFT) LCAO and plane wave (PW) calculations of the electronic and structural properties of four known SrZrO 3 phases (Pm3m, I4/mcm, Cmcm and Pbnm) are presented and discussed. The calculated unit cell energies and relative stability of these phases agree well with the experimental sequence of SrZrO 3 phases as the temperature increases. The lattice structure parameters optimized in the PW calculations for all four phases are in good agreement with the experimental neutron diffraction data. The LCAO and PW results for the electronic structure, density of states and chemical bonding in the cubic phase (Pm3m) are discussed in detail and compared with the results of previous PW calculations. (copyright 2005 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)

Electromagnetic waves in gravitational wave spacetimes

International Nuclear Information System (INIS)

Haney, M.; Bini, D.; Ortolan, A.; Fortini, P.

2013-01-01

We have considered the propagation of electromagnetic waves in a space-time representing an exact gravitational plane wave and calculated the induced changes on the four-potential field Aμ of a plane electromagnetic wave. By choosing a suitable photon round-trip in a Michelson interferometer, we have been able to identify the physical effects of the exact gravitational wave on the electromagnetic field, i.e. phase shift, change of the polarization vector, angular deflection and delay. These results have been exploited to study the response of an interferometric gravitational wave detector beyond the linear approximation of the general theory of relativity. A much more detailed examination of this problem can be found in our paper recently published in Classical and Quantum Gravity (28 (2011) 235007).

Singularities and horizons in the collisions of gravitational waves

International Nuclear Information System (INIS)

Yurtsever, U.H.

1989-01-01

This thesis presents a study of the dynamical, nonlinear interaction of colliding gravitational waves, as described by classical general relativity. In the work on the collisions of exactly-plane waves, it is shown that Killing horizons in any plane-symmetric spacetime are unstable against small plane-symmetric perturbations. It is thus concluded that the Killing-Cauchy horizons produced by the collisions of some exactly plane gravitational waves are nongeneric, and the generic initial data for the colliding plane waves always produce pure spacetime singularities without such horizons. This conclusion is later proved rigorously (using the full nonlinear theory rather than perturbation theory), in connection with an analysis of the asymptotic singularity structure of a general colliding plane-wave spacetime. This analysis also proves that asymptotically the singularities created by colliding plane waves are of inhomogeneous-Kasner type; the asymptotic Kasner axes and exponents of these singularities in general depend on the spatial coordinate that runs tangentially to the singularity in the non-plane-symmetric direction. In the work on collisions of almost-plane gravitational waves, first some general properties of single almost-plane gravitational-wave spacetimes are explored. It is shown that, by contrast with an exact plane wave, an almost-plane gravitational wave cannot have a propagation direction that is Killing; i.e., it must diffract and disperse as it propagates. It is also shown that an almost-plane wave cannot be precisely sandwiched between two null wave-fronts; i.e., it must leave behind tails in the spacetime region through which is passes

Acoustic radiation force on a rigid elliptical cylinder in plane (quasi)standing waves

Science.gov (United States)

Mitri, F. G.

2015-12-01

The acoustic radiation force on a 2D elliptical (non-circular) cylinder centered on the axis of wave propagation of plane quasi-standing and standing waves is derived, based on the partial-wave series expansion (PWSE) method in cylindrical coordinates. A non-dimensional acoustic radiation force function, which is the radiation force per unit length, per characteristic energy density and per unit cross-sectional surface of the ellipse, is defined in terms of the scattering coefficients that are determined by applying the Neumann boundary condition for an immovable surface. A system of linear equations involving a single numerical integration procedure is solved by matrix inversion. Numerical simulations showing the transition from the quasi-standing to the (equi-amplitude) standing wave behaviour are performed with particular emphasis on the aspect ratio a/b, where a and b are the ellipse semi-axes, as well as the dimensionless size parameter kb (where k is the wavenumber), without the restriction to a particular range of frequencies. It is found that at high kb values > 1, the radiation force per length with broadside incidence is larger, whereas the opposite situation occurs in the long-wavelength limit (i.e., kb acoustic levitation of elliptical cylinders, the acoustic stabilization of liquid columns in a host medium, acousto-fluidics devices, and other particle dynamics applications to name a few. Moreover, the formalism presented here may be effectively applied to compute the acoustic radiation force on other 2D surfaces of arbitrary shape such as super-ellipses, Chebyshev cylindrical particles, or other non-circular geometries.

Projecting non-diffracting waves with intermediate-plane holography.

Science.gov (United States)

Mondal, Argha; Yevick, Aaron; Blackburn, Lauren C; Kanellakopoulos, Nikitas; Grier, David G

2018-02-19

We introduce intermediate-plane holography, which substantially improves the ability of holographic trapping systems to project propagation-invariant modes of light using phase-only diffractive optical elements. Translating the mode-forming hologram to an intermediate plane in the optical train can reduce the need to encode amplitude variations in the field, and therefore complements well-established techniques for encoding complex-valued transfer functions into phase-only holograms. Compared to standard holographic trapping implementations, intermediate-plane holograms greatly improve diffraction efficiency and mode purity of propagation-invariant modes, and so increase their useful non-diffracting range. We demonstrate this technique through experimental realizations of accelerating modes and long-range tractor beams.

A singularity extraction technique for computation of antenna aperture fields from singular plane wave spectra

DEFF Research Database (Denmark)

Cappellin, Cecilia; Breinbjerg, Olav; Frandsen, Aksel

2008-01-01

An effective technique for extracting the singularity of plane wave spectra in the computation of antenna aperture fields is proposed. The singular spectrum is first factorized into a product of a finite function and a singular function. The finite function is inverse Fourier transformed...... numerically using the Inverse Fast Fourier Transform, while the singular function is inverse Fourier transformed analytically, using the Weyl-identity, and the two resulting spatial functions are then convolved to produce the antenna aperture field. This article formulates the theory of the singularity...

Large amplitude ion-acoustic waves in a plasma with an electron beam

International Nuclear Information System (INIS)

Nejoh, Y.; Sanuki, H.

1995-01-01

The nonlinear wave structures of large amplitude ion-acoustic waves are studied in a plasma with an electron beam, by the pseudopotential method. The region of the existence of large amplitude ion-acoustic waves is examined, showing that the condition of the existence sensitively depends on the parameters such as the electron beam temperature, the ion temperature, the electrostatic potential, and the concentration of the electron beam density. It turns out that the region of the existence spreads as the beam temperature increases but the effect of the electron beam velocity is relatively small. New findings of large amplitude ion-acoustic waves in a plasma with an electron beam are predicted. copyright 1995 American Institute of Physics

Three-dimensional stability of solitary kinetic Alfven waves and ion-acoustic waves

International Nuclear Information System (INIS)

Ghosh, G.; Das, K.P.

1994-01-01

Starting from a set of equations that lead to a linear dispersion relation coupling kinetic Alfven waves and ion-acoustic waves, three-dimensional KdV equations are derived for these waves. These equations are then used to investigate the three-dimensional stability of solitary kinetic Alfven waves and ion-acoustic waves by the small-k perturbation expansion method of Rowlands and Infeld. For kinetic Alfven waves it is found that there is instability if the direction of the plane-wave perturbation lies inside a cone, and the growth rate of the instability attains a maximum when the direction of the perturbation lies in the plane containing the external magnetic field and the direction of propagation of the solitary wave. For ion-acoustic waves the growth rate of instability attains a maximum when the direction of the perturbation lies in a plane perpendicular to the direction of propagation of the solitary wave. (Author)

Next generation sub-millimeter wave focal plane array coupling concepts: an ESA TRP project to develop multichroic focal plane pixels for future CMB polarization experiments

Science.gov (United States)

Trappe, N.; Bucher, M.; De Bernardis, P.; Delabrouille, J.; Deo, P.; DePetris, M.; Doherty, S.; Ghribi, A.; Gradziel, M.; Kuzmin, L.; Maffei, B.; Mahashabde, S.; Masi, S.; Murphy, J. A.; Noviello, F.; O'Sullivan, C.; Pagano, L.; Piacentini, F.; Piat, M.; Pisano, G.; Robinson, M.; Stompor, R.; Tartari, A.; van der Vorst, M.; Verhoeve, P.

2016-07-01

The main objective of this activity is to develop new focal plane coupling array concepts and technologies that optimise the coupling from reflector optics to the large number of detectors for next generation sub millimetre wave telescopes particularly targeting measurement of the polarization of the cosmic microwave background (CMB). In this 18 month TRP programme the consortium are tasked with developing, manufacturing and experimentally verifying a prototype multichroic pixel which would be suitable for the large focal plane arrays which will be demanded to reach the required sensitivity of future CMB polarization missions. One major development was to have multichroic operation to potentially reduce the required focal plane size of a CMB mission. After research in the optimum telescope design and definition of requirements based on a stringent science case review, a number of compact focal plane architecture concepts were investigated before a pixel demonstrator consisting of a planar mesh lens feeding a backend Resonant Cold Electron Bolometer RCEB for filtering and detection of the dual frequency signal was planned for manufacture and test. In this demonstrator the frequencies of the channels was chosen to be 75 and 105 GHz in the w band close to the peak CMB signal. In the next year the prototype breadboards will be developed to test the beams produced by the manufactured flat lenses fed by a variety of antenna configurations and the spectral response of the RCEBs will also be verified.

Instability of coupled gravity-inertial-Rossby waves on a β-plane in solar system atmospheres

Directory of Open Access Journals (Sweden)

J. F. McKenzie

2009-11-01

Full Text Available This paper provides an analysis of the combined theory of gravity-inertial-Rossby waves on a β-plane in the Boussinesq approximation. The wave equation for the system is fifth order in space and time and demonstrates how gravity-inertial waves on the one hand are coupled to Rossby waves on the other through the combined effects of β, the stratification characterized by the Väisälä-Brunt frequency N, the Coriolis frequency f at a given latitude, and vertical propagation which permits buoyancy modes to interact with westward propagating Rossby waves. The corresponding dispersion equation shows that the frequency of a westward propagating gravity-inertial wave is reduced by the coupling, whereas the frequency of a Rossby wave is increased. If the coupling is sufficiently strong these two modes coalesce giving rise to an instability. The instability condition translates into a curve of critical latitude Θc versus effective equatorial rotational Mach number M, with the region below this curve exhibiting instability. "Supersonic" fast rotators are unstable in a narrow band of latitudes around the equator. For example Θc~12° for Jupiter. On the other hand slow "subsonic" rotators (e.g. Mercury, Venus and the Sun's Corona are unstable at all latitudes except very close to the poles where the β effect vanishes. "Transonic" rotators, such as the Earth and Mars, exhibit instability within latitudes of 34° and 39°, respectively, around the Equator. Similar results pertain to Oceans. In the case of an Earth's Ocean of depth 4km say, purely westward propagating waves are unstable up to 26° about the Equator. The nonlinear evolution of this instability which feeds off rotational energy and gravitational buoyancy may play an important role in atmospheric dynamics.

Coherent quantum states of a relativistic particle in an electromagnetic plane wave and a parallel magnetic field

International Nuclear Information System (INIS)

Colavita, E.; Hacyan, S.

2014-01-01

We analyze the solutions of the Klein–Gordon and Dirac equations describing a charged particle in an electromagnetic plane wave combined with a magnetic field parallel to the direction of propagation of the wave. It is shown that the Klein–Gordon equation admits coherent states as solutions, while the corresponding solutions of the Dirac equation are superpositions of coherent and displaced-number states. Particular attention is paid to the resonant case in which the motion of the particle is unbounded. -- Highlights: •We study a relativistic electron in a particular electromagnetic field configuration. •New exact solutions of the Klein–Gordon and Dirac equations are obtained. •Coherent and displaced number states can describe a relativistic particle

Fourier plane imaging microscopy

Energy Technology Data Exchange (ETDEWEB)

Dominguez, Daniel, E-mail: daniel.dominguez@ttu.edu; Peralta, Luis Grave de [Department of Physics, Texas Tech University, Lubbock, Texas 79409 (United States); Nano Tech Center, Texas Tech University, Lubbock, Texas 79409 (United States); Alharbi, Nouf; Alhusain, Mdhaoui [Department of Physics, Texas Tech University, Lubbock, Texas 79409 (United States); Bernussi, Ayrton A. [Nano Tech Center, Texas Tech University, Lubbock, Texas 79409 (United States); Department of Electrical and Computer Engineering, Texas Tech University, Lubbock, Texas 79409 (United States)

2014-09-14

We show how the image of an unresolved photonic crystal can be reconstructed using a single Fourier plane (FP) image obtained with a second camera that was added to a traditional compound microscope. We discuss how Fourier plane imaging microscopy is an application of a remarkable property of the obtained FP images: they contain more information about the photonic crystals than the images recorded by the camera commonly placed at the real plane of the microscope. We argue that the experimental results support the hypothesis that surface waves, contributing to enhanced resolution abilities, were optically excited in the studied photonic crystals.

An IBEM solution to the scattering of plane SH-waves by a lined tunnel in elastic wedge space

Science.gov (United States)

Liu, Zhongxian; Liu, Lei

2015-02-01

The indirect boundary element method (IBEM) is developed to solve the scattering of plane SH-waves by a lined tunnel in elastic wedge space. According to the theory of single-layer potential, the scattered-wave field can be constructed by applying virtual uniform loads on the surface of lined tunnel and the nearby wedge surface. The densities of virtual loads can be solved by establishing equations through the continuity conditions on the interface and zero-traction conditions on free surfaces. The total wave field is obtained by the superposition of free field and scattered-wave field in elastic wedge space. Numerical results indicate that the IBEM can solve the diffraction of elastic wave in elastic wedge space accurately and efficiently. The wave motion feature strongly depends on the wedge angle, the angle of incidence, incident frequency, the location of lined tunnel, and material parameters. The waves interference and amplification effect around the tunnel in wedge space is more significant, causing the dynamic stress concentration factor on rigid tunnel and the displacement amplitude of flexible tunnel up to 50.0 and 17.0, respectively, more than double that of the case of half-space. Hence, considerable attention should be paid to seismic resistant or anti-explosion design of the tunnel built on a slope or hillside.

Dynamics of plane-symmetric thin walls in general relativity

International Nuclear Information System (INIS)

Wang, A.

1992-01-01

Plane walls (including plane domain walls) without reflection symmetry are studied in the framework of Einstein's general relativity. Using the distribution theory, all the Einstein field equations and Bianchi identities are split into two groups: one holding in the regions outside of the wall and the other holding at the wall. The Einstein field equations at the wall are found to take a very simple form, and given explicitly in terms of the discontinuities of the metric coefficients and their derivatives. The Bianchi identities at the wall are also given explicitly. Using the latter, the interaction of a plane wall with gravitational waves and some specific matter fields is studied. In particular, it is found that, when a gravitational plane wave passes through a wall, if the wall has no reflection symmetry, the phenomena, such as reflection, stimulation, or absorption, in general, occur. It is also found that, unlike for gravitational waves, a massless scalar wave or an electromagnetic wave continuously passes through a wall without any reflection. The repulsion and attraction of a plane wall are also studied. It is found that the acceleration of an observer who is at rest relative to the wall usually consists of three parts: one is due to the force produced by the wall, the second is due to the force produced by the space-time curvature, which is zero if the wall has reflection symmetry, and the last is due to the accelerated motion of the wall. As a result, a repulsive (attractive) plane wall may not be repulsive (attractive) at all. Finally, the collision and interaction among the walls are studied

Temperature elevation in the eye of anatomically based human head models for plane-wave exposures

International Nuclear Information System (INIS)

Hirata, A; Watanabe, S; Fujiwara, O; Kojima, M; Sasaki, K; Shiozawa, T

2007-01-01

This study investigated the temperature elevation in the eye of anatomically based human head models for plane-wave exposures. The finite-difference time-domain method is used for analyzing electromagnetic absorption and temperature elevation. The eyes in the anatomic models have average dimensions and weight. Computational results show that the ratio of maximum temperature in the lens to the eye-average SAR (named 'heating factor for the lens') is almost uniform (0.112-0.147 deg. C kg W -1 ) in the frequency region below 3 GHz. Above 3 GHz, this ratio increases gradually with an increase of frequency, which is attributed to the penetration depth of an electromagnetic wave. Particular attention is paid to the difference in the heating factor for the lens between this study and earlier works. Considering causes clarified in this study, compensated heating factors in all these studies are found to be in good agreement

Relativistic effects on large amplitude nonlinear Langmuir waves in a two-fluid plasma

International Nuclear Information System (INIS)

Nejoh, Yasunori

1994-07-01

Large amplitude relativistic nonlinear Langmuir waves are analyzed by the pseudo-potential method. The existence conditions for nonlinear Langmuir waves are confirmed by considering relativistic high-speed electrons in a two-fluid plasma. The significant feature of this investigation is that the propagation of nonlinear Langmuir waves depends on the ratio of the electron streaming velocity to the velocity of light, the normalized potential and the ion mass to electron mass ratio. The constant energy is determined by the specific range of the relativistic effect. In the non-relativistic limit, large amplitude relativistic Langmuir waves do not exist. The present investigation predicts new findings of large amplitude nonlinear Langmuir waves in space plasma phenomena in which relativistic electrons are important. (author)

Four-dimensional parameter estimation of plane waves using swarming intelligence

International Nuclear Information System (INIS)

Zaman Fawad; Munir Fahad; Khan Zafar Ullah; Qureshi Ijaz Mansoor

2014-01-01

This paper proposes an efficient approach for four-dimensional (4D) parameter estimation of plane waves impinging on a 2-L shape array. The 4D parameters include amplitude, frequency and the two-dimensional (2D) direction of arrival, namely, azimuth and elevation angles. The proposed approach is based on memetic computation, in which the global optimizer, particle swarm optimization is hybridized with a rapid local search technique, pattern search. For this purpose, a new multi-objective fitness function is used. This fitness function is the combination of mean square error and the correlation between the normalized desired and estimated vectors. The proposed hybrid scheme is not only compared with individual performances of particle swarm optimization and pattern search, but also with the performance of the hybrid genetic algorithm and that of the traditional approach. A large number of Monte—Carlo simulations are carried out to validate the performance of the proposed scheme. It gives promising results in terms of estimation accuracy, convergence rate, proximity effect and robustness against noise. (interdisciplinary physics and related areas of science and technology)

Scattering of electromagnetic plane waves by a buried vertical dike

Directory of Open Access Journals (Sweden)

Batista Lurimar S.

2003-01-01

Full Text Available The complete and exact solution of the scattering of a TE mode frequency domain electromagnetic plane wave by a vertical dike under a conductive overburden has been established. An integral representation composed of one-sided Fourier transforms describes the scattered electric field components in each one of the five media: air, overburden, dike, and the country rocks on both sides of the dike. The determination of the terms of the series that represents the spectral components of the Fourier integrals requires the numerical inversion of a sparse matrix, and the method of successive approaches. The zero-order term of the series representation for the spectral components of the overburden, for given values of the electrical and geometrical parameters of the model, has been computed. This result allowed to determine an approximate value of the variation of the electric field on the top of the overburden in the direction perpendicular to the strike of the dike. The results demonstrate the efficiency of this forward electromagnetic modeling, and are fundamental for the interpretation of VLF and Magnetotelluric data.

Acoustic radiation force on a rigid elliptical cylinder in plane (quasi)standing waves

International Nuclear Information System (INIS)

Mitri, F. G.

2015-01-01

The acoustic radiation force on a 2D elliptical (non-circular) cylinder centered on the axis of wave propagation of plane quasi-standing and standing waves is derived, based on the partial-wave series expansion (PWSE) method in cylindrical coordinates. A non-dimensional acoustic radiation force function, which is the radiation force per unit length, per characteristic energy density and per unit cross-sectional surface of the ellipse, is defined in terms of the scattering coefficients that are determined by applying the Neumann boundary condition for an immovable surface. A system of linear equations involving a single numerical integration procedure is solved by matrix inversion. Numerical simulations showing the transition from the quasi-standing to the (equi-amplitude) standing wave behaviour are performed with particular emphasis on the aspect ratio a/b, where a and b are the ellipse semi-axes, as well as the dimensionless size parameter kb (where k is the wavenumber), without the restriction to a particular range of frequencies. It is found that at high kb values > 1, the radiation force per length with broadside incidence is larger, whereas the opposite situation occurs in the long-wavelength limit (i.e., kb < 1). The results are particularly relevant in acoustic levitation of elliptical cylinders, the acoustic stabilization of liquid columns in a host medium, acousto-fluidics devices, and other particle dynamics applications to name a few. Moreover, the formalism presented here may be effectively applied to compute the acoustic radiation force on other 2D surfaces of arbitrary shape such as super-ellipses, Chebyshev cylindrical particles, or other non-circular geometries

Acoustic radiation force on a rigid elliptical cylinder in plane (quasi)standing waves

Energy Technology Data Exchange (ETDEWEB)

Mitri, F. G., E-mail: F.G.Mitri@ieee.org [Chevron, Area 52 Technology–ETC, Santa Fe, New Mexico 87508 (United States)

2015-12-07

The acoustic radiation force on a 2D elliptical (non-circular) cylinder centered on the axis of wave propagation of plane quasi-standing and standing waves is derived, based on the partial-wave series expansion (PWSE) method in cylindrical coordinates. A non-dimensional acoustic radiation force function, which is the radiation force per unit length, per characteristic energy density and per unit cross-sectional surface of the ellipse, is defined in terms of the scattering coefficients that are determined by applying the Neumann boundary condition for an immovable surface. A system of linear equations involving a single numerical integration procedure is solved by matrix inversion. Numerical simulations showing the transition from the quasi-standing to the (equi-amplitude) standing wave behaviour are performed with particular emphasis on the aspect ratio a/b, where a and b are the ellipse semi-axes, as well as the dimensionless size parameter kb (where k is the wavenumber), without the restriction to a particular range of frequencies. It is found that at high kb values > 1, the radiation force per length with broadside incidence is larger, whereas the opposite situation occurs in the long-wavelength limit (i.e., kb < 1). The results are particularly relevant in acoustic levitation of elliptical cylinders, the acoustic stabilization of liquid columns in a host medium, acousto-fluidics devices, and other particle dynamics applications to name a few. Moreover, the formalism presented here may be effectively applied to compute the acoustic radiation force on other 2D surfaces of arbitrary shape such as super-ellipses, Chebyshev cylindrical particles, or other non-circular geometries.

Mobile ultrasound plane wave beamforming on iPhone or iPad using metal-based GPU processing

OpenAIRE

Hewener, H.; Tretbar, S.

2015-01-01

Mobile and cost effective ultrasound devices are being used in point of care scenarios or the drama room. To reduce the costs of such devices we already presented the possibilities of consumer devices like Apple iPad for full signal processing of raw data for ultraound image generation. Using technologies like plane wave imaging to generate a full image with only one excitation/reception event the acquisition times and power consumption of ultrasound imaging can be reduced for low power mobil...

Spin-orbit interaction effects in zincblende semiconductors: Ab initio pseudopotential calculations

International Nuclear Information System (INIS)

Li, Ming-Fu; Surh, M.P.; Louie, S.G.

1988-06-01

Ab initio band structure calculations have been performed for the spin-orbit interaction effects at the top of the valence bands for GaAs and InSb. Relativistic, norm-conserving pseudopotentials are used with no correction made for the gaps from the local density approximation. The spin-orbit splitting at Γ and linear terms in the /rvec char/k dependence of the splitting are found to be in excellent agreement with existing experiments and previous theoretical results. The effective mass and the cubic splitting terms are also examined. 6 refs., 1 fig., 2 tabs

Three-dimensional shear wave elastography for differentiation of breast lesions: An initial study with quantitative analysis using three orthogonal planes.

Science.gov (United States)

Wang, Qiao

2018-05-25

To prospectively evaluate the diagnostic performance of three-dimensional (3D) shear wave elastography (SWE) for breast lesions with quantitative stiffness information from transverse, sagittal and coronal planes. Conventional ultrasound (US), two-dimensional (2D)-SWE and 3D-SWE were performed for 122 consecutive patients with 122 breast lesions before biopsy or surgical excision. Maximum elasticity values of Young's modulus (Emax) were recorded on 2D-SWE and three planes of 3D-SWE. Area under the receiver operating characteristic curve (AUC), sensitivity and specificity of US, 2D-SWE and 3D-SWE were evaluated. Two combined sets (i.e., BI-RADS and 2D-SWE; BI-RADS and 3D-SWE) were compared in AUC. Observer consistency was also evaluated. On 3D-SWE, the AUC and sensitivity of sagittal plane were significantly higher than those of transverse and coronal planes (both P 0.05). However, the combined set of BI-RADS and sagittal plane of 3D-SWE had significantly higher sensitivity than the combined set of BI-RADS and 2D-SWE. The sagittal plane shows the best diagnostic performance among 3D-SWE. The combination of BI-RADS and 3D-SWE is a useful tool for predicting breast malignant lesions in comparison with BI-RADS alone.

Effects of positron density and temperature on large amplitude ion-acoustic waves in an electron-positron-ion plasma

International Nuclear Information System (INIS)

Nejoh, Y.N.

1997-01-01

The nonlinear wave structures of large amplitude ion-acoustic waves are studied in a plasma with positrons. We have presented the region of existence of the ion-acoustic waves by analysing the structure of the pseudopotential. The region of existence sensitively depends on the positron to electron density ratio, the ion to electron mass ratio and the positron to electron temperature ratio. It is shown that the maximum Mach number increases as the positron temperature increases and the region of existence of the ion-acoustic waves spreads as the positron temperature increases. 12 refs., 6 figs

DFT LCAO and plane wave calculations of SrZrO{sub 3}

Energy Technology Data Exchange (ETDEWEB)

Evarestov, R.A.; Bandura, A.V.; Alexandrov, V.E. [Department of Quantum Chemistry, St. Petersburg State University, 26 Universitetskiy Prospekt, Stary Peterhof 198504 (Russian Federation); Kotomin, E.A. [Max-Planck-Institut fuer Festkoerperforschung, Heisenbergstr. 1, 70569, Stuttgart (Germany)

2005-02-01

The results of the density functional (DFT) LCAO and plane wave (PW) calculations of the electronic and structural properties of four known SrZrO{sub 3} phases (Pm3m, I4/mcm, Cmcm and Pbnm) are presented and discussed. The calculated unit cell energies and relative stability of these phases agree well with the experimental sequence of SrZrO{sub 3} phases as the temperature increases. The lattice structure parameters optimized in the PW calculations for all four phases are in good agreement with the experimental neutron diffraction data. The LCAO and PW results for the electronic structure, density of states and chemical bonding in the cubic phase (Pm3m) are discussed in detail and compared with the results of previous PW calculations. (copyright 2005 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)

Progress in parallel implementation of the multilevel plane wave time domain algorithm

KAUST Repository

Liu, Yang

2013-07-01

The computational complexity and memory requirements of classical schemes for evaluating transient electromagnetic fields produced by Ns dipoles active for Nt time steps scale as O(NtN s 2) and O(Ns 2), respectively. The multilevel plane wave time domain (PWTD) algorithm [A.A. Ergin et al., Antennas and Propagation Magazine, IEEE, vol. 41, pp. 39-52, 1999], viz. the extension of the frequency domain fast multipole method (FMM) to the time domain, reduces the above costs to O(NtNslog2Ns) and O(Ns α) with α = 1.5 for surface current distributions and α = 4/3 for volumetric ones. Its favorable computational and memory costs notwithstanding, serial implementations of the PWTD scheme unfortunately remain somewhat limited in scope and ill-suited to tackle complex real-world scattering problems, and parallel implementations are called for. © 2013 IEEE.

Calculation of radial couplings in the model-potential and pseudopotential approaches: The NaH quasimolecule

International Nuclear Information System (INIS)

Mo, O.; Riera, A.; Yaez, M.

1985-01-01

We present an extension of the analytical method of Macias and Riera to calculate radial couplings, to include model potentials or (local and nonlocal) pseudopotentials, in the Hamiltonian. As an illustration, energies, couplings, and momentum matrix elements are presented and discussed for the two-effective-electron NaH quasimolecule, as a stringent test case

Calculation of radial couplings in the model-potential and pseudopotential approaches: The NaH quasimolecule

Energy Technology Data Exchange (ETDEWEB)

Mo, O.; Riera, A.; Yaez, M.

1985-06-01

We present an extension of the analytical method of Macias and Riera to calculate radial couplings, to include model potentials or (local and nonlocal) pseudopotentials, in the Hamiltonian. As an illustration, energies, couplings, and momentum matrix elements are presented and discussed for the two-effective-electron NaH quasimolecule, as a stringent test case.

Instability of coupled gravity-inertial-Rossby waves on a β-plane in solar system atmospheres

Directory of Open Access Journals (Sweden)

J. F. McKenzie

2009-11-01

Full Text Available This paper provides an analysis of the combined theory of gravity-inertial-Rossby waves on a β-plane in the Boussinesq approximation. The wave equation for the system is fifth order in space and time and demonstrates how gravity-inertial waves on the one hand are coupled to Rossby waves on the other through the combined effects of β, the stratification characterized by the Väisälä-Brunt frequency N, the Coriolis frequency f at a given latitude, and vertical propagation which permits buoyancy modes to interact with westward propagating Rossby waves. The corresponding dispersion equation shows that the frequency of a westward propagating gravity-inertial wave is reduced by the coupling, whereas the frequency of a Rossby wave is increased. If the coupling is sufficiently strong these two modes coalesce giving rise to an instability. The instability condition translates into a curve of critical latitude Θ_c versus effective equatorial rotational Mach number M, with the region below this curve exhibiting instability. "Supersonic" fast rotators are unstable in a narrow band of latitudes around the equator. For example Θ_c~12° for Jupiter. On the other hand slow "subsonic" rotators (e.g. Mercury, Venus and the Sun's Corona are unstable at all latitudes except very close to the poles where the β effect vanishes. "Transonic" rotators, such as the Earth and Mars, exhibit instability within latitudes of 34° and 39°, respectively, around the Equator. Similar results pertain to Oceans. In the case of an Earth's Ocean of depth 4km say, purely westward propagating waves are unstable up to 26° about the Equator. The nonlinear evolution of this instability which feeds off rotational energy and gravitational buoyancy may play an important role in atmospheric dynamics.

Propagation of sound waves in ducts

DEFF Research Database (Denmark)

Jacobsen, Finn

2000-01-01

Plane wave propagation in ducts with rigid walls, radiation from ducts, classical four-pole theory for composite duct systems, and three-dimentional waves in wave guides of various cross-sectional shape are described.......Plane wave propagation in ducts with rigid walls, radiation from ducts, classical four-pole theory for composite duct systems, and three-dimentional waves in wave guides of various cross-sectional shape are described....

Evaluation of the Electromagnetic Power Absorption in Humans Exposed to Plane Waves: The Effect of Breathing Activity

Directory of Open Access Journals (Sweden)

Marta Cavagnaro

2013-01-01

Full Text Available The safety aspects of the exposure of people to uniform plane waves in the frequency range from 900 MHz to 5 GHz are analyzed. Starting from a human body model available in the literature, representing a man in resting state, two new anatomical models are considered, representing different phases of the respiratory activity: tidal breath and deep breath. These models have been used to evaluate the whole body Specific Absorption Rate (SAR and the 10-g averaged and 1-g averaged SAR. The analysis is performed using a parallel implementation of the finite difference time domain method. A uniform plane wave, with vertical polarization, is used as an incident field since this is the canonical exposure situation used in safety guidelines. Results show that if the incident electromagnetic field is compliant with the reference levels promulgated by the International Commission on Non-Ionizing Radiation Protection and by IEEE, the computed SAR values are lower than the corresponding basic restrictions, as expected. On the other side, when the Federal Communications Commission reference levels are considered, 1-g SAR values exceeding the basic restrictions for exposure at 4 GHz and above are obtained. Furthermore, results show that the whole body SAR values increase passing from the resting state model to the deep breath model, for all the considered frequencies.

Fast Plane Wave 2-D Vector Flow Imaging Using Transverse Oscillation and Directional Beamforming

DEFF Research Database (Denmark)

Jensen, Jonas; Villagómez Hoyos, Carlos Armando; Stuart, Matthias Bo

2017-01-01

load, which is 4.6 times larger than for TO and seven times smaller than for conventional DB. Steered plane wave transmissions are employed for high frame rate imaging, and parabolic flow with a peak velocity of 0.5 m/s is simulated in straight vessels at beamto- flow angles from 45 to 90. The TO......-DB method estimates the angle with a bias and standard deviation (SD) less than 2, and the SD of the velocity magnitude is less than 2%. When using only TO, the SD of the angle ranges from 2 to 17 and for the velocity magnitude up to 7%. Bias of the velocity magnitude is within 2% for TO and slightly larger...

Kinetic theory of electromagnetic plane wave obliquely incident on bounded plasma slab

International Nuclear Information System (INIS)

Angus, J. R.; Krasheninnikov, S. I.; Smolyakov, A. I.

2010-01-01

The effects of electromagnetic plane waves obliquely incident on a warm bounded plasma slab of finite length L are studied by solving the coupled Vlasov-Maxwell set of equations. It is shown that the solution can be greatly simplified in the limit where thermal effects are most important by expanding in small parameters and introducing self-similar variables. These solutions reveal that the coupling of thermal effects with the angle of incidence is negligible in the region of bounce resonance and anomalous skin effect. In the region of the anomalous skin effect, the heating is shown to scale linearly with the anomalous skin depth δ a when δ a a >>L, the heating is shown to decay with 1/δ a 3 . The transmission is found to be exponentially larger than that predicted from a local theory in the appropriate region of the anomalous skin effect.

Temperature dependence of residual electrical resistivity of Cu-Au in pseudopotential approximation

International Nuclear Information System (INIS)

Khwaja, F.A.; Ahmed, I.; Shaukat, A.

1986-08-01

The problem of temperature dependence of residual electrical resistivity of Cu-Au system is re-examined in the light of static distortion and thermal vibration of the lattice along with the short-range-order of atoms above critical temperature. The extended version of Ziman's formula for resistivity obtained yields a unified version for the calculation of resistivity in pseudopotential approximation. The temperature dependence of the quantity Δρ/ρ in this framework for Cu-Au system is found to be in better agreement with the experimental data as compared to previous calculation. (author)

Band structure calculation of GaSe-based nanostructures using empirical pseudopotential method

International Nuclear Information System (INIS)

Osadchy, A V; Obraztsova, E D; Volotovskiy, S G; Golovashkin, D L; Savin, V V

2016-01-01

In this paper we present the results of band structure computer simulation of GaSe- based nanostructures using the empirical pseudopotential method. Calculations were performed using a specially developed software that allows performing simulations using cluster computing. Application of this method significantly reduces the demands on computing resources compared to traditional approaches based on ab-initio techniques and provides receiving the adequate comparable results. The use of cluster computing allows to obtain information for structures that require an explicit account of a significant number of atoms, such as quantum dots and quantum pillars. (paper)

CMS-Wave

Science.gov (United States)

2015-10-30

Coastal Inlets Research Program CMS -Wave CMS -Wave is a two-dimensional spectral wind-wave generation and transformation model that employs a forward...marching, finite-difference method to solve the wave action conservation equation. Capabilities of CMS -Wave include wave shoaling, refraction... CMS -Wave can be used in either on a half- or full-plane mode, with primary waves propagating from the seaward boundary toward shore. It can

Applicability of geometrical optics to in-plane liquid-crystal configurations.

Science.gov (United States)

Sluijter, M; Xu, M; Urbach, H P; de Boer, D K G

2010-02-15

We study the applicability of geometrical optics to inhomogeneous dielectric nongyrotropic optically anisotropic media typically found in in-plane liquid-crystal configurations with refractive indices n(o)=1.5 and n(e)=1.7. To this end, we compare the results of advanced ray- and wave-optics simulations of the propagation of an incident plane wave to a special anisotropic configuration. Based on the results, we conclude that for a good agreement between ray and wave optics, a maximum change in optical properties should occur over a distance of at least 20 wavelengths.

Plane-wave and common-translation-factor treatments of He2++H collisions at high velocities

International Nuclear Information System (INIS)

Errea, L.F.; Harel, C.; Jouin, H.; Maidagan, J.M.; Mendez, L.; Pons, B.; Riera, A.

1992-01-01

We complement previous work that showed that the molecular approach, modified with plane-wave translation factors, is able to reproduce the fall of charge-exchange cross sections in He 2+ +H collisions, by presenting the molecular data, and studying the corresponding mechanism. We test the accuracy of simplifications of the method that have been employed in the literature, and that lead to very simple calculations. We show that the common-translation-factor method is also successful at high nuclear velocities, provided that sufficiently excited states are included in the basis; moreover, it yields a simple picture of the mechanism and a description of ionization processes at high velocities

Linear and nonlinear dust ion acoustic solitary waves in a quantum dusty electron-positron-ion plasma

Energy Technology Data Exchange (ETDEWEB)

Emadi, E.; Zahed, H. [Physics Department, Faculty of Science, Sahand University of Technology, 51335–1996 Tabriz (Iran, Islamic Republic of)

2016-08-15

The behavior of linear and nonlinear dust ion acoustic (DIA) solitary waves in an unmagnetized quantum dusty plasma, including inertialess electrons and positrons, ions, and mobile negative dust grains, are studied. Reductive perturbation and Sagdeev pseudopotential methods are employed for small and large amplitude DIA solitary waves, respectively. A minimum value of the Mach number obtained for the existence of solitary waves using the analytical expression of the Sagdeev potential. It is observed that the variation on the values of the plasma parameters such as different values of Mach number M, ion to electron Fermi temperature ratio σ, and quantum diffraction parameter H can lead to the creation of compressive solitary waves.

Density fitting for derivatives of Coulomb integrals in ab initio calculations using mixed Gaussian and plane-wave basis

Czech Academy of Sciences Publication Activity Database

Čársky, Petr

2009-01-01

Roč. 109, č. 620 (2009), s. 1237-1242 ISSN 0020-7608 R&D Projects: GA ČR GA203/07/0070; GA ČR GA202/08/0631; GA AV ČR 1ET400400413; GA AV ČR IAA100400501 Institutional research plan: CEZ:AV0Z40400503 Keywords : Derivatives of Coulomb integrals * mixed Gaussian and plane-wave basis sets * electron scattering * computer time saving Subject RIV: CF - Physical ; Theoretical Chemistry Impact factor: 1.315, year: 2009

Magnetoelastic plane waves in rotating media in thermoelasticity of type II (G-N model

Directory of Open Access Journals (Sweden)

S. K. Roychoudhuri

2004-01-01

Full Text Available A study is made of the propagation of time-harmonic plane waves in an infinite, conducting, thermoelastic solid permeated by a uniform primary external magnetic field when the entire medium is rotating with a uniform angular velocity. The thermoelasticity theory of type II (G-N model (1993 is used to study the propagation of waves. A more general dispersion equation is derived to determine the effects of rotation, thermal parameters, characteristic of the medium, and the external magnetic field. If the primary magnetic field has a transverse component, it is observed that the longitudinal and transverse motions are linked together. For low frequency (χ≪1, χ being the ratio of the wave frequency to some standard frequency ω∗, the rotation and the thermal field have no effect on the phase velocity to the first order of χ and then this corresponds to only one slow wave influenced by the electromagnetic field only. But to the second order of χ, the phase velocity, attenuation coefficient, and the specific energy loss are affected by rotation and depend on the thermal parameters cT, cT being the nondimensional thermal wave speed of G-N theory, and the thermoelastic coupling εT, the electromagnetic parameters εH, and the transverse magnetic field RH. Also for large frequency, rotation and thermal field have no effect on the phase velocity, which is independent of primary magnetic field to the first order of (1/χ (χ≫1, and the specific energy loss is a constant, independent of any field parameter. However, to the second order of (1/χ, rotation does exert influence on both the phase velocity and the attenuation factor, and the specific energy loss is affected by rotation and depends on the thermal parameters cT and εT, electromagnetic parameter εH, and the transverse magnetic field RH, whereas the specific energy loss is independent of any field parameters to the first order of (1/χ.

The effect of lower-hybrid waves on the propagation of hydromagnetic waves

International Nuclear Information System (INIS)

Hamabata, Hiromitsu; Namikawa, Tomikazu; Mori, Kazuhiro

1988-01-01

Propagation characteristics of hydromagnetic waves in a magnetic plasma are investigated using the two-plasma fluid equations including the effect of lower-hybrid waves propagating perpendicularly to the magnetic field. The effect of lower-hybrid waves on the propagation of hydromagnetic waves is analysed in terms of phase speed, growth rate, refractive index, polarization and the amplitude relation between the density perturbation and the magnetic-field perturbation for the cases when hydromagnetic waves propagate in the plane whose normal is perpendicular to both the magnetic field and the propagation direction of lower-hybrid waves and in the plane perpendicular to the propagation direction of lower-hybrid waves. It is shown that hydromagnetic waves propagating at small angles to the propagation direction of lower-hybrid waves can be excited by the effect of lower-hybrid waves and the energy of excited waves propagates nearly parallel to the propagation direction of lower-hybrid waves. (author)

Pseudopotential calculations of AlSb under pressure

Science.gov (United States)

Algarni, H.; Al-Hagan, O. A.; Bouarissa, N.; Khan, M. A.; Alhuwaymel, T. F.

2018-02-01

The dependence on hydrostatic pressure of the electronic and optical properties of zinc-blende AlSb semiconducting material in the pressure range of 0-20 kbar has been reported using a pseudopotential approach. At zero pressure, our findings showed that the electron and heavy hole effective masses are 0.11 and 0.38 m0, respectively. Moreover, our results yielded values of 3.3289 and 11.08 for refractive index and high frequency dielectric constant, respectively. These results are found to be in good accord with experiment. Upon compression, all physical parameters of interest showed a monotonic behavior. The pressure-induced energy shifts for the optical transition related to band-gaps indicated that AlSb remains an indirect (D-X) band-gap semiconductor at pressures from 0 to 20 kbar. The trend in all features of interest versus pressure has been presented and discussed. It is found that the lattice parameter is reduced from 0.61355 to 0.60705 nm when pressure is raised from 0 to 20 kbar. The present investigation may be useful for mid-infrared lasers applications, detectors and communication devices.

Coherent field propagation between tilted planes.

Science.gov (United States)

Stock, Johannes; Worku, Norman Girma; Gross, Herbert

2017-10-01

Propagating electromagnetic light fields between nonparallel planes is of special importance, e.g., within the design of novel computer-generated holograms or the simulation of optical systems. In contrast to the extensively discussed evaluation between parallel planes, the diffraction-based propagation of light onto a tilted plane is more burdensome, since discrete fast Fourier transforms cannot be applied directly. In this work, we propose a quasi-fast algorithm (O(N 3  log N)) that deals with this problem. Based on a proper decomposition into three rotations, the vectorial field distribution is calculated on a tilted plane using the spectrum of plane waves. The algorithm works on equidistant grids, so neither nonuniform Fourier transforms nor an explicit complex interpolation is necessary. The proposed algorithm is discussed in detail and applied to several examples of practical interest.

Neoclassical Solution of Transient Interaction of Plane Acoustic Waves with a Spherical Elastic Shell

Directory of Open Access Journals (Sweden)

Hanson Huang

1996-01-01

Full Text Available A detailed solution to the transient interaction of plane acoustic waves with a spherical elastic shell was obtained more than a quarter of a century ago based on the classical separation of variables, series expansion, and Laplace transform techniques. An eight-term summation of the time history series was sufficient for the convergence of the shell deflection and strain, and to a lesser degree, the shell velocity. Since then, the results have been used routinely for validation of solution techniques and computer methods for the evaluation of underwater explosion response of submerged structures. By utilizing modern algorithms and exploiting recent advances of computer capacities and floating point mathematics, sufficient terms of the inverse Laplace transform series solution can now be accurately computed. Together with the application of the Cesaro summation using up to 70 terms of the series, two primary deficiencies of the previous solution are now remedied: meaningful time histories of higher time derivative data such as acceleration and pressure are now generated using a sufficient number of terms in the series; and uniform convergence around the discontinuous step wave front is now obtained, completely eradicating spurious oscillations due to the Gibbs' phenomenon. New results of time histories of response items of interest are presented.

Covariant quantum mechanics on a null plane

International Nuclear Information System (INIS)

Leutwyler, H.; Stern, J.

1977-03-01

Lorentz invariance implies that the null plane wave functions factorize into a kinematical part describing the motion of the system as a whole and an inner wave function that involves the specific dynamical properties of the system - in complete correspondence with the non-relativistic situation. Covariance is equivalent to an angular condition which admits non-trivial solutions

s -wave scattering length of a Gaussian potential

Science.gov (United States)

Jeszenszki, Peter; Cherny, Alexander Yu.; Brand, Joachim

2018-04-01

We provide accurate expressions for the s -wave scattering length for a Gaussian potential well in one, two, and three spatial dimensions. The Gaussian potential is widely used as a pseudopotential in the theoretical description of ultracold-atomic gases, where the s -wave scattering length is a physically relevant parameter. We first describe a numerical procedure to compute the value of the s -wave scattering length from the parameters of the Gaussian, but find that its accuracy is limited in the vicinity of singularities that result from the formation of new bound states. We then derive simple analytical expressions that capture the correct asymptotic behavior of the s -wave scattering length near the bound states. Expressions that are increasingly accurate in wide parameter regimes are found by a hierarchy of approximations that capture an increasing number of bound states. The small number of numerical coefficients that enter these expressions is determined from accurate numerical calculations. The approximate formulas combine the advantages of the numerical and approximate expressions, yielding an accurate and simple description from the weakly to the strongly interacting limit.

Reflection and Transmission of Plane Electromagnetic Waves by a Geologic Layer.

Energy Technology Data Exchange (ETDEWEB)

Aldridge, David F. [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States)

2017-04-01

Electric field and magnetic field reflection and transmission responses generated by a plane wave normally incident onto a finite - thickness geologic layer are mathematically derived and numerically evaluated. A thin layer with enhanced electric current conductivity and/or magnetic permeability is a reasonable geophysical representation of a hydraulic fracture inject ed with a high - contrast proppant pack. Both theory and numerics indicate that backward - and forward - scattered electromagnetic wavefields are potentially observable in a field experiment, despite the extreme thinness of a fracture compared to a typical low - frequency electromagnetic wavelength. The First Born Approximation (FBA) representation of layer scattering, significant for inversion studies, is shown to be accurate for a thin layer with mild medium parameter (i.e., conductivity, permeability, and per mittivity) contrasts with the surrounding homogeneous wholespace. However, FBA scattering theory breaks down for thick layers and strong parameter contrasts. ACKNOWLEDGEMENTS Sandia National Laboratories is a multi - mission laboratory managed and operated by Sandia Corporation, a wholly owned subsidiary of Lockheed Martin Corporation, for the US Department of Energy's National Nuclear Security Administration under contract DE - AC04 - 94AL85000. This research is conducted under the auspices of CRADA (Cooperative Research and Development Agreement) SC11/01780.00 between Carbo Ceramics Inc. and Sandia National Laboratories. The author acknowledges former Carbo R&D Vic e - President Mr. Chad Cannan and former SNL Geophysics Department manage r Ms. Amy Halloran for their interest i n and support of this work. Technical discussions with Project Manager and Principal Investigator Dr. Chester J. Weiss of the SNL Geophysics Department greatly benefited this work. Dr. Lewis C. Bartel, formerly with S NL and presently a consultant to Carbo Ceramics, provided many useful and intuitive insights, and

Wave phenomena

CERN Document Server

Towne, Dudley H

1988-01-01

This excellent undergraduate-level text emphasizes optics and acoustics, covering inductive derivation of the equation for transverse waves on a string, acoustic plane waves, boundary-value problems, polarization, three-dimensional waves and more. With numerous problems (solutions for about half). ""The material is superbly chosen and brilliantly written"" - Physics Today. Problems. Appendices.

In-plane angular dependence of the spin-wave nonreciprocity of an ultrathin film with Dzyaloshinskii-Moriya interaction

Energy Technology Data Exchange (ETDEWEB)

Zhang, Vanessa Li; Di, Kai; Lim, Hock Siah; Ng, Ser Choon; Kuok, Meng Hau, E-mail: phykmh@nus.edu.sg [Department of Physics, National University of Singapore, Singapore 117551 (Singapore); Yu, Jiawei; Yoon, Jungbum; Qiu, Xuepeng; Yang, Hyunsoo, E-mail: eleyang@nus.edu.sg [Department of Electrical and Computer Engineering, National University of Singapore, Singapore 117576 (Singapore)

2015-07-13

The nonreciprocal propagation of spin waves in an ultrathin Pt/Co/Ni film has been measured by Brillouin light scattering. The frequency nonreciprocity, due to the interfacial Dzyaloshinskii-Moriya interaction (DMI), has a sinusoidal dependence on the in-plane angle between the magnon wavevector and the applied magnetic field. The results, which are in good agreement with analytical predictions reported earlier, yield a value of the DMI constant which is the same as that obtained previously from a study of the magnon dispersion relations. We have demonstrated that our magnon-dynamics based method can experimentally ascertain the DMI constant of multilayer thin films.

Wavelets in self-consistent electronic structure calculations

International Nuclear Information System (INIS)

Wei, S.; Chou, M.Y.

1996-01-01

We report the first implementation of orthonormal wavelet bases in self-consistent electronic structure calculations within the local-density approximation. These local bases of different scales efficiently describe localized orbitals of interest. As an example, we studied two molecules, H 2 and O 2 , using pseudopotentials and supercells. Considerably fewer bases are needed compared with conventional plane-wave approaches, yet calculated binding properties are similar. Our implementation employs fast wavelet and Fourier transforms, avoiding evaluating any three-dimensional integral numerically. copyright 1996 The American Physical Society

The plain truth about forming a plane wave of neutrons

Energy Technology Data Exchange (ETDEWEB)

Wagh, Apoorva G., E-mail: nintsspd@barc.gov.i [Solid State Physics Division, Bhabha Atomic Research Centre, Mumbai 400 085 (India); Abbas, Sohrab [Solid State Physics Division, Bhabha Atomic Research Centre, Mumbai 400 085 (India); Treimer, Wolfgang [Helmholtz Zentrum Berlin, Glienicker Str. 100, D-14109 Berlin (Germany)

2011-04-01

We have attained the first sub-arcsecond collimation of a monochromatic neutron beam by diffracting neutrons from a Bragg prism, viz. a single crystal prism operating in the vicinity of Bragg incidence. Analytical as well numerical computations based on the dynamical diffraction theory, led to the optimised collimator configuration of a silicon {l_brace}1 1 1{r_brace} Bragg prism for 5.26 A neutrons. We fabricated a Bragg prism to these specifications, tested and operated it at the double diffractometer setup in Helmholtz Zentrum Berlin to produce a 0.58 arcsec wide monochromatic neutron beam. With a similarly optimised Bragg prism analyser of opposite asymmetry, we recorded a 0.62 arcsec wide virgin rocking curve for this ultra-parallel beam. With this nearly plane-wave neutron beam, we have recorded the first ever USANS spectrum in Q{approx}10{sup -6} A{sup -1} range with a hydroxyapatite casein protein sample and demonstrated the instrument capability to characterise agglomerates up to 150 {mu}m in size. The super-collimated monochromatic beam has also enabled us to record the first neutron diffraction pattern from a macroscopic grating of 200 {mu}m period. The transverse coherence length of 175 {mu}m (FWHM) of the ultra-parallel beam derived from the analysis of this pattern, is the greatest achieved to date for A wavelength neutrons.

Density-functional formulation of the generalized pseudopotential theory. III. Transition-metal interatomic potentials

Science.gov (United States)

Moriarty, John A.

1988-08-01

The first-principles, density-functional version of the generalized pseudopotential theory (GPT) developed in papers I and II of this series [Phys. Rev. B 16, 2537 (1977); 26, 1754 (1982)] for empty- and filled-d-band metals is here extended to pure transition metals with partially filled d bands. The present focus is on a rigorous, real-space expansion of the bulk total energy in terms of widely transferable, structure-independent interatomic potentials, including both central-force pair interactions and angular-force triplet and quadruplet interactions. To accomplish this expansion, a specialized set of starting equations is derived from the basic local-density formalism for a pure metal, including refined expansions for the exchange-correlation terms and a simplified yet accurate representation of the cohesive energy. The parent pseudo-Green's-function formalism of the GPT is then used to develop these equations in a plane-wave, localized-d-state basis. In this basis, the cohesive energy divides quite naturally into a large volume component and a smaller structural component. The volume component,which includes all one-ion intra-atomic energy contributions, already gives a good description of the cohesion in lowest order. The structural component is expanded in terms of weak interatomic matrix elements and gives rise to a multi-ion series which establishes the interatomic potentials. Special attention is focused on the dominant d-electron contributions to this series and complete formal results for the two-ion, three-ion, and four-ion d-state potentials (vd2, vd3, and vd4) are derived. In addition, a simplified model is used to demonstrate that while vd3 can be of comparable importance to vd2, vd4 is inherently small and the series is rapidly convergent beyond three-ion interactions. Analytic model forms are also derived for vd2 and vd3 in the case of canonical d bands. In this limit, vd2 is purely attractive and varies with interatomic distance as r-10, while

A phase-plane analysis of localized frictional waves

Science.gov (United States)

Putelat, T.; Dawes, J. H. P.; Champneys, A. R.

2017-07-01

Sliding frictional interfaces at a range of length scales are observed to generate travelling waves; these are considered relevant, for example, to both earthquake ground surface movements and the performance of mechanical brakes and dampers. We propose an explanation of the origins of these waves through the study of an idealized mechanical model: a thin elastic plate subject to uniform shear stress held in frictional contact with a rigid flat surface. We construct a nonlinear wave equation for the deformation of the plate, and couple it to a spinodal rate-and-state friction law which leads to a mathematically well-posed problem that is capable of capturing many effects not accessible in a Coulomb friction model. Our model sustains a rich variety of solutions, including periodic stick-slip wave trains, isolated slip and stick pulses, and detachment and attachment fronts. Analytical and numerical bifurcation analysis is used to show how these states are organized in a two-parameter state diagram. We discuss briefly the possible physical interpretation of each of these states, and remark also that our spinodal friction law, though more complicated than other classical rate-and-state laws, is required in order to capture the full richness of wave types.

Experimental and numerical study of guided wave propagation in a thin metamaterial plate

International Nuclear Information System (INIS)

Zhu, R.; Huang, G.L.; Huang, H.H.; Sun, C.T.

2011-01-01

In this Letter, both in-plane and out-of-plane guided waves in a thin plate with local resonators are studied numerically and experimentally. Through the numerical simulation, a new metamaterial plate design is achieved for a low-frequency bandgap in both in-plane and out-of-plane guided waves. Experiments were conducted to validate the numerical design. In the experiment, piezoelectric transducers were used to generate and receive guided wave signals. The results show that the numerical predictions are in very good agreement with the experimental measurements. Specifically, the connection between the local resonance in the thin plate and its wave attenuation mechanism was discussed. -- Highlights: → Both in-plane and out-of-plane guided waves in a thin plate with local resonators are studied numerically and experimentally. → A new metamaterial plate design is achieved for a low-frequency bandgap in both in-plane and out-of-plane guided waves. → Experiments were conducted to validate the numerical design. → The connection between the local resonance in the thin plate and its wave attenuation mechanism was investigated.

Rayleigh-wave phase-velocity maps and three-dimensional shear velocity structure of the western US from local non-plane surface wave tomography

Science.gov (United States)

Pollitz, F.F.; Snoke, J. Arthur

2010-01-01

We utilize two-and-three-quarter years of vertical-component recordings made by the Transportable Array (TA) component of Earthscope to constrain three-dimensional (3-D) seismic shear wave velocity structure in the upper 200 km of the western United States. Single-taper spectral estimation is used to compile measurements of complex spectral amplitudes from 44 317 seismograms generated by 123 teleseismic events. In the first step employed to determine the Rayleigh-wave phase-velocity structure, we implement a new tomographic method, which is simpler and more robust than scattering-based methods (e.g. multi-plane surface wave tomography). The TA is effectively implemented as a large number of local arrays by defining a horizontal Gaussian smoothing distance that weights observations near a given target point. The complex spectral-amplitude measurements are interpreted with the spherical Helmholtz equation using local observations about a succession of target points, resulting in Rayleigh-wave phase-velocity maps at periods over the range of 18–125 s. The derived maps depend on the form of local fits to the Helmholtz equation, which generally involve the nonplane-wave solutions of Friederich et al. In a second step, the phase-velocity maps are used to derive 3-D shear velocity structure. The 3-D velocity images confirm details witnessed in prior body-wave and surface-wave studies and reveal new structures, including a deep (>100 km deep) high-velocity lineament, of width ∼200 km, stretching from the southern Great Valley to northern Utah that may be a relic of plate subduction or, alternatively, either a remnant of the Mojave Precambrian Province or a mantle downwelling. Mantle seismic velocity is highly correlated with heat flow, Holocene volcanism, elastic plate thickness and seismicity. This suggests that shallow mantle structure provides the heat source for associated magmatism, as well as thinning of the thermal lithosphere, leading to relatively high

Generation and Propagation of Finite-Amplitude Waves in Flexible Tubes (A)

DEFF Research Database (Denmark)

Jensen, Leif Bjørnø

1972-01-01

Highly reproducible finite-amplitude waves, generated by a modified electromagnetic plane-wave generator, characterized by a rise time......Highly reproducible finite-amplitude waves, generated by a modified electromagnetic plane-wave generator, characterized by a rise time...

Statistics for long irregular wave run-up on a plane beach from direct numerical simulations

Science.gov (United States)

Didenkulova, Ira; Senichev, Dmitry; Dutykh, Denys

2017-04-01

-975 (2011). [2] P. Denissenko, I. Didenkulova, A. Rodin, M. Listak, E. Pelinovsky. Experimental statistics of long wave runup on a plane beach. Journal of Coastal Research 65, 195-200 (2013). [3] I. Didenkulova, E. Pelinovsky, A. Sergeeva. Statistical characteristics of long waves nearshore. Coastal Engineering 58, 94-102 (2011). [4] D. Dutykh, T. Katsaounis, D. Mitsotakis. Finite volume schemes for dispersive wave propagation and runup. J. Comput. Phys. 230 (8), 3035-3061 (2011a). [5] D. Dutykh, C. Labart, D. Mitsotakis. Long wave run-up on random beaches. Phys. Rev. Lett. 107, 184504 (2011b).

Designing broad phononic band gaps for in-plane modes

Science.gov (United States)

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.

Time-domain analytic Solutions of two-wire transmission line excited by a plane-wave field

Institute of Scientific and Technical Information of China (English)

Ni Gu-Yan; Yan Li; Yuan Nai-Chang

2008-01-01

This paper reports that an analytic method is used to calculate the load responses of the two-wire transmission line excited by a plane-wave directly in the time domain.By the frequency-domain Baum-Liu-Tesche(BLT)equation,the time-domain analytic solutions are obtained and expressed in an infinite geometric series.Moreover,it is shown that there exist only finite nonzero terms in the infinite geometric series if the time variate is at a finite interval.In other word.the time-domain analytic solutions are expanded in a finite geometric series indeed if the time variate is at a finite interval.The computed results are subsequently compared with transient responses obtained by using the frequency-domain BLT equation via a fast Fourier transform,and the agreement is excellent.

The surface chemistry of metal-oxygen interactions

DEFF Research Database (Denmark)

Stokbro, Kurt; Baroni, Stefano

1997-01-01

We report on a computational study of the clean and oxygen-covered Rh(110) surface, based on density-functional theory within the local-density approximation. We have used plane-wave basis sets and Vanderbilt ultra-soft pseudopotentials. For the clean surface, we present results for the equilibrium...... structure, surface energy and surface stress of the unreconstructed and (1 x 2) reconstructed structures. For the oxygen-covered surface we have performed a geometry optimization at 0.5, 1, and 2 monolayer oxygen coverages, and we present results for the equilibrium configurations, workfunctions and oxygen...

Three-dimensional sheaf of ultrasound planes reconstruction (SOUPR) of ablated volumes.

Science.gov (United States)

Ingle, Atul; Varghese, Tomy

2014-08-01

This paper presents an algorithm for 3-D reconstruction of tumor ablations using ultrasound shear wave imaging with electrode vibration elastography. Radio-frequency ultrasound data frames are acquired over imaging planes that form a subset of a sheaf of planes sharing a common axis of intersection. Shear wave velocity is estimated separately on each imaging plane using a piecewise linear function fitting technique with a fast optimization routine. An interpolation algorithm then computes velocity maps on a fine grid over a set of C-planes that are perpendicular to the axis of the sheaf. A full 3-D rendering of the ablation can then be created from this stack of C-planes; hence the name "Sheaf Of Ultrasound Planes Reconstruction" or SOUPR. The algorithm is evaluated through numerical simulations and also using data acquired from a tissue mimicking phantom. Reconstruction quality is gauged using contrast and contrast-to-noise ratio measurements and changes in quality from using increasing number of planes in the sheaf are quantified. The highest contrast of 5 dB is seen between the stiffest and softest regions of the phantom. Under certain idealizing assumptions on the true shape of the ablation, good reconstruction quality while maintaining fast processing rate can be obtained with as few as six imaging planes suggesting that the method is suited for parsimonious data acquisitions with very few sparsely chosen imaging planes.

Dielectric functions, pseudopotentials and applications to lattice dynamics

International Nuclear Information System (INIS)

Sinha, S.K.

1975-01-01

An attempt has been made to review the method of calculating the phonon spectra of crystals in terms of the basic electronic structure. Solids with defects, disordered solids and anharmonic effects have been excluded. The most general technique, viz. the Born-Oppenheimer perturbation theory has been discussed. The structure of the dynamic matrix has been discussed and the manifestations of the Fermi surface in the phonon spectrum explained. A pseudopotential concept for the free electron like metals has been justified and a brief account of these potentials from the point of view of the OPW method as well as from that of the phase shift analysis is included. The formalism of the basic results of the phenomenological dipolar models and their recent generalizations have been reviewed. It has pointed out that this could be derived from the microscopic theory by factorization approximation for the dielectric matrix, and the same method could lead even to more general models and the dielectric properties of the crystal could be obtained from such a microscopic theory. It is expected that the results may be applied to optical properties of the crystal. (K.B.)

Curvature collineations for the field of gravitational waves

International Nuclear Information System (INIS)

Singh, K.P.; Singh, Gulab

1981-01-01

It has been shown that the space-times formed from a plane-fronted gravity wave and from a plane sandwich wave with constant polarisation admit proper curvature collineation in general. The curvature collineation vectors have been determined explicitly. (author)

Time-domain analytic solutions of two-wire transmission line excited by a plane-wave field

International Nuclear Information System (INIS)

Ni Guyan; Yan Li; Yuan Naichang

2008-01-01

This paper reports that an analytic method is used to calculate the load responses of the two-wire transmission line excited by a plane-wave directly in the time domain. By the frequency-domain Baum–Liu–Tesche (BLT) equation, the time-domain analytic solutions are obtained and expressed in an infinite geometric series. Moreover, it is shown that there exist only finite nonzero terms in the infinite geometric series if the time variate is at a finite interval. In other word, the time-domain analytic solutions are expanded in a finite geometric series indeed if the time variate is at a finite interval. The computed results are subsequently compared with transient responses obtained by using the frequency-domain BLT equation via a fast Fourier transform, and the agreement is excellent. (the physics of elementary particles and fields)

Integrable open spin chain in Super Yang-Mills and the plane-wave/SYM duality

International Nuclear Information System (INIS)

Chen Bin; Wang Xiaojun; Wu Yongshi

2004-01-01

We investigate the integrable structures in an N = 2 superconfomal Sp(N) Yang-Mills theory with matter, which is dual to an open+closed string system. We restrict ourselves to the BMN operators that correspond to free string states. In the closed string sector, an integrable structure is inherited from its parent theory, N = 4 SYM. For the open string sector, the planar one-loop mixing matrix for gauge invariant holomorphic operators is identified with the Hamiltonian of an integrable SU(3) open spin chain. Using the K-matrix formalism we identify the integrable open-chain boundary conditions that correspond to string boundary conditions. The solutions to the algebraic Bethe ansatz equations (ABAE) with a few impurities are shown to recover the anomalous dimensions that exactly match the spectrum of free open string in the plane-wave background. We also discuss the properties of the solutions of ABAE beyond the BMN regime. (author)

Three Dimensional Sheaf of Ultrasound Planes Reconstruction (SOUPR) of Ablated Volumes

Science.gov (United States)

Ingle, Atul; Varghese, Tomy

2014-01-01

This paper presents an algorithm for three dimensional reconstruction of tumor ablations using ultrasound shear wave imaging with electrode vibration elastography. Radiofrequency ultrasound data frames are acquired over imaging planes that form a subset of a sheaf of planes sharing a common axis of intersection. Shear wave velocity is estimated separately on each imaging plane using a piecewise linear function fitting technique with a fast optimization routine. An interpolation algorithm then computes velocity maps on a fine grid over a set of C-planes that are perpendicular to the axis of the sheaf. A full three dimensional rendering of the ablation can then be created from this stack of C-planes; hence the name “Sheaf Of Ultrasound Planes Reconstruction” or SOUPR. The algorithm is evaluated through numerical simulations and also using data acquired from a tissue mimicking phantom. Reconstruction quality is gauged using contrast and contrast-to-noise ratio measurements and changes in quality from using increasing number of planes in the sheaf are quantified. The highest contrast of 5 dB is seen between the stiffest and softest regions of the phantom. Under certain idealizing assumptions on the true shape of the ablation, good reconstruction quality while maintaining fast processing rate can be obtained with as few as 6 imaging planes suggesting that the method is suited for parsimonious data acquisitions with very few sparsely chosen imaging planes. PMID:24808405

First principles calculation of thermodynamic properties of NaAlSi ternary

International Nuclear Information System (INIS)

Qin Jining; Lu Weijie; Zhang Di; Fan Tongxiang

2012-01-01

PbFCl-type NaAlSi ternary is a corrosion compound found in aluminum, which is used as a sealing material in sodium sulfur battery. To understand and control the corrosion process, it is important to predict its quantitative properties. In this study, a first-principles calculation has been carried out to calculate its equilibrium lattice parameters, bulk modulus and pressure derivative of bulk modulus by both all-electron full-potential linear augmented plane wave scheme and pseudopotential plane wave scheme within the generalized gradient approximation. The theoretical results show good agreement with the available experimental data. The thermodynamic properties, including the specific heat capacity and entropy with pressure up to 9 GPa, have been investigated for the first time by coupling of density functional perturbation theory and quasiharmonic approximation. The volume and linear thermal expansion coefficients were estimated and the results show that the linear thermal expansion on c-axis is nearly twice as large as that on a-axis within the calculated temperature.

Radiation and propagation of electromagnetic waves

CERN Document Server

Tyras, George; Declaris, Nicholas

1969-01-01

Radiation and Propagation of Electromagnetic Waves serves as a text in electrical engineering or electrophysics. The book discusses the electromagnetic theory; plane electromagnetic waves in homogenous isotropic and anisotropic media; and plane electromagnetic waves in inhomogenous stratified media. The text also describes the spectral representation of elementary electromagnetic sources; the field of a dipole in a stratified medium; and radiation in anisotropic plasma. The properties and the procedures of Green's function method of solution, axial currents, as well as cylindrical boundaries a

Precursor Wave Emission Enhanced by Weibel Instability in Relativistic Shocks

Science.gov (United States)

Iwamoto, Masanori; Amano, Takanobu; Hoshino, Masahiro; Matsumoto, Yosuke

2018-05-01

We investigated the precursor wave emission efficiency in magnetized purely perpendicular relativistic shocks in pair plasmas. We extended our previous study to include the dependence of upstream magnetic field orientations. We performed two-dimensional particle-in-cell simulations and focused on two magnetic field orientations: the magnetic field in the simulation plane (i.e., in-plane configuration) and that perpendicular to the simulation plane (i.e., out-of-plane configuration). Our simulations in the in-plane configuration demonstrated that not only extraordinary but also ordinary mode waves are excited. We quantified the emission efficiency as a function of the magnetization parameter σ e and found that the large-amplitude precursor waves are emitted for a wide range of σ e . We found that especially at low σ e , the magnetic field generated by Weibel instability amplifies the ordinary mode wave power. The amplitude is large enough to perturb the upstream plasma, and transverse density filaments are generated as in the case of the out-of-plane configuration investigated in the previous study. We confirmed that our previous conclusion holds regardless of upstream magnetic field orientations with respect to the two-dimensional simulation plane. We discuss the precursor wave emission in three dimensions and the feasibility of wakefield acceleration in relativistic shocks based on our results.

Pixel-size-maintained image reconstruction of digital holograms on arbitrarily tilted planes by the angular spectrum method.

Science.gov (United States)

Jeong, Seung Jun; Hong, Chung Ki

2008-06-01

We present an effective method for the pixel-size-maintained reconstruction of images on arbitrarily tilted planes in digital holography. The method is based on the plane wave expansion of the diffraction wave fields and the three-axis rotation of the wave vectors. The images on the tilted planes are reconstructed without loss of the frequency contents of the hologram and have the same pixel sizes. Our method shows good results in the extreme cases of large tilting angles and in the region closer than the paraxial case. The effectiveness of the method is demonstrated by both simulation and experiment.

Basis set construction for molecular electronic structure theory: natural orbital and Gauss-Slater basis for smooth pseudopotentials.

Science.gov (United States)

Petruzielo, F R; Toulouse, Julien; Umrigar, C J

2011-02-14

A simple yet general method for constructing basis sets for molecular electronic structure calculations is presented. These basis sets consist of atomic natural orbitals from a multiconfigurational self-consistent field calculation supplemented with primitive functions, chosen such that the asymptotics are appropriate for the potential of the system. Primitives are optimized for the homonuclear diatomic molecule to produce a balanced basis set. Two general features that facilitate this basis construction are demonstrated. First, weak coupling exists between the optimal exponents of primitives with different angular momenta. Second, the optimal primitive exponents for a chosen system depend weakly on the particular level of theory employed for optimization. The explicit case considered here is a basis set appropriate for the Burkatzki-Filippi-Dolg pseudopotentials. Since these pseudopotentials are finite at nuclei and have a Coulomb tail, the recently proposed Gauss-Slater functions are the appropriate primitives. Double- and triple-zeta bases are developed for elements hydrogen through argon. These new bases offer significant gains over the corresponding Burkatzki-Filippi-Dolg bases at various levels of theory. Using a Gaussian expansion of the basis functions, these bases can be employed in any electronic structure method. Quantum Monte Carlo provides an added benefit: expansions are unnecessary since the integrals are evaluated numerically.

Wave-equation Migration Velocity Analysis Using Plane-wave Common Image Gathers

KAUST Repository

Guo, Bowen; Schuster, Gerard T.

2017-01-01

Wave-equation migration velocity analysis (WEMVA) based on subsurface-offset, angle domain or time-lag common image gathers (CIGs) requires significant computational and memory resources because it computes higher dimensional migration images

Characteristic wave fronts in magnetohydrodynamics

International Nuclear Information System (INIS)

Menon, V.V.; Sharma, V.D.

1981-01-01

The influence of magnetic field on the process of steepening or flattening of the characteristic wave fronts in a plane and cylindrically symmetric motion of an ideal plasma is investigated. This aspect of the problem has not been considered until now. Remarkable differences between plane, cylindrical diverging, and cylindrical converging waves are discovered. The discontinuity in the velocity gradient at the wave front is shown to satisfy a Bernoulli-type equation. The discussion of the solutions of such equations reported in the literature is shown to be incomplete, and three general theorems are established. 18 refs

Response of a Doppler canceling system to plane gravitational waves

International Nuclear Information System (INIS)

Caporali, A.

1982-01-01

This paper discusses the interaction of long periodic gravitational waves with a three-link microwave system known as the Doppler canceling system. This system, which was developed for gravitational red-shift experiment, uses one-way and two-way Doppler information to construct the beat signal of two reference oscillators moving with respect to each other. The geometric-optics approximation is used to derive the frequency shift produced on a light signal propagating in a gravitational-wave space-time. The signature left on the Doppler-canceled beat by bursts and continuous gravitational waves is analyzed. A comparison is made between the response to gravitational waves of the Doppler canceling system and that of a (NASA) Doppler tracking system which employs two-way, round-trip radio waves. A threefold repetition of the gravitational wave form is found to be a common feature of the response functions of both systems. These two functions otherwise exhibit interesting differences

Infragravity Waves Produced by Wave Groups on Beaches

Institute of Scientific and Technical Information of China (English)

邹志利; 常梅

2003-01-01

The generation of low frequency waves by a single or double wave groups incident upon two plane beaches with the slope of 1/40 and 1/100 is investigated experimentally and numerically. A new type of wave maker signal is used to generate the groups, allowing the bound long wave (set-down) to be included in the group. The experiments show that the low frequency wave is generated during breaking and propagation to the shoreline of the wave group. This process of generation and propagation of low frequency waves is simulated numerically by solving the short-wave averaged mass and momentum conservation equations. The computed and measured results are in good agreement. The mechanism of generation of low frequency waves in the surf zone is examined and discussed.

G4CEP: A G4 theory modification by including pseudopotential for molecules containing first-, second- and third-row representative elements

Energy Technology Data Exchange (ETDEWEB)

Silva, Cleuton de Souza [Instituto de Química, Universidade Estadual de Campinas, Barão Geraldo, P.O. Box 6154, 13083-970 Campinas, São Paulo (Brazil); Instituto de Ciências Exatas e Tecnologia, Universidade Federal do Amazonas, Campus de Itacoatiara, 69100-021 Itacoatiara, Amazonas (Brazil); Pereira, Douglas Henrique [Departamento de Ciências Exatas e Biotecnológicas, Universidade Federal do Tocantins, Campus de Gurupi, 77410-530 Gurupi, Tocantins (Brazil); Custodio, Rogério, E-mail: roger@iqm.unicamp.br [Instituto de Química, Universidade Estadual de Campinas, Barão Geraldo, P.O. Box 6154, 13083-970 Campinas, São Paulo (Brazil)

2016-05-28

The G4CEP composite method was developed from the respective G4 all-electron version by considering the implementation of compact effective pseudopotential (CEP). The G3/05 test set was used as reference to benchmark the adaptation by treating in this work atoms and compounds from the first and second periods of the periodic table, as well as representative elements of the third period, comprising 440 thermochemical data. G4CEP has not reached a so high level of accuracy as the G4 all-electron theory. G4CEP presented a mean absolute error around 1.09 kcal mol{sup −1}, while the original method presents a deviation corresponding to 0.83 kcal mol{sup −1}. The similarity of the optimized molecular geometries between G4 and G4CEP indicates that the core-electron effects and basis set adjustments may be pointed out as a significant factor responsible for the large discrepancies between the pseudopotential results and the experimental data, or even that the all-electron calculations are more efficient either in its formulation or in the cancellation of errors. When the G4CEP mean absolute error (1.09 kcal mol{sup −1}) is compared to 1.29 kcal mol{sup −1} from G3CEP, it does not seem so efficient. However, while the G3CEP uncertainty is ±4.06 kcal mol{sup −1}, the G4CEP deviation is ±2.72 kcal mol{sup −1}. Therefore, the G4CEP theory is considerably more reliable than any previous combination of composite theory and pseudopotential, particularly for enthalpies of formation and electron affinities.

Energy flow analysis of out-of-plane vibration in coplanar coupled finite Mindlin plates

Directory of Open Access Journals (Sweden)

Young-Ho Park

2015-01-01

Full Text Available : In this paper, an Energy Flow Analysis (EFA for coplanar coupled Mindlin plates was performed to estimate their dynamic responses at high frequencies. Mindlin plate theory can consider the effects of shear distortion and rotatory inertia, which are very important at high frequencies. For EFA for coplanar coupled Mindlin plates, the wave transmission and reflection relationship for progressing out-of-plane waves (out-of-plane shear wave, bending dominant flexural wave, and shear dominant flexural wave in coplanar coupled Mindlin plates was newly derived. To verify the validity of the EFA results, numerical analyses were performed for various cases where coplanar coupled Mindlin plates are excited by a harmonic point force, and the energy flow solutions for coplanar coupled Mindlin plates were compared with the classical solutions in the various conditions.

Helicons in uniform fields. I. Wave diagnostics with hodograms

Science.gov (United States)

Urrutia, J. M.; Stenzel, R. L.

2018-03-01

The wave equation for whistler waves is well known and has been solved in Cartesian and cylindrical coordinates, yielding plane waves and cylindrical waves. In space plasmas, waves are usually assumed to be plane waves; in small laboratory plasmas, they are often assumed to be cylindrical "helicon" eigenmodes. Experimental observations fall in between both models. Real waves are usually bounded and may rotate like helicons. Such helicons are studied experimentally in a large laboratory plasma which is essentially a uniform, unbounded plasma. The waves are excited by loop antennas whose properties determine the field rotation and transverse dimensions. Both m = 0 and m = 1 helicon modes are produced and analyzed by measuring the wave magnetic field in three dimensional space and time. From Ampère's law and Ohm's law, the current density and electric field vectors are obtained. Hodograms for these vectors are produced. The sign ambiguity of the hodogram normal with respect to the direction of wave propagation is demonstrated. In general, electric and magnetic hodograms differ but both together yield the wave vector direction unambiguously. Vector fields of the hodogram normal yield the phase flow including phase rotation for helicons. Some helicons can have locally a linear polarization which is identified by the hodogram ellipticity. Alternatively the amplitude oscillation in time yields a measure for the wave polarization. It is shown that wave interference produces linear polarization. These observations emphasize that single point hodogram measurements are inadequate to determine the wave topology unless assuming plane waves. Observations of linear polarization indicate wave packets but not plane waves. A simple qualitative diagnostics for the wave polarization is the measurement of the magnetic field magnitude in time. Circular polarization has a constant amplitude; linear polarization results in amplitude modulations.

Evaluation of uterine peristalsis using cine MRI on the coronal plane in comparison with the sagittal plane.

Science.gov (United States)

Shitano, Fuki; Kido, Aki; Kataoka, Masako; Fujimoto, Koji; Kiguchi, Kayo; Fushimi, Yasutaka; Togashi, Kaori

2016-01-01

Uterine peristalsis is supposed to be closely related to the early stages of reproduction. Sperms are preferentially transported from the uterine cervix to the side of the tube with the dominant follicle. However, with respect to magnetic resonance imaging (MRI), uterine peristalsis has only been evaluated at the sagittal plane of cine MRI. To evaluate and compare uterine peristalsis both on sagittal and coronal planes using cine MRI. Internal ethics committee approval was obtained, and subjects provided informed written consent. Thirty-one women underwent MRI scans in the periovulatory phase of the menstrual cycle. Cine MR images obtained by fast advanced spin echo sequence at 3-T field strength magnet (Toshiba Medical Systems) were visually evaluated by two independent radiologists. The frequency and the direction of peristalsis, and the presence of outer myometrium conduction of signal intensities (OMC), were evaluated. The laterality of the dominant follicle was determined on axial images and compared with the peristaltic direction in fundus. The subjects in which peristaltic directions were more clearly recognized were significantly frequent in coronal planes than in sagittal planes (P < 0.05). There was no significant difference in the peristaltic frequency between the sagittal and the coronal plane. However, the OMC was more recognized in the coronal plane than in the sagittal plane (P < 0.05). Peristaltic waves conducted toward the possible ovulation side were observed in only three of the 10 subjects. OMC of uterine peristalsis was better demonstrated in the coronal plane compared to the sagittal plane. © The Foundation Acta Radiologica 2015.

Propagation of Quasi-plane Nonlinear Waves in Tubes

Directory of Open Access Journals (Sweden)

P. Koníček

2002-01-01

Full Text Available This paper deals with possibilities of using the generalized Burgers equation and the KZK equation to describe nonlinear waves in circular ducts. A new method for calculating of diffraction effects taking into account boundary layer effects is described. The results of numerical solutions of the model equations are compared. Finally, the limits of validity of the used model equations are discussed with respect to boundary conditions and the radius of the circular duct. The limits of applicability of the KZK equation and the GBE equation for describing nonlinear waves in tubes are discussed.

Noise characteristics analysis of short wave infrared InGaAs focal plane arrays

Science.gov (United States)

Yu, Chunlei; Li, Xue; Yang, Bo; Huang, Songlei; Shao, Xiumei; Zhang, Yaguang; Gong, Haimei

2017-09-01

The increasing application of InGaAs short wave infrared (SWIR) focal plane arrays (FPAs) in low light level imaging requires ultra-low noise FPAs. This paper presents the theoretical analysis of FPA noise, and point out that both dark current and detector capacitance strongly affect the FPA noise. The impact of dark current and detector capacitance on FPA noise is compared in different situations. In order to obtain low noise performance FPAs, the demand for reducing detector capacitance is higher especially when pixel pitch is smaller, integration time is shorter, and integration capacitance is larger. Several InGaAs FPAs were measured and analyzed, the experiments' results could be well fitted to the calculated results. The study found that the major contributor of FPA noise is coupled noise with shorter integration time. The influence of detector capacitance on FPA noise is more significant than that of dark current. To investigate the effect of detector performance on FPA noise, two kinds of photodiodes with different concentration of the absorption layer were fabricated. The detectors' performance and noise characteristics were measured and analyzed, the results are consistent with that of theoretical analysis.

Beam Dynamics a Integrated Plane Wave Transformer Photoinjector at S- and X- band

Science.gov (United States)

Rosenzweig, J. B.; Ding, X.; Pellegrini, X.; Serafini, L.; Yu, D.

1997-05-01

The beam dynamics of an integrated S-band rf photoinjector based on the plane wave transformer concept, proposed as part of an SBIR collaboration between UCLA and DULY Research, are studied. The intial design, which calls for an 11.5 cell structure run at a peak on-axis accelerating field of 60 MV/m, and has a compact solenoid around the intial 2.5 cells, is based on the recently developed theory of emittance compensation(L.Serafini, and J.B. Rosenzweig, submitted to Physical Review E.). It calls for matching the beam onto an envelope which is a generalized Brillouin flow, producing a beam which diminishes in transverse size as the square root of the accelerating beam energy. This condition produces a minimized emittance, which for the S-band case is 1 mm-rad at at charge of 1 nC. This design is also scaled to produce nearly identical performance at X-band, giving an injector appropriate to running an FEL at the SLAC NLCTA. It is noted that these designs are insensitive to rf emittance increase, allowign a choice of injection phase, and the option to compress the emitted pulse.

Structural electronic and mechanical properties of YM2 (M=Mn, Fe, Co) laves phase compounds: First principle calculations analyzed with datamining approach

Science.gov (United States)

Saidi, F.; Sebaa, N.; Mahmoudi, A.; Aourag, H.; Merad, G.; Dergal, M.

2018-06-01

We performed first-principle calculations to investigate structural, phase stability, electronic and mechanical properties for the Laves phases YM2 (M = Mn, Fe, Co) with C15, C14 and C36 structures. We used the density functional theory within the framework of both pseudo-potentials and plane wave basis using VASP (Vienna Ab Initio Software Package). The calculated equilibrium structural parameters are in accordance with available theoretical values. Mechanical properties were calculated, discussed, and analyzed with data mining approach in terms of structure stability. The results reveal that YCo2 is harder than YFe2 and YMn2.

First Principles Simulation of a Ceramic/ Metal Interface with Misfit

International Nuclear Information System (INIS)

Benedek, R.; Alavi, A.; Seidman, D. N.; Yang, L. H.; Muller, D. A.; Woodward, C.

2000-01-01

The relaxed atomic structure of a model ceramic/metal interface, {222}MgO/Cu , is simulated, including lattice constant mismatch, using first principles local-density functional theory plane wave pseudopotential methods. The 399-atom computational unit cell contains 36 O and 49 Cu atoms per layer in accordance with the 7/6 ratio of MgO to Cu lattice constants. The atomic layers on both sides of the interface warp to optimize the local bonding. The interface adhesive energy is calculated. The interface electronic structure is found to vary appreciably with the local environment. (c) 2000 The American Physical Society

Forecast of Piezoelectric Properties of Crystalline Materials from First Principles Calculation

International Nuclear Information System (INIS)

Zheng Yanqing; Shi Erwei; Chen Jianjun; Zhang Tao; Song Lixin

2006-01-01

In this paper, forecast of piezoelectric tensors are presented. Piezo crystals including quartz, quartz-like crystals, known and novel crystals of langasite-type structure are treated with density-functional perturb theory (DFPT) using plane-wave pseudopotentials method, within the local density approximation (LDA) to the exchange-correlation functional. Compared with experimental results, the ab initio calculation results have quantitative or semi-quantitative accuracy. It is shown that first principles calculation opens a door to the search and design of new piezoelectric material. Further application of first principles calculation to forecast the whole piezoelectric properties are also discussed

The Electronic and Optical Properties of Au Doped Single-Layer Phosphorene

Science.gov (United States)

Zhu, Ziqing; Chen, Changpeng; Liu, Jiayi; Han, Lu

2018-01-01

The electronic properties and optical properties of single and double Au-doped phosphorene have been comparatively investigated using the first-principles plane-wave pseudopotential method based on density functional theory. The decrease from direct band gap 0.78 eV to indirect band gap 0.22 and 0.11 eV are observed in the single and double Au-doped phosphorene, respectively. The red shifts of absorbing edge occur in both doped systems, which consequently enhance the absorbing of infrared light in phosphorene. Band gap engineering can, therefore, be used to directly tune the optical absorption of phosphorene system by substitutional Au doping.

Quartic scaling MP2 for solids: A highly parallelized algorithm in the plane wave basis

Science.gov (United States)

Schäfer, Tobias; Ramberger, Benjamin; Kresse, Georg

2017-03-01

We present a low-complexity algorithm to calculate the correlation energy of periodic systems in second-order Møller-Plesset (MP2) perturbation theory. In contrast to previous approximation-free MP2 codes, our implementation possesses a quartic scaling, O ( N 4 ) , with respect to the system size N and offers an almost ideal parallelization efficiency. The general issue that the correlation energy converges slowly with the number of basis functions is eased by an internal basis set extrapolation. The key concept to reduce the scaling is to eliminate all summations over virtual orbitals which can be elegantly achieved in the Laplace transformed MP2 formulation using plane wave basis sets and fast Fourier transforms. Analogously, this approach could allow us to calculate second order screened exchange as well as particle-hole ladder diagrams with a similar low complexity. Hence, the presented method can be considered as a step towards systematically improved correlation energies.

Acoustically mediated long-range interaction among multiple spherical particles exposed to a plane standing wave

International Nuclear Information System (INIS)

Zhang, Shenwei; Qiu, Chunyin; Wang, Mudi; Ke, Manzhu; Liu, Zhengyou

2016-01-01

In this work, we study the acoustically mediated interaction forces among multiple well-separated spherical particles trapped in the same node or antinode plane of a standing wave. An analytical expression of the acoustic interaction force is derived, which is accurate even for the particles beyond the Rayleigh limit. Interestingly, the multi-particle system can be decomposed into a series of independent two-particle systems described by pairwise interactions. Each pairwise interaction is a long-range interaction, as characterized by a soft oscillatory attenuation (at the power exponent of n  = −1 or −2). The vector additivity of the acoustic interaction force, which is not well expected considering the nonlinear nature of the acoustic radiation force, is greatly useful for exploring a system consisting of a large number of particles. The capability of self-organizing a big particle cluster can be anticipated through such acoustically controllable long-range interaction. (paper)

On AdS/CFT correspondence beyond SUGRA: plane waves, free CFTs and double-trace deformations

Energy Technology Data Exchange (ETDEWEB)

Diaz Vazquez, D.E.

2007-09-13

This thesis deals with three corners of the AdS/CFT Correspondence that lie one step beyond the classical supergravity (SUGRA) approximation. We first explore the BMN limit of the duality and study, in particular, the behavior of field theoretic propagators in the corresponding Penrose limit. We unravel the semiclassical (WKB-) exactness of the propagators in the resulting plane wave background metric. Then, we address the limit of vanishing coupling of the conformal field theory (CFT) at large N. In the simplified scenario of Higher Spin/O(N) Vector Model duality, the conformal partial wave (CPW) expansion of scalar four-point functions are reorganized to make them suggestive of a bulk interpretation in term of a consistent truncated massless higher spin theory and their corresponding exchange Witten graphs. We also explore the connection to the interacting O(N) Vector Model at its infra-red fixed point, at leading large N. Finally, coming back to the gauge theory, we study the effect of a relevant double-trace deformations of the boundary CFT on the partition function and its dual bulk interpretation. We show how the one-loop computation in the Anti-de Sitter (AdS) space correctly reproduces the partition function and conformal anomaly of the boundary theory. In all, we get a clean test of the duality beyond the classical SUGRA approximation in the AdS bulk and at the corresponding next-to-leading 1/N order of the CFT at the conformal boundary. (orig.)

On AdS/CFT correspondence beyond SUGRA: plane waves, free CFTs and double-trace deformations

International Nuclear Information System (INIS)

Diaz Vazquez, D.E.

2007-01-01

This thesis deals with three corners of the AdS/CFT Correspondence that lie one step beyond the classical supergravity (SUGRA) approximation. We first explore the BMN limit of the duality and study, in particular, the behavior of field theoretic propagators in the corresponding Penrose limit. We unravel the semiclassical (WKB-) exactness of the propagators in the resulting plane wave background metric. Then, we address the limit of vanishing coupling of the conformal field theory (CFT) at large N. In the simplified scenario of Higher Spin/O(N) Vector Model duality, the conformal partial wave (CPW) expansion of scalar four-point functions are reorganized to make them suggestive of a bulk interpretation in term of a consistent truncated massless higher spin theory and their corresponding exchange Witten graphs. We also explore the connection to the interacting O(N) Vector Model at its infra-red fixed point, at leading large N. Finally, coming back to the gauge theory, we study the effect of a relevant double-trace deformations of the boundary CFT on the partition function and its dual bulk interpretation. We show how the one-loop computation in the Anti-de Sitter (AdS) space correctly reproduces the partition function and conformal anomaly of the boundary theory. In all, we get a clean test of the duality beyond the classical SUGRA approximation in the AdS bulk and at the corresponding next-to-leading 1/N order of the CFT at the conformal boundary. (orig.)

Pseudopotential description of rare earths in oxides: The case of Er2Si2O7

DEFF Research Database (Denmark)

Lægsgaard, Jesper; Stokbro, Kurt

2001-01-01

The applicability of ultrasoft pseudopotentials to the problem of rare-earth incorporation in silicates is investigated using the compound Er2Si2O7 as a test case. It is found that density-functional theory within the generalized gradient approximation provides a good description of the structural...... parameters, when treating the Er 4f states as a partially occupied core shell. The density of states and the distribution of electronic charge are analyzed, and it is concluded that the presence of Er tends to increase the covalency of neighboring Si-O bonds....

FDTD method for computing the off-plane band structure in a two-dimensional photonic crystal consisting of nearly free-electron metals

Energy Technology Data Exchange (ETDEWEB)

Xiao Sanshui; He Sailing

2002-12-01

An FDTD numerical method for computing the off-plane band structure of a two-dimensional photonic crystal consisting of nearly free-electron metals is presented. The method requires only a two-dimensional discretization mesh for a given off-plane wave number k{sub z} although the off-plane propagation is a three-dimensional problem. The off-plane band structures of a square lattice of metallic rods with the high-frequency metallic model in the air are studied, and a complete band gap for some nonzero off-plane wave number k{sub z} is founded.

FDTD method for computing the off-plane band structure in a two-dimensional photonic crystal consisting of nearly free-electron metals

International Nuclear Information System (INIS)

Xiao Sanshui; He Sailing

2002-01-01

An FDTD numerical method for computing the off-plane band structure of a two-dimensional photonic crystal consisting of nearly free-electron metals is presented. The method requires only a two-dimensional discretization mesh for a given off-plane wave number k z although the off-plane propagation is a three-dimensional problem. The off-plane band structures of a square lattice of metallic rods with the high-frequency metallic model in the air are studied, and a complete band gap for some nonzero off-plane wave number k z is founded

Nonlinear ion acoustic waves in a quantum degenerate warm plasma with dust grains

International Nuclear Information System (INIS)

Dubinov, A. E.; Kolotkov, D. Yu.; Sazonkin, M. A.

2011-01-01

A study is made of the propagation of ion acoustic waves in a collisionless unmagnetized dusty plasma containing degenerate ion and electron gases at nonzero temperatures. In linear theory, a dispersion relation for isothermal ion acoustic waves is derived and an exact expression for the linear ion acoustic velocity is obtained. The dependence of the linear ion acoustic velocity on the dust density in a plasma is calculated. An analysis of the dispersion relation reveals parameter ranges in which the problem has soliton solutions. In nonlinear theory, an exact solution to the basic equations is found and examined. The analysis is carried out by Bernoulli’s pseudopotential method. The ranges of the phase velocities of periodic ion acoustic waves and the velocities of solitons are determined. It is shown that these ranges do not overlap and that the soliton velocity cannot be lower than the linear ion acoustic velocity. The profiles of the physical quantities in a periodic wave and in a soliton are evaluated, as well as the dependence of the critical velocity of solitons on the dust density in a plasma.

Large eddy simulation of breaking waves

DEFF Research Database (Denmark)

Christensen, Erik Damgaard; Deigaard, Rolf

2001-01-01

A numerical model is used to simulate wave breaking, the large scale water motions and turbulence induced by the breaking process. The model consists of a free surface model using the surface markers method combined with a three-dimensional model that solves the flow equations. The turbulence....... The incoming waves are specified by a flux boundary condition. The waves are approaching in the shore-normal direction and are breaking on a plane, constant slope beach. The first few wave periods are simulated by a two-dimensional model in the vertical plane normal to the beach line. The model describes...... the steepening and the overturning of the wave. At a given instant, the model domain is extended to three dimensions, and the two-dimensional flow field develops spontaneously three-dimensional flow features with turbulent eddies. After a few wave periods, stationary (periodic) conditions are achieved...

Three-wave interaction in two-component quadratic nonlinear lattices

DEFF Research Database (Denmark)

Konotop, V. V.; Cunha, M. D.; Christiansen, Peter Leth

1999-01-01

We investigate a two-component lattice with a quadratic nonlinearity and find with the multiple scale technique that integrable three-wave interaction takes place between plane wave solutions when these fulfill resonance conditions. We demonstrate that. energy conversion and pulse propagation known...... from three-wave interaction is reproduced in the lattice and that exact phase matching of parametric processes can be obtained in non-phase-matched lattices by tilting the interacting plane waves with respect to each other. [S1063-651X(99)15110-9]....

The effect of finite-difference time-domain resolution and power-loss computation method on SAR values in plane-wave exposure of Zubal phantom

International Nuclear Information System (INIS)

Uusitupa, T M; Ilvonen, S A; Laakso, I M; Nikoskinen, K I

2008-01-01

In this paper, the anatomically realistic body model Zubal is exposed to a plane wave. A finite-difference time-domain (FDTD) method is used to obtain field data for specific-absorption-rate (SAR) computation. It is investigated how the FDTD resolution, power-loss computation method and positioning of the material voxels in the FDTD grid affect the SAR results. The results enable one to estimate the effects due to certain fundamental choices made in the SAR simulation

Performance evaluation of compounding and directional beamforming techniques for carotid strain imaging using plane wave transmissions

DEFF Research Database (Denmark)

Hansen, Hendrik H.G.; Stuart, Matthias Bo; Villagómez Hoyos, Carlos Armando

2014-01-01

Carotid strain imaging in 3D is not possible with conventional focused imaging, because the frame rate is too low. Plane wave ultrasound provides sufficiently high frame rates, albeit at t he cost of image quality, especially in the off - axis direction due to the lack of focusing . Multiple...... techniques have been developed to cope with the low off - axis image quality when performing 2D (and in future 3D) motion estimation: cross correlation with directional beamforming (with or without RF (coherent) compounding) and displacement compounding. This study compares the precision of these techniques...... with RF compounding and 2D displacement compounding with θ = ~20 ° per formed equally and best with a relative root - mean - squared error of ~2% with respect to the analytical solution . The mean and standard deviation of the estimated motion direction for 2D displacement compounding with θ = 20 ° was 0...

Acceleration waves in non-ideal magnetogasdynamics

Directory of Open Access Journals (Sweden)

R. Singh

2014-03-01

Full Text Available The problem of propagation of acceleration waves in an unsteady inviscid non-ideal gas under the influence of magnetic field is investigated. The characteristic solution to the problem in the neighbourhood of leading characteristics has been determined. An evolution equation governing the behaviour of acceleration waves has been derived. It is shown that a linear solution in the characteristic plane exhibits non-linear behaviour in physical plane. The effect of magnetic field on the formation of shock in non-ideal gas flow with planar and cylindrical symmetry is analysed. It is noticed that all compressive waves terminate into a shock wave. Further, we also compare/contrast the nature of solution in ideal and non-ideal magnetogasdynamic regime.

Correlations in quantum systems and branch points in the complex plane

OpenAIRE

Rotter, I.

2001-01-01

Branch points in the complex plane are responsible for avoided level crossings in closed and open quantum systems. They create not only an exchange of the wave functions but also a mixing of the states of a quantum system at high level density. The influence of branch points in the complex plane on the low-lying states of the system is small.

Kinematics and dynamics of green water on a fixed platform in a large wave basin in focusing wave and random wave conditions

Science.gov (United States)

Chuang, Wei-Liang; Chang, Kuang-An; Mercier, Richard

2018-06-01

Green water kinematics and dynamics due to wave impingements on a simplified geometry, fixed platform were experimentally investigated in a large, deep-water wave basin. Both plane focusing waves and random waves were employed in the generation of green water. The focusing wave condition was designed to create two consecutive plunging breaking waves with one impinging on the frontal vertical wall of the fixed platform, referred as wall impingement, and the other directly impinging on the deck surface, referred as deck impingement. The random wave condition was generated using the JONSWAP spectrum with a significant wave height approximately equal to the freeboard. A total of 179 green water events were collected in the random wave condition. By examining the green water events in random waves, three different flow types are categorized: collapse of overtopping wave, fall of bulk water, and breaking wave crest. The aerated flow velocity was measured using bubble image velocimetry, while the void fraction was measured using fiber optic reflectometry. For the plane focusing wave condition, measurements of impact pressure were synchronized with the flow velocity and void fraction measurements. The relationship between the peak pressures and the pressure rise times is examined. For the high-intensity impact in the deck impingement events, the peak pressures are observed to be proportional to the aeration levels. The maximum horizontal velocities in the green water events in random waves are well represented by the lognormal distribution. Ritter's solution is shown to quantitatively describe the green water velocity distributions under both the focusing wave condition and the random wave condition. A prediction equation for green water velocity distribution under random waves is proposed.

Calculations of electronic structure of UF6 molecule and crystal UO2 with relativistic pseudopotential

International Nuclear Information System (INIS)

Ehvarestov, R.A.; Panin, A.I.; Bandura, A.V.

2008-01-01

Account of relativistic effects on the properties of uranium hexafluoride is testified. Detailed comparison of single electron energies spectrum revealed in nonrelativistic (by Hartree-Fock method), relativistic (by Dirac-Fock method), and scalar-relativistic (using relativistic potential of atomic uranium frame) has been conducted. Optimization procedures of atomic basis in LCAO calculations of molecules and crystals permissive taking into account distortion of atomic orbitals when chemical bonding are discussed, and optimization effect of atomic basis on the results of scalar-relativistic calculations of UF 6 molecule properties is analyzed. Calculations of electronic structure and properties of UO 2 crystal having relativistic and nonrelativistic pseudopotentials have been realized [ru

High Intensity Compton Scattering in a strong plane wave field of general form

International Nuclear Information System (INIS)

Hartin, A.; Moortgat-Pick, G.; Hamburg Univ.

2011-06-01

Photon emission by an electron embedded in a strong external field of general form is studied theoretically. The external field considered is a plane wave electromagnetic field of any number of components, period and polarisation. Exact, Volkov solutions of the Dirac equation with the 4-potential of the general external field are obtained. The photon emission is considered in the usual perturbation theory using the Volkov solutions to represent the electron. An expression for the transition probability of this process is obtained after the usual spin and polarisation sums, trace calculation and phase space integration. The final transition probability in the general case contains a single sum over contributions from external field photons, an integration over one of the phase space components and the Fourier transforms of the Volkov phases. The validity of the general expression is established by considering specific external fields. Known specific analytic forms of the transition probability are obtained after substitution of the 4-potential for a circularly polarised and constant crossed external field. As an example usage of the general result for the transition probability, the case of two circularly polarised external fields separated by a phase difference is studied both analytically and numerically. (orig.)

High Intensity Compton Scattering in a strong plane wave field of general form

Energy Technology Data Exchange (ETDEWEB)

Hartin, A. [Deutsches Elektronen-Synchrotron (DESY), Hamburg (Germany); Moortgat-Pick, G. [Deutsches Elektronen-Synchrotron (DESY), Hamburg (Germany); Hamburg Univ. (Germany). 2. Inst. fuer Theoretische Physik

2011-06-15

Photon emission by an electron embedded in a strong external field of general form is studied theoretically. The external field considered is a plane wave electromagnetic field of any number of components, period and polarisation. Exact, Volkov solutions of the Dirac equation with the 4-potential of the general external field are obtained. The photon emission is considered in the usual perturbation theory using the Volkov solutions to represent the electron. An expression for the transition probability of this process is obtained after the usual spin and polarisation sums, trace calculation and phase space integration. The final transition probability in the general case contains a single sum over contributions from external field photons, an integration over one of the phase space components and the Fourier transforms of the Volkov phases. The validity of the general expression is established by considering specific external fields. Known specific analytic forms of the transition probability are obtained after substitution of the 4-potential for a circularly polarised and constant crossed external field. As an example usage of the general result for the transition probability, the case of two circularly polarised external fields separated by a phase difference is studied both analytically and numerically. (orig.)

Explaining Electromagnetic Plane Waves in a Vacuum at the Introductory Level

Science.gov (United States)

Allred, Clark L.; Della-Rose, Devin J.; Flusche, Brian M.; Kiziah, Rex R.; Lee, David J.

2010-01-01

A typical introduction to electromagnetic waves in vacuum is illustrated by the following quote from an introductory physics text: "Maxwell's equations predict that an electromagnetic wave consists of oscillating electric and magnetic fields. The changing fields induce each other, which maintains the propagation of the wave; a changing electric…

The application of digital image plane holography technology to identify Chinese herbal medicine

Science.gov (United States)

Wang, Huaying; Guo, Zhongjia; Liao, Wei; Zhang, Zhihui

2012-03-01

In this paper, the imaging technology of digital image plane holography to identify the Chinese herbal medicine is studied. The optical experiment system of digital image plane holography which is the special case of pre-magnification digital holography was built. In the record system, one is an object light by using plane waves which illuminates the object, and the other one is recording hologram by using spherical light wave as reference light. There is a Micro objective lens behind the object. The second phase factor which caus ed by the Micro objective lens can be eliminated by choosing the proper position of the reference point source when digital image plane holography is recorded by spherical light. In this experiment, we use the Lygodium cells and Onion cells as the object. The experiment results with Lygodium cells and Onion cells show that digital image plane holography avoid the process of finding recording distance by using auto-focusing approach, and the phase information of the object can be reconstructed more accurately. The digital image plane holography is applied to the microscopic imaging of cells more effectively, and it is suit to apply for the identify of Chinese Herbal Medicine. And it promotes the application of digital holographic in practice.

Advanced capabilities for materials modelling with Quantum ESPRESSO

Science.gov (United States)

Giannozzi, P.; Andreussi, O.; Brumme, T.; Bunau, O.; Buongiorno Nardelli, M.; Calandra, M.; Car, R.; Cavazzoni, C.; Ceresoli, D.; Cococcioni, M.; Colonna, N.; Carnimeo, I.; Dal Corso, A.; de Gironcoli, S.; Delugas, P.; DiStasio, R. A., Jr.; Ferretti, A.; Floris, A.; Fratesi, G.; Fugallo, G.; Gebauer, R.; Gerstmann, U.; Giustino, F.; Gorni, T.; Jia, J.; Kawamura, M.; Ko, H.-Y.; Kokalj, A.; Küçükbenli, E.; Lazzeri, M.; Marsili, M.; Marzari, N.; Mauri, F.; Nguyen, N. L.; Nguyen, H.-V.; Otero-de-la-Roza, A.; Paulatto, L.; Poncé, S.; Rocca, D.; Sabatini, R.; Santra, B.; Schlipf, M.; Seitsonen, A. P.; Smogunov, A.; Timrov, I.; Thonhauser, T.; Umari, P.; Vast, N.; Wu, X.; Baroni, S.

2017-11-01

Quantum EXPRESSO is an integrated suite of open-source computer codes for quantum simulations of materials using state-of-the-art electronic-structure techniques, based on density-functional theory, density-functional perturbation theory, and many-body perturbation theory, within the plane-wave pseudopotential and projector-augmented-wave approaches. Quantum EXPRESSO owes its popularity to the wide variety of properties and processes it allows to simulate, to its performance on an increasingly broad array of hardware architectures, and to a community of researchers that rely on its capabilities as a core open-source development platform to implement their ideas. In this paper we describe recent extensions and improvements, covering new methodologies and property calculators, improved parallelization, code modularization, and extended interoperability both within the distribution and with external software.

Advanced capabilities for materials modelling with Quantum ESPRESSO.

Science.gov (United States)

Andreussi, Oliviero; Brumme, Thomas; Bunau, Oana; Buongiorno Nardelli, Marco; Calandra, Matteo; Car, Roberto; Cavazzoni, Carlo; Ceresoli, Davide; Cococcioni, Matteo; Colonna, Nicola; Carnimeo, Ivan; Dal Corso, Andrea; de Gironcoli, Stefano; Delugas, Pietro; DiStasio, Robert; Ferretti, Andrea; Floris, Andrea; Fratesi, Guido; Fugallo, Giorgia; Gebauer, Ralph; Gerstmann, Uwe; Giustino, Feliciano; Gorni, Tommaso; Jia, Junteng; Kawamura, Mitsuaki; Ko, Hsin-Yu; Kokalj, Anton; Küçükbenli, Emine; Lazzeri, Michele; Marsili, Margherita; Marzari, Nicola; Mauri, Francesco; Nguyen, Ngoc Linh; Nguyen, Huy-Viet; Otero-de-la-Roza, Alberto; Paulatto, Lorenzo; Poncé, Samuel; Giannozzi, Paolo; Rocca, Dario; Sabatini, Riccardo; Santra, Biswajit; Schlipf, Martin; Seitsonen, Ari Paavo; Smogunov, Alexander; Timrov, Iurii; Thonhauser, Timo; Umari, Paolo; Vast, Nathalie; Wu, Xifan; Baroni, Stefano

2017-09-27

Quantum ESPRESSO is an integrated suite of open-source computer codes for quantum simulations of materials using state-of-the art electronic-structure techniques, based on density-functional theory, density-functional perturbation theory, and many-body perturbation theory, within the plane-wave pseudo-potential and projector-augmented-wave approaches. Quantum ESPRESSO owes its popularity to the wide variety of properties and processes it allows to simulate, to its performance on an increasingly broad array of hardware architectures, and to a community of researchers that rely on its capabilities as a core open-source development platform to implement theirs ideas. In this paper we describe recent extensions and improvements, covering new methodologies and property calculators, improved parallelization, code modularization, and extended interoperability both within the distribution and with external software. © 2017 IOP Publishing Ltd.

Temperature dependence of the short-range order parameter and the concentration dependence of the order disorder temperature for Ni-Pt and Ni-Fe systems in the improved statistical pseudopotential approximation

International Nuclear Information System (INIS)

Khwaja, F.A.

1980-08-01

The calculations for the temperature dependence of the first shell short-range order (SRO) parameter for Ni 3 Fe using the cubic approximation of Tahir Kheli, and the concentration dependence of order-disorder temperature Tsub(c) for Ni-Fe and Ni-Pt systems using the linear approximation, have been carried out in the framework of pseudopotential theory. It is shown that the cubic approximation yields a good agreement between the theoretical prediction of the α 1 and the experimental data. Results for the concentration dependence of the Tsub(c) show that improvements in the statistical pseudo-potential approach are essential to achieve a good agreement with experiment. (author)

Study of the atomic ordering in the alloys Ni-Ir using diffuse X-ray scattering and pseudopotentials

International Nuclear Information System (INIS)

Abbas, T.

1982-06-01

Experiments were performed on the Ni-Ir alloys to measure the diffuse X-ray scattering intensity after annealing from high temperatures. It was established that the short-range order exists in these alloys when the samples are quenched from 1200 0 C and 1400 0 C. The ordering potentials for various concentrations of Ir in Ni were calculated using the pseudopotentials of Animalu. The method of incorporating the d electrons in the dielectric screening function was proposed. It was shown that the ordering potential is severely affected by the new type of screening. (author)

Quasiparticle semiconductor band structures including spin-orbit interactions.

Science.gov (United States)

Malone, Brad D; Cohen, Marvin L

2013-03-13

We present first-principles calculations of the quasiparticle band structure of the group IV materials Si and Ge and the group III-V compound semiconductors AlP, AlAs, AlSb, InP, InAs, InSb, GaP, GaAs and GaSb. Calculations are performed using the plane wave pseudopotential method and the 'one-shot' GW method, i.e. G(0)W(0). Quasiparticle band structures, augmented with the effects of spin-orbit, are obtained via a Wannier interpolation of the obtained quasiparticle energies and calculated spin-orbit matrix. Our calculations explicitly treat the shallow semicore states of In and Ga, which are known to be important in the description of the electronic properties, as valence states in the quasiparticle calculation. Our calculated quasiparticle energies, combining both the ab initio evaluation of the electron self-energy and the vector part of the pseudopotential representing the spin-orbit effects, are in generally very good agreement with experimental values. These calculations illustrate the predictive power of the methodology as applied to group IV and III-V semiconductors.

Deltons, peakons and other traveling-wave solutions of a Camassa-Holm hierarchy

International Nuclear Information System (INIS)

Peng Xiaochun; Dai Huihui

2009-01-01

In this letter, we study an integrable Camassa-Holm hierarchy whose high-frequency limit is the Camassa-Holm equation. Phase plane analysis is employed to investigate bounded traveling wave solutions. An important feature is that there exists a singular line on the phase plane. By considering the properties of the equilibrium points and the relative position of the singular line, we find that there are in total three types of phase planes. Those paths in phase planes which represented bounded solutions are discussed one-by-one. Besides solitary, peaked and periodic waves, the equations are shown to admit a new type of traveling waves, which concentrate all their energy in one point, and we name them deltons as they can be expressed as some constant multiplied by a delta function. There also exists a type of traveling waves we name periodic deltons, which concentrate their energy in periodic points. The explicit expressions for them and all the other traveling waves are given.

Mobile Ultrasound Plane Wave Beamforming on iPhone or iPad using Metal- based GPU Processing

Science.gov (United States)

Hewener, Holger J.; Tretbar, Steffen H.

Mobile and cost effective ultrasound devices are being used in point of care scenarios or the drama room. To reduce the costs of such devices we already presented the possibilities of consumer devices like the Apple iPad for full signal processing of raw data for ultrasound image generation. Using technologies like plane wave imaging to generate a full image with only one excitation/reception event the acquisition times and power consumption of ultrasound imaging can be reduced for low power mobile devices based on consumer electronics realizing the transition from FPGA or ASIC based beamforming into more flexible software beamforming. The massive parallel beamforming processing can be done with the Apple framework "Metal" for advanced graphics and general purpose GPU processing for the iOS platform. We were able to integrate the beamforming reconstruction into our mobile ultrasound processing application with imaging rates up to 70 Hz on iPad Air 2 hardware.

Accuracy and Precision of a Plane Wave Vector Flow Imaging Method in the Healthy Carotid Artery

DEFF Research Database (Denmark)

Jensen, Jonas; Villagómez Hoyos, Carlos Armando; Traberg, Marie Sand

2018-01-01

The objective of the study described here was to investigate the accuracy and precision of a plane wave 2-D vector flow imaging (VFI) method in laminar and complex blood flow conditions in the healthy carotid artery. The approach was to study (i) the accuracy for complex flow by comparing...... of laminar flow in vivo. The precision in vivo was calculated as the mean standard deviation (SD) of estimates aligned to the heart cycle and was highest in the center of the common carotid artery (SD = 3.6% for velocity magnitudes and 4.5° for angles) and lowest in the external branch and for vortices (SD...... the velocity field from a computational fluid dynamics (CFD) simulation to VFI estimates obtained from the scan of an anthropomorphic flow phantom and from an in vivo scan; (ii) the accuracy for laminar unidirectional flow in vivo by comparing peak systolic velocities from VFI with magnetic resonance...

Modelling of heterogeneous clustering in aluminium

International Nuclear Information System (INIS)

Smith, A.E.; Bourgeois, L.; Nie, J.-F.; Muddle, B.C.

2003-01-01

Full text: Ab initio modelling of heterogeneous clustering in aluminium has been carried out in order to study the precipitation hardening of alloys. This process is based on the addition of small amounts of solute element to the pure metal. With increasing computational power, atomic scale effects can now be better simulated to determine the nature of the hardening mechanism. Comparisons are made between results obtained from two computational packages. These are the Linear Augmented Plane Wave WEEN2K and the plane wave pseudopotential density functional theory package fhi98md. The study of the optimal geometry of very small size clusters inside aluminium has begun with the testing of initial convergence conditions by determination of binding energies for a variety of super cell sizes of the aluminium host crystal. These are compared with total energy calculations for small size precipitates of copper and transition metals of fixed geometry. Such local optimal determinations are seen as precursors to full Monte Carlo calculations of the notional best local geometry for larger precipitates

Absolute parametric instability in a nonuniform plane plasma

Indian Academy of Sciences (India)

The paper reports an analysis of the effect of spatial plasma nonuniformity on absolute parametric instability (API) of electrostatic waves in magnetized plane waveguides subjected to an intense high-frequency (HF) electric field using the separation method. In this case the effect of strong static magnetic field is considered.

Contact angle adjustment in equation-of-state-based pseudopotential model.

Science.gov (United States)

Hu, Anjie; Li, Longjian; Uddin, Rizwan; Liu, Dong

2016-05-01

The single component pseudopotential lattice Boltzmann model has been widely applied in multiphase simulation due to its simplicity and stability. In many studies, it has been claimed that this model can be stable for density ratios larger than 1000. However, the application of the model is still limited to small density ratios when the contact angle is considered. The reason is that the original contact angle adjustment method influences the stability of the model. Moreover, simulation results in the present work show that, by applying the original contact angle adjustment method, the density distribution near the wall is artificially changed, and the contact angle is dependent on the surface tension. Hence, it is very inconvenient to apply this method with a fixed contact angle, and the accuracy of the model cannot be guaranteed. To solve these problems, a contact angle adjustment method based on the geometry analysis is proposed and numerically compared with the original method. Simulation results show that, with our contact angle adjustment method, the stability of the model is highly improved when the density ratio is relatively large, and it is independent of the surface tension.

First principles study of α and δ-Pu

International Nuclear Information System (INIS)

Chattaraj, Debabrata; Dash, Smruti

2017-01-01

The structural and electronic properties of α-and δ-Pu has been investigated using state of the art first principles method. All the calculations have been performed using a plane wave based pseudopotential method under the framework of spin polarized density functional theory. The effect of relativistic spin-orbit interactions on these properties has been investigated. The calculated lattice parameters are found to be within ±1% of the experimental data. The cohesive energy of α-and δ-Pu are calculated to be -3.125 and -3.126 eV/atom. The nature of chemical bonding present in those phases of Pu is depicted by calculated density of states spectra. (author)

Electronic structure and phase stability during martensitic transformation in Al-doped ZrCu intermetallics

International Nuclear Information System (INIS)

Qiu Feng; Shen Ping; Liu Tao; Lin Qiaoli; Jiang Qichuan

2010-01-01

Martensitic transformation, phase stability and electronic structure of Al-doped ZrCu intermetallics were investigated by experiments and first-principles calculations using the pseudopotentials plane wave method. The formation energy calculations indicate that the stability of the ZrCu phase increases with the increasing Al content. Al plays a decisive role in controlling the formation and microstructures of the martensite phases in Zr-Cu-Al alloys. The total energy difference between ZrCu (B2) austenite and ZrCu martensite plays an important role in the martensitic transformation. The phase stability is dependent on its electronic structure. The densities of states (DOS) of the intermetallics were discussed in detail.

Structural, electronic and vibrational properties of lanthanide monophosphide at high pressure

Energy Technology Data Exchange (ETDEWEB)

Panchal, J. M., E-mail: amitjignesh@yahoo.co.in [Government Engineering College, Gandhinagar382028, Gujarat (India); Department of Physics, University School of Sciences, Gujarat University, Ahmedabad 380009, Gujarat (India); Joshi, Mitesh [Government Polytechnic for Girls, Athwagate, Surat395001, Gujarat (India); Gajjar, P. N., E-mail: pngajjar@rediffmail.com [Department of Physics, University School of Sciences, Gujarat University, Ahmedabad 380009, Gujarat (India)

2016-05-06

A first-principles plane wave self-consistent method with the ultra-soft-pseudopotential scheme in the framework of the density functional theory (DFT) is performed to study structural, electronic and vibrational properties of LaP for Rock-salt (NaCl/Bl) and Cesium-chloride (CsCl/B2) phases. The instability of Rock-salt (NaCl/Bl) phases around the transition is discussed. Conclusions based on electronic energy band structure, density of state, phonon dispersion and phonon density of states in both phases are outlined. The calculated results are consistence and confirm the successful applicability of quasi-harmonic phonon theory for structural instability studies for the alloys.

Infrared spectroscopy of copper-resveratrol complexes: A joint experimental and theoretical study

Energy Technology Data Exchange (ETDEWEB)

Chiavarino, B.; Crestoni, M. E.; Fornarini, S. [Dipartimento di Chimica e Tecnologie del Farmaco, Sapienza - Universita di Roma, Piazzale A. Moro 5, 00185 Rome (Italy); Taioli, S. [Interdisciplinary Laboratory for Computational Science, FBK-CMM and University of Trento, Via Sommarive 18, 38123 Trento (Italy); Department of Physics, University of Trento, Via Sommarive 14, 38123 Trento (Italy); Istituto Nazionale di Fisica Nucleare, Sezione di Perugia (Italy); Department of Chemistry, University of Bologna, Via F. Selmi 2, I-40126 Bologna (Italy); Mancini, I.; Tosi, P. [Department of Physics, University of Trento, Via Sommarive 14, 38123 Trento (Italy)

2012-07-14

Infrared multiple-photon dissociation spectroscopy has been used to record vibrational spectra of charged copper-resveratrol complexes in the 3500-3700 cm{sup -1} and 1100-1900 cm{sup -1} regions. Minimum energy structures have been determined by density functional theory calculations using plane waves and pseudopotentials. In particular, the copper(I)-resveratrol complex presents a tetra-coordinated metal bound with two carbon atoms of the alkenyl moiety and two closest carbons of the adjoining resorcinol ring. For these geometries vibrational spectra have been calculated by using linear response theory. The good agreement between experimental and calculated IR spectra for the selected species confirms the overall reliability of the proposed geometries.

Structural, electronic and vibrational properties of lanthanide monophosphide at high pressure

International Nuclear Information System (INIS)

Panchal, J. M.; Joshi, Mitesh; Gajjar, P. N.

2016-01-01

A first-principles plane wave self-consistent method with the ultra-soft-pseudopotential scheme in the framework of the density functional theory (DFT) is performed to study structural, electronic and vibrational properties of LaP for Rock-salt (NaCl/Bl) and Cesium-chloride (CsCl/B2) phases. The instability of Rock-salt (NaCl/Bl) phases around the transition is discussed. Conclusions based on electronic energy band structure, density of state, phonon dispersion and phonon density of states in both phases are outlined. The calculated results are consistence and confirm the successful applicability of quasi-harmonic phonon theory for structural instability studies for the alloys.

A first principles study of native defects in alpha-quartz

CERN Document Server

Roma, G

2003-01-01

We present a study of several neutral and charged oxygen and silicon defects in alpha-quartz. We performed plane waves pseudopotential calculations in the framework of density functional theory in the local density approximation. We will show the structures that we obtained for vacancies and interstitials in several charge states and the corresponding formation energies. We discuss the reciprocal dependence of formation energies of charged defects (and thus concentrations) and the electron chemical potential on each other and we determine the latter by iterative self-consistent solution of the equation imposing charge neutrality. Results on defect concentrations, their dependence on oxygen partial pressure, and self-doping effects are presented.

Simulated non-contact atomic force microscopy for GaAs surfaces based on real-space pseudopotentials

International Nuclear Information System (INIS)

Kim, Minjung; Chelikowsky, James R.

2014-01-01

We simulate non-contact atomic force microscopy (AFM) with a GaAs(1 1 0) surface using a real-space ab initio pseudopotential method. While most ab initio simulations include an explicit model for the AFM tip, our method does not introduce the tip modeling step. This approach results in a considerable reduction of computational work, and also provides complete AFM images, which can be directly compared to experiment. By analyzing tip-surface interaction forces in both our results and previous ab initio simulations, we find that our method provides very similar force profile to the pure Si tip results. We conclude that our method works well for systems in which the tip is not chemically active.

Absolute instabilities of travelling wave solutions in a Keller-Segel model

Science.gov (United States)

Davis, P. N.; van Heijster, P.; Marangell, R.

2017-11-01

We investigate the spectral stability of travelling wave solutions in a Keller-Segel model of bacterial chemotaxis with a logarithmic chemosensitivity function and a constant, sublinear, and linear consumption rate. Linearising around the travelling wave solutions, we locate the essential and absolute spectrum of the associated linear operators and find that all travelling wave solutions have parts of the essential spectrum in the right half plane. However, we show that in the case of constant or sublinear consumption there exists a range of parameters such that the absolute spectrum is contained in the open left half plane and the essential spectrum can thus be weighted into the open left half plane. For the constant and sublinear consumption rate models we also determine critical parameter values for which the absolute spectrum crosses into the right half plane, indicating the onset of an absolute instability of the travelling wave solution. We observe that this crossing always occurs off of the real axis.

Absolute parametric instability in a nonuniform plane plasma ...

Indian Academy of Sciences (India)

Abstract. The paper reports an analysis of the effect of spatial plasma nonuniformity on absolute parametric instability (API) of electrostatic waves in magnetized plane waveguides subjected to an intense high-frequency (HF) electric field using the separation method. In this case the effect of strong static magnetic field is ...

Characteristics of phase-averaged equations for modulated wave groups

NARCIS (Netherlands)

Klopman, G.; Petit, H.A.H.; Battjes, J.A.

2000-01-01

The project concerns the influence of long waves on coastal morphology. The modelling of the combined motion of the long waves and short waves in the horizontal plane is done by phase-averaging over the short wave motion and using intra-wave modelling for the long waves, see e.g. Roelvink (1993).

Geometric characteristics of aberrations of plane-symmetric optical systems

International Nuclear Information System (INIS)

Lu Lijun; Deng Zhiyong

2009-01-01

The geometric characteristics of aberrations of plane-symmetric optical systems are studied in detail with a wave-aberration theory. It is dealt with as an extension of the Seidel aberrations to realize a consistent aberration theory from axially symmetric to plane-symmetric systems. The aberration distribution is analyzed with the spot diagram of a ray and an aberration curve. Moreover, the root-mean-square value and the centroid of aberration distribution are discussed. The numerical results are obtained with the focusing optics of a toroidal mirror at grazing incidence.

Japanese space gravitational wave antenna DECIGO and DPF

Science.gov (United States)

Musha, Mitsuru

2017-11-01

The gravitational wave detection will open a new gravitational wave astronomy, which gives a fruitful insight about early universe or birth and death of stars. In order to detect gravitational wave, we planed a space gravitational wave detector, DECIGO (DECi-heltz Interferometer Gravitational wave Observatory), which consists of three drag-free satellites forming triangle shaped Fabry-Perot laser interferometer with the arm length of 1000 km, and whose strain sensitivity is designed to be 2x10-24 /√Hz around 0.1 Hz. Before launching DECIGO around 2030, a milestone mission named DECIGO pathfinder (DPF) is planed to be launched whose main purpose is the feasibility test of the key technologies for DECIGO. In the present paper, the conceptual design and current status of DECIGO and DPF are reviewed.

Multiplane wave imaging increases signal-to-noise ratio in ultrafast ultrasound imaging

International Nuclear Information System (INIS)

Tiran, Elodie; Deffieux, Thomas; Correia, Mafalda; Maresca, David; Osmanski, Bruno-Felix; Pernot, Mathieu; Tanter, Mickael; Sieu, Lim-Anna; Bergel, Antoine; Cohen, Ivan

2015-01-01

Ultrafast imaging using plane or diverging waves has recently enabled new ultrasound imaging modes with improved sensitivity and very high frame rates. Some of these new imaging modalities include shear wave elastography, ultrafast Doppler, ultrafast contrast-enhanced imaging and functional ultrasound imaging. Even though ultrafast imaging already encounters clinical success, increasing even more its penetration depth and signal-to-noise ratio for dedicated applications would be valuable.Ultrafast imaging relies on the coherent compounding of backscattered echoes resulting from successive tilted plane waves emissions; this produces high-resolution ultrasound images with a trade-off between final frame rate, contrast and resolution. In this work, we introduce multiplane wave imaging, a new method that strongly improves ultrafast images signal-to-noise ratio by virtually increasing the emission signal amplitude without compromising the frame rate. This method relies on the successive transmissions of multiple plane waves with differently coded amplitudes and emission angles in a single transmit event. Data from each single plane wave of increased amplitude can then be obtained, by recombining the received data of successive events with the proper coefficients.The benefits of multiplane wave for B-mode, shear wave elastography and ultrafast Doppler imaging are experimentally demonstrated. Multiplane wave with 4 plane waves emissions yields a 5.8  ±  0.5 dB increase in signal-to-noise ratio and approximately 10 mm in penetration in a calibrated ultrasound phantom (0.7 d MHz −1 cm −1 ). In shear wave elastography, the same multiplane wave configuration yields a 2.07  ±  0.05 fold reduction of the particle velocity standard deviation and a two-fold reduction of the shear wave velocity maps standard deviation. In functional ultrasound imaging, the mapping of cerebral blood volume results in a 3 to 6 dB increase of the contrast-to-noise ratio in

Back Radiation Suppression through a Semitransparent Ground Plane for a mm-Wave Patch Antenna

KAUST Repository

Klionovski, Kirill; Shamim, Atif

2017-01-01

by a round semitransparent ground plane. The semitransparent ground plane has been realized using a low-cost carbon paste on a Kapton film. Experimental results match closely with those of simulations and validate the overall concept.

Features of propagation and recordingof the stress waves in plates of finite thickness

Directory of Open Access Journals (Sweden)

Cherednichenko Rostislav Andreevich

2014-02-01

Full Text Available This work was carried out to study at the same time the dynamics of wave propagation in plane and axisymmetric plates by finite-difference numerical calculation and by the method of dynamic photoelasticity.In many cases it is possible to carry out the investigation of the dynamic stressed state of solid structures under the impact of seismic waves in plane statement, observing the foundation and the building itself in the conditions of plane deformation. Such problems in structural mechanics are usually investigated on plates providing the conditions of generalized plane stressed condition and accounting for the necessity of the known substitution of elastic constants. In case of applying the model of generalized plane stressed state for investigating two-dimensional waves’ propagation in three-dimensional elastic medium it may be necessary to observe certain additional conditions, which for example limit the class of external impacts of high frequencies (short waves. The use of candling for wave recording in plane models explored with the method of dynamic photoelasticity in the observed cases of impulse loading of the plates with finite thickness gives satisfactory results.

Contribution to study of interfaces instabilities in plane, cylindrical and spherical geometry

Science.gov (United States)

Toque, Nathalie

1996-12-01

This thesis proposes several experiments of hydrodynamical instabilities which are studied, numerically and theoretically. The experiments are in plane and cylindrical geometry. Their X-ray radiographies show the evolution of an interface between two solid media crossed by a detonation wave. These materials are initially solid. They become liquide under shock wave or stay between two phases, solid and liquid. The numerical study aims at simulating with the codes EAD and Ouranos, the interfaces instabilities which appear in the experiments. The experimental radiographies and the numerical pictures are in quite good agreement. The theoretical study suggests to modelise a spatio-temporal part of the experiments to obtain the quantitative development of perturbations at the interfaces and in the flows. The models are linear and in plane, cylindrical and spherical geometry. They preceed the inoming study of transition between linear and non linear development of instabilities in multifluids flows crossed by shock waves.

Extended application of Kohn-Sham first-principles molecular dynamics method with plane wave approximation at high energy—From cold materials to hot dense plasmas

International Nuclear Information System (INIS)

Zhang, Shen; Kang, Wei; Wang, Hongwei; Zhang, Ping; He, X. T.

2016-01-01

An extended first-principles molecular dynamics (FPMD) method based on Kohn-Sham scheme is proposed to elevate the temperature limit of the FPMD method in the calculation of dense plasmas. The extended method treats the wave functions of high energy electrons as plane waves analytically and thus expands the application of the FPMD method to the region of hot dense plasmas without suffering from the formidable computational costs. In addition, the extended method inherits the high accuracy of the Kohn-Sham scheme and keeps the information of electronic structures. This gives an edge to the extended method in the calculation of mixtures of plasmas composed of heterogeneous ions, high-Z dense plasmas, lowering of ionization potentials, X-ray absorption/emission spectra, and opacities, which are of particular interest to astrophysics, inertial confinement fusion engineering, and laboratory astrophysics.

Extended application of Kohn-Sham first-principles molecular dynamics method with plane wave approximation at high energy—From cold materials to hot dense plasmas

Energy Technology Data Exchange (ETDEWEB)

Zhang, Shen; Kang, Wei, E-mail: weikang@pku.edu.cn [Center for Applied Physics and Technology, HEDPS, Peking University, Beijing 100871 (China); College of Engineering, Peking University, Beijing 100871 (China); Wang, Hongwei [College of Engineering, Peking University, Beijing 100871 (China); Zhang, Ping, E-mail: zhang-ping@iapcm.ac.cn [Center for Applied Physics and Technology, HEDPS, Peking University, Beijing 100871 (China); LCP, Institute of Applied Physics and Computational Mathematics, Beijing 100088 (China); He, X. T., E-mail: xthe@iapcm.ac.cn [Center for Applied Physics and Technology, HEDPS, and IFSA Collaborative Innovation Center of MoE, Peking University, Beijing 100871 (China); Institute of Applied Physics and Computational Mathematics, Beijing 100088 (China)

2016-04-15

An extended first-principles molecular dynamics (FPMD) method based on Kohn-Sham scheme is proposed to elevate the temperature limit of the FPMD method in the calculation of dense plasmas. The extended method treats the wave functions of high energy electrons as plane waves analytically and thus expands the application of the FPMD method to the region of hot dense plasmas without suffering from the formidable computational costs. In addition, the extended method inherits the high accuracy of the Kohn-Sham scheme and keeps the information of electronic structures. This gives an edge to the extended method in the calculation of mixtures of plasmas composed of heterogeneous ions, high-Z dense plasmas, lowering of ionization potentials, X-ray absorption/emission spectra, and opacities, which are of particular interest to astrophysics, inertial confinement fusion engineering, and laboratory astrophysics.

Specific-heat measurements in superconducting indium-thallium alloys and the pseudopotential form factor

International Nuclear Information System (INIS)

Munukutla, L.V.; Cappelletti, R.L.

1980-01-01

Normal-state specific heats between 1 and 4.4 K and superconducting transition temperatures of pure indium and In-Tl alloys have been measured. Excellent agreement with previous results was found. N/sub bs/(0) was extracted using our γ values and Dynes's lambda values and shows a large variation. The measured variation of lambda 2 > was also obtained from Dynes's results and found to be nearly linear in spite of the large variation of N/sub bs/(0). This is shown to be a consequence of the fact that the ratio of the calculated average screened pseudopotential form factor to electron density of states, 2 /sub s/>/N/sub bs/(0), is nearly constant across the alloy series for each element. No anomaly was found in the specific heat of In/sub 0.69/Tl/sub 0.31/ at the expected martensitic transition temperature

Configurational forces in electronic structure calculations using Kohn-Sham density functional theory

Science.gov (United States)

Motamarri, Phani; Gavini, Vikram

2018-04-01

We derive the expressions for configurational forces in Kohn-Sham density functional theory, which correspond to the generalized variational force computed as the derivative of the Kohn-Sham energy functional with respect to the position of a material point x . These configurational forces that result from the inner variations of the Kohn-Sham energy functional provide a unified framework to compute atomic forces as well as stress tensor for geometry optimization. Importantly, owing to the variational nature of the formulation, these configurational forces inherently account for the Pulay corrections. The formulation presented in this work treats both pseudopotential and all-electron calculations in a single framework, and employs a local variational real-space formulation of Kohn-Sham density functional theory (DFT) expressed in terms of the nonorthogonal wave functions that is amenable to reduced-order scaling techniques. We demonstrate the accuracy and performance of the proposed configurational force approach on benchmark all-electron and pseudopotential calculations conducted using higher-order finite-element discretization. To this end, we examine the rates of convergence of the finite-element discretization in the computed forces and stresses for various materials systems, and, further, verify the accuracy from finite differencing the energy. Wherever applicable, we also compare the forces and stresses with those obtained from Kohn-Sham DFT calculations employing plane-wave basis (pseudopotential calculations) and Gaussian basis (all-electron calculations). Finally, we verify the accuracy of the forces on large materials systems involving a metallic aluminum nanocluster containing 666 atoms and an alkane chain containing 902 atoms, where the Kohn-Sham electronic ground state is computed using a reduced-order scaling subspace projection technique [P. Motamarri and V. Gavini, Phys. Rev. B 90, 115127 (2014), 10.1103/PhysRevB.90.115127].

Frequency tunable surface magneto elastic waves

NARCIS (Netherlands)

Janusonis, J.; Chang, C. L.; van Loosdrecht, P. H. M.; Tobey, R. I.

2015-01-01

We use the transient grating technique to generate narrow-band, widely tunable, in-plane surface magnetoelastic waves in a nickel film. We monitor both the structural deformation of the acoustic wave and the accompanying magnetic precession and witness their intimate coupling in the time domain.

Nonlinear differential equations for the wavefront surface at arbitrary Hartmann-plane distances.

Science.gov (United States)

Téllez-Quiñones, Alejandro; Malacara-Doblado, Daniel; Flores-Hernández, Ricardo; Gutiérrez-Hernández, David A; León-Rodríguez, Miguel

2016-03-20

In the Hartmann test, a wave aberration function W is estimated from the information of the spot diagram drawn in an observation plane. The distance from a reference plane to the observation plane, the Hartmann-plane distance, is typically chosen as z=f, where f is the radius of a reference sphere. The function W and the transversal aberrations {X,Y} calculated at the plane z=f are related by two well-known linear differential equations. Here, we propose two nonlinear differential equations to denote a more general relation between W and the transversal aberrations {U,V} calculated at any arbitrary Hartmann-plane distance z=r. We also show how to directly estimate the wavefront surface w from the information of {U,V}. The use of arbitrary r values could improve the reliability of the measurements of W, or w, when finding difficulties in adequate ray identification at z=f.

Temperature dependent empirical pseudopotential theory for self-assembled quantum dots.

Science.gov (United States)

Wang, Jianping; Gong, Ming; Guo, Guang-Can; He, Lixin

2012-11-28

We develop a temperature dependent empirical pseudopotential theory to study the electronic and optical properties of self-assembled quantum dots (QDs) at finite temperature. The theory takes the effects of both lattice expansion and lattice vibration into account. We apply the theory to InAs/GaAs QDs. For the unstrained InAs/GaAs heterostructure, the conduction band offset increases whereas the valence band offset decreases with increasing temperature, and there is a type-I to type-II transition at approximately 135 K. Yet, for InAs/GaAs QDs, the holes are still localized in the QDs even at room temperature, because the large lattice mismatch between InAs and GaAs greatly enhances the valence band offset. The single-particle energy levels in the QDs show a strong temperature dependence due to the change of confinement potentials. Because of the changes of the band offsets, the electron wavefunctions confined in QDs increase by about 1-5%, whereas the hole wavefunctions decrease by about 30-40% when the temperature increases from 0 to 300 K. The calculated recombination energies of excitons, biexcitons and charged excitons show red shifts with increasing temperature which are in excellent agreement with available experimental data.

Model test study on propagation law of plane stress wave in jointed rock mass under different in-situ stresses

Science.gov (United States)

Dong, Qian

2017-12-01

The study of propagation law of plane stress wave in jointed rock mass under in-situ stress has important significance for safety excavation of underground rock mass engineering. A model test of the blasting stress waves propagating in the intact rock and jointed rock mass under different in-situ stresses was carried out, and the influencing factors on the propagation law, such as the scale of static loads and the number of joints were studied respectively. The results show that the transmission coefficient of intact rock is larger than that of jointed rock mass under the same loading condition. With the increase of confining pressure, the transmission coefficients of intact rock and jointed rock mass both show an trend of increasing first and then decreasing, and the variation of transmission coefficients in intact rock is smaller than that of jointed rock mass. Transmission coefficient of jointed rock mass decreases with the increase of the number of joints under the same loading condition, when the confining pressure is relatively small, the reduction of transmission coefficients decreases with the increasing of the number of joints, and the variation law of the reduction of transmission coefficients is contrary when the confining pressure is large.

Scattering in a spherical potential: Motion of complex-plane poles and zeros

International Nuclear Information System (INIS)

Arndt, R.A.; Roper, L.D.

1989-01-01

Scattering of spinless nucleons in a spherical potential is examined with the use of a computer graphics simulation VSCAT. The potential is defined stepwise and the Schroedinger equation is solved to obtain wavefunctions, scattering phases, partial-wave total cross sections, and differential cross sections, which are then displayed graphically. For the particular case of a square well, partial-wave amplitudes are displayed over the complex momentum plane in a three-dimensional plot. The well depth is then varied to follow the motion of poles in the complex momentum plane as they become resonances and then are bound states. Also displayed are the partial-wave zeros, which are required to satisfy Levinson's theorem for multiple states. The requirement on well depth is developed to produce a specified number of bound states and enumerate the energies which, at a given well depth, create equal scattering phases in adjoining partial waves δ/sub l//sub -1/ = δ/sub l/ = δ/sub l//sub +1/. This symmetry of scattering phases exists for both repulsive and attractive square potentials. A square repulsive core is also studied, which has the same triple-point symmetry as the square well

Electromagnetic waves in stratified media

CERN Document Server

Wait, James R; Fock, V A; Wait, J R

2013-01-01

International Series of Monographs in Electromagnetic Waves, Volume 3: Electromagnetic Waves in Stratified Media provides information pertinent to the electromagnetic waves in media whose properties differ in one particular direction. This book discusses the important feature of the waves that enables communications at global distances. Organized into 13 chapters, this volume begins with an overview of the general analysis for the electromagnetic response of a plane stratified medium comprising of any number of parallel homogeneous layers. This text then explains the reflection of electromagne

The structure and properties of vacancies in Si nano-crystals calculated by real space pseudopotential methods

International Nuclear Information System (INIS)

Beckman, S.P.; Chelikowsky, James R.

2007-01-01

The structure and properties of vacancies in a 2 nm Si nano-crystal are studied using a real space density functional theory/pseudopotential method. It is observed that a vacancy's electronic properties and energy of formation are directly related to the local symmetry of the vacancy site. The formation energy for vacancies and Frenkel pair are calculated. It is found that both defects have lower energy in smaller crystals. In a 2 nm nano-crystal the energy to form a Frenkel pair is 1.7 eV and the energy to form a vacancy is no larger than 2.3 eV. The energy barrier for vacancy diffusion is examined via a nudged elastic band algorithm

Orbital effects of a monochromatic plane gravitational wave with ultra-low frequency incident on a gravitationally bound two-body system

Directory of Open Access Journals (Sweden)

Lorenzo Iorio

2014-09-01

Full Text Available We analytically compute the long-term orbital variations of a test particle orbiting a central body acted upon by an incident monochromatic plane gravitational wave. We assume that the characteristic size of the perturbed two-body system is much smaller than the wavelength of the wave. Moreover, we also suppose that the wave's frequency νg is much smaller than the particle's orbital one nb. We make neither a priori assumptions about the direction of the wavevector kˆ nor on the orbital configuration of the particle. While the semi-major axis a is left unaffected, the eccentricity e, the inclination I, the longitude of the ascending node Ω, the longitude of pericenter ϖ and the mean anomaly ℳ undergo non-vanishing long-term changes of the form dΨ/dt=F(Kij;e,I,Ω,ω,Ψ=e,I,Ω,ϖ,M, where Kij, i,j=1,2,3 are the coefficients of the tidal matrix K. Thus, in addition to the variations of its orientation in space, the shape of the orbit would be altered as well. Strictly speaking, such effects are not secular trends because of the slow modulation introduced by K and by the orbital elements themselves: they exhibit peculiar long-term temporal patterns which would be potentially of help for their detection in multidecadal analyses of extended data records of planetary observations of various kinds. In particular, they could be useful in performing independent tests of the inflation-driven ultra-low gravitational waves whose imprint may have been indirectly detected in the Cosmic Microwave Background by the Earth-based experiment BICEP2. Our calculation holds, in general, for any gravitationally bound two-body system whose orbital frequency nb is much larger than the frequency νg of the external wave, like, e.g., extrasolar planets and the stars orbiting the Galactic black hole. It is also valid for a generic perturbation of tidal type with constant coefficients over timescales of the order of the orbital period of the perturbed particle.

The light wave flow effect in a plane-parallel layer with a quasi-zero refractive index under the action of bounded light beams

International Nuclear Information System (INIS)

Gadomsky, O. N.; Shchukarev, I. A.

2016-01-01

It is shown that external optical radiation in the 450–1200 nm range can be efficiently transformed under the action of bounded light beams to a surface wave that propagates along the external and internal boundaries of a plane-parallel layer with a quasi-zero refractive index. Reflection regimes with complex and real angles of refraction in the layer are considered. The layer with a quasi-zero refractive index in this boundary problem is located on a highly reflective metal substrate; it is shown that the uniform low reflection of light is achieved in the wavelength range under study.

Non-Linear Langmuir Wave Modulation in Collisionless Plasmas

DEFF Research Database (Denmark)

Dysthe, K. B.; Pécseli, Hans

1977-01-01

in the expressions concerning the modulation instability of a plane Langmuir wave. When the Vlasov equation for the ions is applied, a Langmuir wave is modulationally unstable for arbitrary perturbations independent of the unperturbed wave amplitude, in contrast to what is found for fluid ions. A simple analogy...

Electronic and structural properties of {beta}-Be{sub 3}N{sub 2}

Energy Technology Data Exchange (ETDEWEB)

Mokhtari, A.; Akbarzadeh, H

2002-12-01

We report the results of a theoretical study of the electronic and structural properties of the hexagonal beryllium nitride, using first principle pseudopotential plane wave (PP-PW) as well as full potential linearized augmented plane wave (FP-LAPW) methods within density functional theory. In the case of PP-PW we generated the pseudopotential by the highly optimized Q{sub c}-tuning method and used the local density approximation and generalized gradient approximation (GGA) for the exchange-correlation potential. We applied pressure on the unit cell by the Wentzcovitch and traditional methods. In the FP-LAPW approach only the GGA was used for the exchange-correlation potential. Our calculated values for structural properties, based on both approaches are in reasonable agreement with experimental and other theoretical (Hartree Fock) results. By applying the above two approaches and also the Tight Binding Linear Muffin Thin Orbital method, the ground state Kohn-Sham eigenvalues were calculated. The energy bands in three cases were similar and except for the energy gap values they were in good agreement with other theoretical results. Various versions of GGA functionals are usually obtained by optimizing the exchange correlation energy E{sub XC} rather than the corresponding potential V{sub XC}. As these functionals are not able to simultaneously reproduce E{sub XC} and V{sub XC}, hence they cannot obtain an accurate value for the band gap which mainly depends on the potential. Engel and Vosko (Phys. Rev. B 47 (1993) 13164) have proposed an alternate form of GGA which is based on optimizing V{sub XC} instead of the integral quantity E{sub XC}. We used this functional to calculate the band gap and the result seems to be more reasonable. Finally the total and partial densities of states were calculated for each atom.

Study on crack scattering in aluminum plates with Lamb wave frequency–wavenumber analysis

International Nuclear Information System (INIS)

Yu, Lingyu; Tian, Zhenhua; Leckey, Cara A C

2013-01-01

The multimodal characteristic of Lamb waves makes the interpretation of Lamb wave signals difficult in either the time or frequency domain. In this work, we present our study of Lamb wave propagation characterization and crack scattering using frequency–wavenumber analysis. The aim is to investigate three dimensional (3D) Lamb wave behavior in the presence of crack damage via the application of frequency–wavenumber analysis. The analysis techniques are demonstrated using simulation examples of an aluminum plate with a through-thickness crack. Both in-plane and out-of-plane components are acquired through a 3D elastodynamic finite integration technique (EFIT), while the out-of-plane component is also experimentally obtained using a scanning laser Doppler vibrometer for verification purposes. The time–space wavefield is then transformed to the frequency–wavenumber domain by a two dimensional (2D) Fourier transform and the out-of-plane EFIT results are compared to experimental measurements. The experimental and simulated results are found to be in close agreement. The frequency–wavenumber representation of in-plane and out-of-plane components shows clear distinction among various Lamb wave modes that are present. However, spatial information is lost during this 2D transformation. A short space 2D Fourier transform is therefore adopted to obtain the frequency–wavenumber spectra at various spatial locations, resulting in a space–frequency–wavenumber representation of the signal. The space–frequency–wavenumber analysis has shown its potential for indicating crack presence. (paper)

The two-wave X-ray field calculated by means of integral-equation methods

International Nuclear Information System (INIS)

Bremer, J.

1984-01-01

The problem of calculating the two-wave X-ray field on the basis of the Takagi-Taupin equations is discussed for the general case of curved lattice planes. A two-dimensional integral equation which incorporates the nature of the incoming radiation, the form of the crystal/vacuum boundary, and the curvature of the structure, is deduced. Analytical solutions for the symmetrical Laue case with incoming plane waves are obtained directly for perfect crystals by means of iteration. The same method permits a simple derivation of the narrow-wave Laue and Bragg cases. Modulated wave fronts are discussed, and it is shown that a cut-off in the width of an incoming plane wave leads to lateral oscillations which are superimposed on the Pendelloesung fringes. Bragg and Laue shadow fields are obtained. The influence of a non-zero kernel is discussed and a numerical procedure for calculating wave amplitudes in curved crystals is presented. (Auth.)

Scalable real space pseudopotential density functional codes for materials in the exascale regime

Science.gov (United States)

Lena, Charles; Chelikowsky, James; Schofield, Grady; Biller, Ariel; Kronik, Leeor; Saad, Yousef; Deslippe, Jack

Real-space pseudopotential density functional theory has proven to be an efficient method for computing the properties of matter in many different states and geometries, including liquids, wires, slabs, and clusters with and without spin polarization. Fully self-consistent solutions using this approach have been routinely obtained for systems with thousands of atoms. Yet, there are many systems of notable larger sizes where quantum mechanical accuracy is desired, but scalability proves to be a hindrance. Such systems include large biological molecules, complex nanostructures, or mismatched interfaces. We will present an overview of our new massively parallel algorithms, which offer improved scalability in preparation for exascale supercomputing. We will illustrate these algorithms by considering the electronic structure of a Si nanocrystal exceeding 104 atoms. Support provided by the SciDAC program, Department of Energy, Office of Science, Advanced Scientific Computing Research and Basic Energy Sciences. Grant Numbers DE-SC0008877 (Austin) and DE-FG02-12ER4 (Berkeley).

Study of Thermodynamics of Liquid Noble-Metals Alloys Through a Pseudopotential Theory

International Nuclear Information System (INIS)

Vora, Aditya M.

2010-01-01

The Gibbs-Bogoliubov (GB) inequality is applied to investigate the thermodynamic properties of some equiatomic noble metal alloys in liquid phase such as Au-Cu, Ag-Cu, and Ag-Au using well recognized pseudopotential formalism. For description of the structure, well known Percus-Yevick (PY) hard sphere model is used as a reference system. By applying a variation method the best hard core diameters have been found which correspond to minimum free energy. With this procedure the thermodynamic properties such as entropy and heat of mixing have been computed. The influence of local field correction function viz; Hartree (H), Taylor (T), Ichimaru-Utsumi (IU), Farid et al. (F), and Sarkar et al. (S) is also investigated. The computed results of the excess entropy compares favourably in the case of liquid alloys while the agreement with experiment is poor in the case of heats of mixing. This may be due to the sensitivity of the heats of mixing with the potential parameters and the dielectric function. (condensed matter: electronic structure, electrical, magnetic, and optical properties)

On the role of lateral waves in the radiation from the dielectric wedge

DEFF Research Database (Denmark)

Balling, Peter

1973-01-01

The field on the dielectric wedge is approximated by a plane-wave expansion as in [1]. Contributions from this solution to both the surface field and the radiation field are examined. Finally, an experimental radiation field is compared with the plane-wave solution and with a geometric-optical...

Applicability of geometrical optics to in-plane liquid-crystal configurations

NARCIS (Netherlands)

Sluijter, M.; Xu, M.; Urbach, H.P.; De Boer, D.K.G.

2010-01-01

We study the applicability of geometrical optics to inhomogeneous dielectric nongyrotropic optically anisotropic media typically found in in-plane liquid-crystal configurations with refractive indices no=1.5 and ne=1.7. To this end, we compare the results of advanced ray- and wave-optics simulations

Effect of nitrogen doping of graphene oxide on hydrogen and hydroxyl adsorption

Energy Technology Data Exchange (ETDEWEB)

Min, Byeong June; Jeong, Hae Kyung [Daegu University, Kyungsan (Korea, Republic of)

2014-05-15

We investigate how nitrogen-doping affects the hydrogen (H) and the hydroxyl (OH) adsorption on graphene oxide (GO) and on nitrogen-doped GO (NGO) via pseudopotential plane wave density functional calculations within the local spin density approximation. We find that the nitrogen doping brings about drastic changes in the hydrogen and the hydroxyl adsorption energetics, but its effects depend sensitively on the nitrogen configuration in NGO. The H and the OH adsorption energies are comparable only for pyrrolic NGO. In GO and quarternary NGO, the H adsorption energy is greater than the OH adsorption energy while the trend is reversed in pyridinic NGO. Also, the OH adsorption process is less affected by nitrogen-doping than the H adsorption is.

Optical properties of LiGaS2: an ab initio study and spectroscopic ellipsometry measurement

International Nuclear Information System (INIS)

Atuchin, V V; Lin, Z S; Isaenko, L I; Lobanov, S I; Kesler, V G; Kruchinin, V N

2009-01-01

Electronic and optical properties of lithium thiogallate crystal, LiGaS 2 , have been investigated by both experimental and theoretical methods. The plane-wave pseudopotential method based on DFT theory has been used for band structure calculations. The electronic parameters of Ga 3d orbitals have been corrected by the DFT+U methods to be consistent with those measured with x-ray photoemission spectroscopy. Evolution of optical constants of LiGaS 2 over a wide spectral range was determined by developed first-principles theory and dispersion curves were compared with optical parameters defined by spectroscopic ellipsometry in the photon energy range 1.2-5.0 eV. Good agreement has been achieved between theoretical and experimental results.

Calculated mechanical and thermal properties of CePt{sub 3}Si and CePt{sub 3}B above their magnetic-ordering temperatures by an LDA-based ab-initio theory

Energy Technology Data Exchange (ETDEWEB)

Sykora, Rudolf [Nanotechnology Centre, VSB-TU Ostrava (Czech Republic); Legut, Dominik [IT4Innovations Centre, VSB-TU Ostrava (Czech Republic); Rogl, Gerda [Institute of Physical Chemistry, University of Vienna (Austria); Institute of Solid State Physics, University of Technology, Wien (Austria); Faculty of Physics, University of Vienna (Austria); Mueller, Peter; Mueller, Herbert; Bauer, Ernst [Institute of Solid State Physics, University of Technology, Wien (Austria); Puchegger, Stephan [Faculty of Physics, University of Vienna (Austria); Rogl, Peter [Institute of Physical Chemistry, University of Vienna (Austria)

2015-07-01

Adopting the plane-wave pseudopotential VASP[1] DFT package, using a simple local density approximation for electronic exchange and correlation effects, and disregarding spin-orbit interaction we calculate (a necessarily naive) electronic structure of CePt{sub 3}Si and CePt{sub 3}B materials (the former being known as a heavy-fermion superconductor with no inversion centre) under several discrete values of stress and strain. For each such configuration we calculate its phonon spectrum with a direct (supercell) method as supplied by the Phonopy program. Combining the results we obtain materials' thermal and mechanical properties within the quasi-harmonic approximation, presumably applicable to temperatures above magnetic-ordering temperatures. Results are compared to experimental data.

Ab initio investigation of the structural and electronic properties of the MgFBrxCl1-x quaternary alloy

Science.gov (United States)

Mokhtari, Ali; Alidoosti, Mohammad

2014-11-01

In the present work, we have performed first principles calculations to study the structural and electronic properties of the MgFBrxCl1-x quaternary alloys using the pseudo-potential plane wave approach within the framework of density functional theory. By using the optimized initial parameters, we have obtained the physical quantities such as equilibrium lattice constants a and c, cohesive energy and band gap and then fitted the results by a quadratic expression for all x compositions. The results of bulk modulus exhibit nearly linear concentration dependence (LCD) but other quantities show nonlinear dependence. Finally, we have calculated the total and angular momentum decomposed (partial) density of states and determined the contributions of different orbitals of each atoms.

Stability of gold atoms and dimers adsorbed on graphene

International Nuclear Information System (INIS)

Varns, R; Strange, P

2008-01-01

We report density functional theory (DFT) calculations for gold atoms and dimers on the surface of graphene. The calculations were performed using the plane wave pseudopotential method. Calculations were performed for a variety of geometries, and both the graphene surface and gold atoms were allowed to fully relax. In agreement with experiment, our results show that the gold-gold interaction is considerably stronger than the gold-graphene interaction, implying that uniform coverage could not be attained. The minimum energy configuration for a single gold atom is found to be directly above a carbon atom, while for the dimer it is perpendicular to the surface and directly above a carbon-carbon bond. Our results are consistent with previous similar calculations

Infrared spectroscopy of copper-resveratrol complexes: A joint experimental and theoretical study

International Nuclear Information System (INIS)

Chiavarino, B.; Crestoni, M. E.; Fornarini, S.; Taioli, S.; Mancini, I.; Tosi, P.

2012-01-01

Infrared multiple-photon dissociation spectroscopy has been used to record vibrational spectra of charged copper-resveratrol complexes in the 3500–3700 cm −1 and 1100–1900 cm −1 regions. Minimum energy structures have been determined by density functional theory calculations using plane waves and pseudopotentials. In particular, the copper(I)-resveratrol complex presents a tetra-coordinated metal bound with two carbon atoms of the alkenyl moiety and two closest carbons of the adjoining resorcinol ring. For these geometries vibrational spectra have been calculated by using linear response theory. The good agreement between experimental and calculated IR spectra for the selected species confirms the overall reliability of the proposed geometries.

Forward volume and surface magnetostatic modes in an yttrium iron garnet film for out-of-plane magnetic fields: Theory and experiment

Science.gov (United States)

Lim, Jinho; Bang, Wonbae; Trossman, Jonathan; Amanov, Dovran; Ketterson, John B.

2018-05-01

We present experimental and theoretical results on the propagation of magnetostatic spin waves in a film of yttrium iron garnet (YIG) for out-of-plane magnetic fields for which propagation in opposite directions is nonreciprocal in the presence of a metal layer. The plane studied is defined by the film normal n and n × k where k is the wave vector of the mode. Spin waves in this setting are classified as forward volume waves or surface waves and display non-reciprocity in the presence of an adjacent metal layer except for when H//n. The measurements are carried out in a transmission geometry, and a microwave mixer is used to measure the change of phase, and with it the evolution of wavevector, of the arriving spin wave with external magnetic field.

Gravitational Couplings for Gop-Planes and y-Op-Planes

OpenAIRE

Giraldo, Juan Fernando Ospina

2000-01-01

The Wess-Zumino actions for generalized orientifold planes (GOp-planes) and y-deformed orientifold planes (yOp-planes) are presented and two series power expantions are realized from whiches processes that involves GOp-planes,yOp-planes, RR-forms, gravitons and gaugeons, are obtained. Finally non-standard GOp-planes and y-Op-planes are showed.

The D-instanton and other supersymmetric D-branes in IIB plane-wave string theory

International Nuclear Information System (INIS)

Gaberdiel, Matthias R.; Green, Michael B.

2003-01-01

A class of D-branes for the type IIB plane-wave background is considered that preserve half the dynamical supersymmetries of the light-cone gauge. The D-branes of this type are the Euclidean (or instantonic) (0,0), (0,4), and (4,0) branes (where (r,s) denotes a brane oriented with r axes in the first four directions transverse to the +, - light-cone, and s axes in the second four directions). Corresponding Lorentzian D-branes are (+,-;0,0), (+,-;0,4), and (+,-;4,0). These are constructed in two ways. The first uses a boundary state formalism which implements appropriate fermionic gluing conditions and the second is based on a direct quantization of the open strings ending on the branes. In distinction to the D-branes considered earlier these have massless world-volume fermions but do not possess kinematical supersymmetries. Cylinder diagrams describing the overlap between a pair of boundary states displaced by some distance are evaluated. The open-string description of this system involves mode frequencies that are, in general, given by irrational solutions to transcendental equations. The closed-string and open-string descriptions are shown to be equivalent by a nontrivial implementation of the S modular transformation. A classical description of the D-instanton (the (0,0) case) in light-cone gauge is also given

NanoPSE: Nanoscience Problem Solving Environment for atomistic electronic structure of semiconductor nanostructures

International Nuclear Information System (INIS)

Jones, Wesley B; Bester, Gabriel; Canning, Andrew; Franceschetti, Alberto; Graf, Peter A; Kim, Kwiseon; Langou, Julien; Wang Linwang; Dongarra, Jack; Zunger, Alex

2005-01-01

Researchers at the National Renewable Energy Laboratory and their collaborators have developed over the past ∼10 years a set of algorithms for an atomistic description of the electronic structure of nanostructures, based on plane-wave pseudopotentials and configurationinteraction. The present contribution describes the first step in assembling these various codes into a single, portable, integrated set of software packages. This package is part of an ongoing research project in the development stage. Components of NanoPSE include codes for atomistic nanostructure generation and passivation, valence force field model for atomic relaxation, code for potential field generation, empirical pseudopotential method solver, strained linear combination of bulk bands method solver, configuration interaction solver for excited states, selection of linear algebra methods, and several inverse band structure solvers. Although not available for general distribution at this time as it is being developed and tested, the design goal of the NanoPSE software is to provide a software context for collaboration. The software package is enabled by fcdev, an integrated collection of best practice GNU software for open source development and distribution augmented to better support FORTRAN

Modeling stress wave propagation in rocks by distinct lattice spring model

Directory of Open Access Journals (Sweden)

Gaofeng Zhao

2014-08-01

Full Text Available In this paper, the ability of the distinct lattice spring model (DLSM for modeling stress wave propagation in rocks was fully investigated. The influence of particle size on simulation of different types of stress waves (e.g. one-dimensional (1D P-wave, 1D S-wave and two-dimensional (2D cylindrical wave was studied through comparing results predicted by the DLSM with different mesh ratios (lr and those obtained from the corresponding analytical solutions. Suggested values of lr were obtained for modeling these stress waves accurately. Moreover, the weak material layer method and virtual joint plane method were used to model P-wave and S-wave propagating through a single discontinuity. The results were compared with the classical analytical solutions, indicating that the virtual joint plane method can give better results and is recommended. Finally, some remarks of the DLSM on modeling of stress wave propagation in rocks were provided.

Realistic full wave modeling of focal plane array pixels.

Energy Technology Data Exchange (ETDEWEB)

Campione, Salvatore [Sandia National Laboratories (SNL-NM), Albuquerque, NM (United States). Electromagnetic Theory Dept.; Warne, Larry K. [Sandia National Laboratories (SNL-NM), Albuquerque, NM (United States). Electromagnetic Theory Dept.; Jorgenson, Roy E. [Sandia National Laboratories (SNL-NM), Albuquerque, NM (United States). Electromagnetic Theory Dept.; Davids, Paul [Sandia National Laboratories (SNL-NM), Albuquerque, NM (United States). Applied Photonic Microsystems Dept.; Peters, David W. [Sandia National Laboratories (SNL-NM), Albuquerque, NM (United States). Applied Photonic Microsystems Dept.

2017-11-01

Here, we investigate full-wave simulations of realistic implementations of multifunctional nanoantenna enabled detectors (NEDs). We focus on a 2x2 pixelated array structure that supports two wavelengths of operation. We design each resonating structure independently using full-wave simulations with periodic boundary conditions mimicking the whole infinite array. We then construct a supercell made of a 2x2 pixelated array with periodic boundary conditions mimicking the full NED; in this case, however, each pixel comprises 10-20 antennas per side. In this way, the cross-talk between contiguous pixels is accounted for in our simulations. We observe that, even though there are finite extent effects, the pixels work as designed, each responding at the respective wavelength of operation. This allows us to stress that realistic simulations of multifunctional NEDs need to be performed to verify the design functionality by taking into account finite extent and cross-talk effects.

Stresses in a submarine topography under ocean waves

Energy Technology Data Exchange (ETDEWEB)

Mei, C.C.; McTigue, D.F.

1984-09-01

The problem of submarine slope stability is of interest to both offshore engineering and geology. In an uneven topography, the weight above a horizontal plane induces two-dimensional variation in the static stress field. The action of wave pressure, which changes with depth, further introduces excess pore pressure and dynamic stresses in the sea bottom. In the present paper, we combine a simple analytical theory for the static stress by the present authors, and the recent solution by Mei and Foda for wave-induced stresses in a plane poro-elastic sea bed to account for mild bottom slope and wave shoaling, and obtain the effective stress field in a submarine topography under sea waves. Sample results are given for a ridge and a canyon. In particular, the dynamic pore pressure and the combined static and dynamic effective stresses are presented.

An Enhanced Plane Wave Expansion Method to Solve Piezoelectric Phononic Crystal with Resonant Shunting Circuits

Directory of Open Access Journals (Sweden)

Ziyang Lian

2016-01-01

Full Text Available An enhanced plane wave expansion (PWE method is proposed to solve piezoelectric phononic crystal (PPC connected with resonant shunting circuits (PPC-C, which is named as PWE-PPC-C. The resonant shunting circuits can not only bring about the locally resonant (LR band gap for the PPC-C but also conveniently tune frequency and bandwidth of band gaps through adjusting circuit parameters. However, thus far, more than one-dimensional PPC-C has been studied just by Finite Element method. Compared with other methods, the PWE has great advantages in solving more than one-dimensional PC as well as various lattice types. Nevertheless, the conventional PWE cannot accurately solve coupling between the structure and resonant shunting circuits of the PPC-C since only taking one-way coupling from displacements to electrical parameters into consideration. A two-dimensional PPC-C model of orthorhombic lattice is established to demonstrate the whole solving process of PWE-PPC-C. The PWE-PPC-C method is validated by Transfer Matrix method as well as Finite Element method. The dependence of band gaps on circuit parameters has been investigated in detail by PWE-PPC-C. Its advantage in solving various lattice types is further illustrated by calculating the PPC-C of triangular and hexagonal lattices, respectively.

Acoustic plane waves normally incident on a clamped panel in a rectangular duct. [to explain noise reduction curves for reducing interior noise in aircraft

Science.gov (United States)

Unz, H.; Roskam, J.

1979-01-01

The theory of acoustic plane wave normally incident on a clamped panel in a rectangular duct is developed. The coupling theory between the elastic vibrations of the panel (plate) and the acoustic wave propagation in infinite space and in the rectangular duct is considered. The partial differential equation which governs the vibration of the panel (plate) is modified by adding to its stiffness (spring) forces and damping forces, and the fundamental resonance frequency and the attenuation factor are discussed. The noise reduction expression based on the theory is found to agree well with the corresponding experimental data of a sample aluminum panel in the mass controlled region, the damping controlled region, and the stiffness controlled region. All the frequency positions of the upward and downward resonance spikes in the sample experimental data are identified theoretically as resulting from four cross interacting major resonance phenomena: the cavity resonance, the acoustic resonance, the plate resonance, and the wooden back panel resonance.

Acoustic solitary waves in dusty and/or multi-ion plasmas with cold, adiabatic, and hot constituents

International Nuclear Information System (INIS)

Verheest, Frank; Hellberg, Manfred A.; Kourakis, Ioannis

2008-01-01

Large nonlinear acoustic waves are discussed in a four-component plasma, made up of two superhot isothermal species, and two species with lower thermal velocities, being, respectively, adiabatic and cold. First a model is considered in which the isothermal species are electrons and ions, while the cooler species are positive and/or negative dust. Using a Sagdeev pseudopotential formalism, large dust-acoustic structures have been studied in a systematic way, to delimit the compositional parameter space in which they can be found, without restrictions on the charges and masses of the dust species and their charge signs. Solitary waves can only occur for nonlinear structure velocities smaller than the adiabatic dust thermal velocity, leading to a novel dust-acoustic-like mode based on the interplay between the two dust species. If the cold and adiabatic dust are oppositely charged, only solitary waves exist, having the polarity of the cold dust, their parameter range being limited by infinite compression of the cold dust. However, when the charges of the cold and adiabatic species have the same sign, solitary structures are limited for increasing Mach numbers successively by infinite cold dust compression, by encountering the adiabatic dust sonic point, and by the occurrence of double layers. The latter have, for smaller Mach numbers, the same polarity as the charged dust, but switch at the high Mach number end to the opposite polarity. Typical Sagdeev pseudopotentials and solitary wave profiles have been presented. Finally, the analysis has nowhere used the assumption that the dust would be much more massive than the ions and hence, one or both dust species can easily be replaced by positive and/or negative ions and the conclusions will apply to that plasma model equally well. This would cover a number of different scenarios, such as, for example, very hot electrons and ions, together with a mix of adiabatic ions and dust (of either polarity) or a very hot electron

Modelling the optical response of human retinal photoreceptors to plane wave illumination with the finite integration technique

Science.gov (United States)

Akhlagh Moayed, Alireza; Dang, Shannon; Ramahi, Omar M.; Bizheva, Kostadinka K.

2009-02-01

The early stages of ocular diseases such as Diabetic Retinopathy are manifested by morphological changes in retinal tissue occurring on cellular level. Therefore, a number of ophthalmic diseases can be diagnosed at an early stage by detecting spatial and temporal variations in the scattering profile of retinal tissue. It was recently demonstrated that, OCT can be used to probe the functional response of retinal photoreceptors to external light stimulation [1]-[3]. fUHROCT measures localized differential changes in the retina reflectivity over time resulting from external light stimulation of the retina. Currently the origins of the observed reflectivity changes are not well understood. However, due to the complex nature of retinal physiology using purely experimental approaches in this case is problematic. For example fUHROCT is sensitive to small changes in the refractive index of biological tissue which as demonstrated previously, can result from a number of processes such as membrane hyperpolarization, osmotic swelling, metabolic changes, etc. In this paper, we present a computational model of interaction between photoreceptor cells and optical plane wave based on the Finite Integration Technique (FIT).

Benney's long wave equations

International Nuclear Information System (INIS)

Lebedev, D.R.

1979-01-01

Benney's equations of motion of incompressible nonviscous fluid with free surface in the approximation of long waves are analyzed. The connection between the Lie algebra of Hamilton plane vector fields and the Benney's momentum equations is shown

Modulational instability, solitons and periodic waves in a model of quantum degenerate boson-fermion mixtures

International Nuclear Information System (INIS)

Belmonte-Beitia, Juan; Perez-Garcia, Victor M.; Vekslerchik, Vadym

2007-01-01

In this paper, we study a system of coupled nonlinear Schroedinger equations modelling a quantum degenerate mixture of bosons and fermions. We analyze the stability of plane waves, give precise conditions for the existence of solitons and write explicit solutions in the form of periodic waves. We also check that the solitons observed previously in numerical simulations of the model correspond exactly to our explicit solutions and see how plane waves destabilize to form periodic waves

RCS Diversity of Electromagnetic Wave Carrying Orbital Angular Momentum.

Science.gov (United States)

Zhang, Chao; Chen, Dong; Jiang, Xuefeng

2017-11-13

An electromagnetic (EM) wave with orbital angular momentum (OAM) has a helical wave front, which is different from that of the plane wave. The phase gradient can be found perpendicular to the direction of propagation and proportional to the number of OAM modes. Herein, we study the backscattering property of the EM wave with different OAM modes, i.e., the radar cross section (RCS) of the target is measured and evaluated with different OAM waves. As indicated by the experimental results, different OAM waves have the same RCS fluctuation for the simple target, e.g., a small metal ball as the target. However, for complicated targets, e.g., two transverse-deployed small metal balls, different RCSs can be identified from the same incident angle. This valuable fact helps to obtain RCS diversity, e.g., equal gain or selective combining of different OAM wave scattering. The majority of the targets are complicated targets or expanded targets; the RCS diversity can be utilized to detect a weak target traditionally measured by the plane wave, which is very helpful for anti-stealth radar to detect the traditional stealth target by increasing the RCS with OAM waves.

Anomalous width variation of rarefactive ion acoustic solitary waves in the context of auroral plasmas

Directory of Open Access Journals (Sweden)

S. S. Ghosh

2004-01-01

Full Text Available The presence of dynamic, large amplitude solitary waves in the auroral regions of space is well known. Since their velocities are of the order of the ion acoustic speed, they may well be considered as being generated from the nonlinear evolution of ion acoustic waves. However, they do not show the expected width-amplitude correlation for K-dV solitons. Recent POLAR observations have actually revealed that the low altitude rarefactive ion acoustic solitary waves are associated with an increase in the width with increasing amplitude. This indicates that a weakly nonlinear theory is not appropriate to describe the solitary structures in the auroral regions. In the present work, a fully nonlinear analysis based on Sagdeev pseudopotential technique has been adopted for both parallel and oblique propagation of rarefactive solitary waves in a two electron temperature multi-ion plasma. The large amplitude solutions have consistently shown an increase in the width with increasing amplitude. The width-amplitude variation profile of obliquely propagating rarefactive solitary waves in a magnetized plasma have been compared with the recent POLAR observations. The width-amplitude variation pattern is found to fit well with the analytical results. It indicates that a fully nonlinear theory of ion acoustic solitary waves may well explain the observed anomalous width variations of large amplitude structures in the auroral region.

Model-based internal wave processing

Energy Technology Data Exchange (ETDEWEB)

Candy, J.V.; Chambers, D.H.

1995-06-09

A model-based approach is proposed to solve the oceanic internal wave signal processing problem that is based on state-space representations of the normal-mode vertical velocity and plane wave horizontal velocity propagation models. It is shown that these representations can be utilized to spatially propagate the modal (dept) vertical velocity functions given the basic parameters (wave numbers, Brunt-Vaisala frequency profile etc.) developed from the solution of the associated boundary value problem as well as the horizontal velocity components. Based on this framework, investigations are made of model-based solutions to the signal enhancement problem for internal waves.

Nonlinear modulation of ionization waves

International Nuclear Information System (INIS)

Bekki, Naoaki

1981-01-01

In order to investigate the nonlinear characteristics of ionization waves (moving-striations) in the positive column of glow discharge, a nonlinear modulation of ionization waves in the region of the Pupp critical current is analysed by means of the reductive perturbation method. The modulation of ionization waves is described by a nonlinear Schroedinger type equation. The coefficients of the equation are evaluated using the data of the low pressure Argon-discharge, and the simple solutions (plane wave and envelope soliton type solutions) are presented. Under a certain condition an envelope soliton is propagated through the positive column. (author)

Propagation of Quasi-plane Nonlinear Waves in Tubes

OpenAIRE

P. Koníček; M. Bednařík; M. Červenka

2002-01-01

This paper deals with possibilities of using the generalized Burgers equation and the KZK equation to describe nonlinear waves in circular ducts. A new method for calculating of diffraction effects taking into account boundary layer effects is described. The results of numerical solutions of the model equations are compared. Finally, the limits of validity of the used model equations are discussed with respect to boundary conditions and the radius of the circular duct. The limits of applicabi...

Reflection of P and SV waves at the free surface of a monoclinic ...

Indian Academy of Sciences (India)

The propagation of plane waves in an anisotropic elastic medium possessing monoclinic symmetry is discussed. The expressions for the phase velocity of qP and qSV waves propagating in the plane of elastic symmetry are obtained in terms of the direction cosines of the propagation vector. It is shown that, in general, ...

Continuous contour phase plates for tailoring the focal plane irradiance profile

International Nuclear Information System (INIS)

Dixit, S.N.; Rushford, M.C.; Thomas, I.M.; Perry, M.D.

1995-01-01

We present fully continuous phase screens for producing super-Gaussian focal-plane irradiance profiles. Such phase screens are constructed with the assumption of either circular symmetric near-field and far-field profiles or a separable phase screen in Cartesian co-ordinates. In each case, the phase screen is only a few waves deep. Under illumination by coherent light, such phase screens produce high order super-Gaussian profiles in the focal plane with high energy content effects of beam aberrations on the focal profiles and their energy content are also discussed

Full Wave Function Optimization with Quantum Monte Carlo and Its Effect on the Dissociation Energy of FeS.

Science.gov (United States)

Haghighi Mood, Kaveh; Lüchow, Arne

2017-08-17

Diffusion quantum Monte Carlo calculations with partial and full optimization of the guide function are carried out for the dissociation of the FeS molecule. For the first time, quantum Monte Carlo orbital optimization for transition metal compounds is performed. It is demonstrated that energy optimization of the orbitals of a complete active space wave function in the presence of a Jastrow correlation function is required to obtain agreement with the experimental dissociation energy. Furthermore, it is shown that orbital optimization leads to a 5 Δ ground state, in agreement with experiments but in disagreement with other high-level ab initio wave function calculations which all predict a 5 Σ + ground state. The role of the Jastrow factor in DMC calculations with pseudopotentials is investigated. The results suggest that a large Jastrow factor may improve the DMC accuracy substantially at small additional cost.

Resonance of Superconducting Microstrip Antenna with Aperture in the Ground Plane

Directory of Open Access Journals (Sweden)

S. Benkouda

2013-08-01

Full Text Available This paper presents a rigorous full-wave analysis of a high Tc superconducting rectangular microstrip antenna with a rectangular aperture in the ground plane. To include the effect of the superconductivity of the microstrip patch in the full-wave analysis, a complex surface impedance is considered. The proposed approach is validated by comparing the computed results with previously published data. Results showing the effect of the aperture on the resonance of the superconducting microstrip antenna are given.

Alfven wave resonances and flow induced by nonlinear Alfven waves in a stratified atmosphere

International Nuclear Information System (INIS)

Stark, B. A.; Musielak, Z. E.; Suess, S. T.

1996-01-01

A nonlinear, time-dependent, ideal MHD code has been developed and used to compute the flow induced by nonlinear Alfven waves propagating in an isothermal, stratified, plane-parallel atmosphere. The code is based on characteristic equations solved in a Lagrangian frame. Results show that resonance behavior of Alfven waves exists in the presence of a continuous density gradient and that the waves with periods corresponding to resonant peaks exert considerably more force on the medium than off-resonance periods. If only off-peak periods are considered, the relationship between the wave period and induced longitudinal velocity shows that short period WKB waves push more on the background medium than longer period, non-WKB, waves. The results also show the development of the longitudinal waves induced by finite amplitude Alfven waves. Wave energy transferred to the longitudinal mode may provide a source of localized heating

Pseudopotential approach to superconductivity in MgB2

International Nuclear Information System (INIS)

Sharma, K.S.; Bhargava, Nidhi; Jain, Ritu; Goyal, Varsha; Sharma, Ritu; Sharma, Smita

2010-01-01

Superconductivity in MgB 2 has been re-examined in BCS-Eliashberg framework by employing Mc-Millan's T c -equation and form factors of MgB 2 computed from the form factors of component metals (Model-I). The empty core model pseudopotential due to Ashcroft and random phase approximation form of dielectric screening due to Gellmann and Brueckner are used in the present work. An excellent agreement between the present values and other theoretically computed values of T c and with the relevant experimental data for MgB 2 confirms the validity of the present approach. The explicit dependence of λ and T c on the isotopic masses of Mg and B, as revealed from the present work, confirms the role of lattice vibrations in the superconducting behaviour of MgB 2 and the high value of T c in it may be attributed to the phonon mediated e-e interaction coupled with higher values of phonon frequencies due to light mass of B atoms. It has also been observed that the pseudo-atom model (Model-II) with appropriate choice of the potential parameter r c successfully explains high value of T c and isotope effect in MgB 2 , confirming the prominent role played by electron-phonon interaction in the high-T c superconductivity observed in MgB 2 . The isotope effect exponent α-values obtained from the two models are in complete agreement with each other and the present value α = 0.46 is also much closer to the BCS value of 0.5. Interaction strength N 0 V values obtained from the two models are also in perfect agreement with each other and the present value N 0 V = 0.48 suggests that MgB 2 is a strong coupling superconductor. (author)

ARBITRARY INTERACTION OF PLANE SUPERSONIC FLOWS

Directory of Open Access Journals (Sweden)

P. V. Bulat

2015-11-01

Full Text Available Subject of study.We consider the Riemann problem for parameters at collision of two plane flows at a certain angle. The problem is solved in the exact statement. Most cases of interference, both stationary and non-stationary gas-dynamic discontinuities, followed by supersonic flows can be reduced to the problem of random interaction of two supersonic flows. Depending on the ratio of the parameters in the flows, outgoing discontinuities turn out to be shock waves, or rarefactionwaves. In some cases, there is no solution at all. It is important to know how to find the domain of existence for the relevant decisions, as the type of shock-wave structures in these domains is known in advance. The Riemann problem is used in numerical methods such as the method of Godunov. As a rule, approximate solution is used, known as the Osher solution, but for a number of problems with a high precision required, solution of this problem needs to be in the exact statement. Main results.Domains of existence for solutions with different types of shock-wave structure have been considered. Boundaries of existence for solutions with two outgoing shock waves are analytically defined, as well as with the outgoing shock wave and rarefaction wave. We identify the area of Mach numbers and angles at which the flows interact and there is no solution. Specific flows with two outgoing rarefaction waves are not considered. Practical significance. The results supplement interference theory of stationary gas-dynamic discontinuities and can be used to develop new methods of numerical calculation with extraction of discontinuities.

Stresses in a submarine topography under ocean waves

Energy Technology Data Exchange (ETDEWEB)

Mei, C.C.; McTigue, D.F.

1984-01-01

The problem of submarine slope stability is of interest to both offshore engineering and geology. In an uneven topography, the weight above a horizontal plane induces two-dimensional variation in the static stress field. The action of wave pressure, which changes with depth, further introduces excess pore pressure and dynamic stresses in the sea bottom. In the present paper, we combine a simple analytical theory for the static stress by the present authors, and the recent solution by Mei and Foda for wave-induced stresses in a plane poro-elastic sea bed to account for mild bottom slope and wave shoaling, to obtain the effective stress field in a submarine topography under sea waves. Sample results are given for a ridge and a canyon. In particular the dynamic pore pressure and the combined static and dynamic effective stresses are presented. 10 references, 11 figures.

Three-dimensional instability of standing waves

Science.gov (United States)

Zhu, Qiang; Liu, Yuming; Yue, Dick K. P.

2003-12-01

We investigate the three-dimensional instability of finite-amplitude standing surface waves under the influence of gravity. The analysis employs the transition matrix (TM) approach and uses a new high-order spectral element (HOSE) method for computation of the nonlinear wave dynamics. HOSE is an extension of the original high-order spectral method (HOS) wherein nonlinear wave wave and wave body interactions are retained up to high order in wave steepness. Instead of global basis functions in HOS, however, HOSE employs spectral elements to allow for complex free-surface geometries and surface-piercing bodies. Exponential convergence of HOS with respect to the total number of spectral modes (for a fixed number of elements) and interaction order is retained in HOSE. In this study, we use TM-HOSE to obtain the stability of general three-dimensional perturbations (on a two-dimensional surface) on two classes of standing waves: plane standing waves in a rectangular tank; and radial/azimuthal standing waves in a circular basin. For plane standing waves, we confirm the known result of two-dimensional side-bandlike instability. In addition, we find a novel three-dimensional instability for base flow of any amplitude. The dominant component of the unstable disturbance is an oblique (standing) wave oriented at an arbitrary angle whose frequency is close to the (nonlinear) frequency of the original standing wave. This finding is confirmed by direct long-time simulations using HOSE which show that the nonlinear evolution leads to classical Fermi Pasta Ulam recurrence. For the circular basin, we find that, beyond a threshold wave steepness, a standing wave (of nonlinear frequency Omega) is unstable to three-dimensional perturbations. The unstable perturbation contains two dominant (standing-wave) components, the sum of whose frequencies is close to 2Omega. From the cases we consider, the critical wave steepness is found to generally decrease/increase with increasing radial

Experimental Study on Corrosion Detection of Aluminum Alloy Using Lamb Wave Mixing Technique

Energy Technology Data Exchange (ETDEWEB)

Choi, Heeung; Lee, Jaesun; Cho, Younho [Pusan Nat’l Univ., Busan (Korea, Republic of)

2016-11-15

In this study, the Lamb wave mixing technique, which is basised on advanced research on the nonlinear bulk wave mixing technique, is applied for corrosion detection. To demonstrate the validity of the Lamb wave mixing technique, an experiment was performed with normal and corroded specimens. Comparison group in an experimentation are selected to mode and frequency with dominant in-plane displacement and out-of-plane displacement of Lamb waves. The results showed that the Lamb wave mixing technique can monitor corrosion defects, and it has a trend similar to that of the conventional Lamb wave technique. It was confirmed that the dominant displacement and mode matching the theory were generated. Flaw detectability is determined depending on displacement ratio instead of using the measurement method and mode selection.

Nonlinear elastic waves in materials

CERN Document Server

Rushchitsky, Jeremiah J

2014-01-01

The main goal of the book is a coherent treatment of the theory of propagation in materials of nonlinearly elastic waves of displacements, which corresponds to one modern line of development of the nonlinear theory of elastic waves. The book is divided on five basic parts: the necessary information on waves and materials; the necessary information on nonlinear theory of elasticity and elastic materials; analysis of one-dimensional nonlinear elastic waves of displacement – longitudinal, vertically and horizontally polarized transverse plane nonlinear elastic waves of displacement; analysis of one-dimensional nonlinear elastic waves of displacement – cylindrical and torsional nonlinear elastic waves of displacement; analysis of two-dimensional nonlinear elastic waves of displacement – Rayleigh and Love nonlinear elastic surface waves. The book is addressed first of all to people working in solid mechanics – from the students at an advanced undergraduate and graduate level to the scientists, professional...

Penetration of an ordinary wave into a weakly inhomogeneous magnetoplasma at oblique incidence

International Nuclear Information System (INIS)

Preinhaelter, J.

1973-12-01

The propagation was studied of high-frequency electromagnetic waves in a plane-stratified weakly inhomogeneous plasma. The density gradient was assumed to be perpendicular to the external magnetic field and the wave vector was not considered to be generally parallel to the plane given by the two former vectors. The analysis shows that an ordinary wave may penetrate the plasma resonance region if the orientation of the vacuum wave vector is appropriately chosen. Analytical expressions for the reflexion and transmission coefficients were obtained and their dependence on the direction cosines of the wave vector of the incident wave was studied. It is also briefly shown that after the transmission through plasma resonance the ordinary wave was transformed into an extraordinary wave and the latter was reflected back to the region of hybrid resonance. In this region the extraordinary wave was fully transformed into the Bernstein modes. (author)

Effects of Medium Characteristics on Laser RCS of Airplane with E-Wave Polarization

Directory of Open Access Journals (Sweden)

Hosam El-Ocla

2015-01-01

Full Text Available Plane wave incidence should be postulated to have an authentic target detection. Practically, the plane wave is incapable usually of keeping its power in the far field especially when propagating through an inhomogeneous medium. Consequently, we assume an incident beam wave with a finite width around the target. In this work, we calculate numerically a laser radar cross section (LRCS of conducting targets having smooth cross sections with inflection points such as airplane in random media. Effects of fluctuations intensity of random media on the LRCS performance are studied in this paper. E-wave polarization (E-wave incidence is considered while the mean target size is approximately twice the wavelength.

Damage detection in composite panels based on mode-converted Lamb waves sensed using 3D laser scanning vibrometer

Science.gov (United States)

Pieczonka, Łukasz; Ambroziński, Łukasz; Staszewski, Wiesław J.; Barnoncel, David; Pérès, Patrick

2017-12-01

This paper introduces damage identification approach based on guided ultrasonic waves and 3D laser Doppler vibrometry. The method is based on the fact that the symmetric and antisymmetric Lamb wave modes differ in amplitude of the in-plane and out-of-plane vibrations. Moreover, the modes differ also in group velocities and normally they are well separated in time. For a given time window both modes can occur simultaneously only close to the wave source or to a defect that leads to mode conversion. By making the comparison between the in-plane and out-of-plane wave vector components the detection of mode conversion is possible, allowing for superior and reliable damage detection. Experimental verification of the proposed damage identification procedure is performed on fuel tank elements of Reusable Launch Vehicles designed for space exploration. Lamb waves are excited using low-profile, surface-bonded piezoceramic transducers and 3D scanning laser Doppler vibrometer is used to characterize the Lamb wave propagation field. The paper presents theoretical background of the proposed damage identification technique as well as experimental arrangements and results.

Analysis of a plane stress wave by the moving least squares method

Directory of Open Access Journals (Sweden)

Wojciech Dornowski

2014-08-01

Full Text Available A meshless method based on the moving least squares approximation is applied to stress wave propagation analysis. Two kinds of node meshes, the randomly generated mesh and the regular mesh are used. The nearest neighbours’ problem is developed from a triangulation that satisfies minimum edges length conditions. It is found that this method of neighbours’ choice significantly improves the solution accuracy. The reflection of stress waves from the free edge is modelled using fictitious nodes (outside the plate. The comparison with the finite difference results also demonstrated the accuracy of the proposed approach.[b]Keywords[/b]: civil engineering, meshless method, moving least squares method, elastic waves

Spin waves in terbium. III. Magnetic anisotropy at zero wave vector

DEFF Research Database (Denmark)

Houmann, Jens Christian Gylden; Jensen, J.; Touborg, P.

1975-01-01

The energy gap at zero wave vector in the spin-wave dispersion relation of ferromagnetic. Tb has been studied by inelastic neutron scattering. The energy was measured as a function of temperature and applied magnetic field, and the dynamic anisotropy parameters were deduced from the results...... the effects of zero-point deviations from the fully aligned ground state, and we tentatively propose polarization-dependent two-ion couplings as their origin........ The axial anisotropy is found to depend sensitively on the orientation of the magnetic moments in the basal plane. This behavior is shown to be a convincing indication of considerable two-ion contributions to the magnetic anisotropy at zero wave vector. With the exception of the sixfold basal...

Optimal Control Of Nonlinear Wave Energy Point Converters

DEFF Research Database (Denmark)

Nielsen, Søren R.K.; Zhou, Qiang; Kramer, Morten

2013-01-01

idea behind the control strategy is to enforce the stationary velocity response of the absorber into phase with the wave excitation force at any time. The controller is optimal under monochromatic wave excitation. It is demonstrated that the devised causal controller, in plane irregular sea states...

Polarisations of quasi-waves in a general anisotropic porous solid ...

Indian Academy of Sciences (India)

in fluid-saturated porous media was developed by. Biot (1956). ... anisotropic permeability controlling the flow of vis- cous fluid in its pores. ..... solid: III reflection of plane waves at a free plane boundary (general case); Bull. Seism. Soc. Am. 52.

Inertia–gravity wave radiation from the elliptical vortex in the f -plane shallow water system

Energy Technology Data Exchange (ETDEWEB)

Sugimoto, Norihiko, E-mail: nori@phys-h.keio.ac.jp [Research and Education Center for Natural Sciences, Department of Physics, Keio University, 4-1-1 Hiyoshi, Kouhoku-ku, Yokohama, Kanagawa 223-8521 (Japan)

2017-04-15

Inertia–gravity wave (IGW) radiation from the elliptical vortex is investigated in the f -plane shallow water system. The far field of IGW is analytically derived for the case of an almost circular Kirchhoff vortex with a small aspect ratio. Cyclone–anticyclone asymmetry appears at finite values of the Rossby number (Ro) caused by the source originating in the Coriolis acceleration. While the intensity of IGWs from the cyclone monotonically decreases as f increases, that from the anticyclone increases as f increases for relatively smaller f and has a local maximum at intermediate f . A numerical experiment is conducted on a model using a spectral method in an unbounded domain. The numerical results agree quite well with the analytical ones for elliptical vortices with small aspect ratios, implying that the derived analytical forms are useful for the verification of the numerical model. For elliptical vortices with larger aspect ratios, however, significant deviation from the analytical estimates appears. The intensity of IGWs radiated in the numerical simulation is larger than that estimated analytically. The reason is that the source of IGWs is amplified during the time evolution because the shape of the vortex changes from ideal ellipse to elongated with filaments. Nevertheless, cyclone–anticyclone asymmetry similar to the analytical estimate appears in all the range of aspect ratios, suggesting that this asymmetry is a robust feature. (paper)

3D synthetic aperture imaging using a virtual source element in the elevation plane

DEFF Research Database (Denmark)

Nikolov, Svetoslav; Jensen, Jørgen Arendt

2000-01-01

. However, the resolution in the elevation plane is determined by the fixed mechanical elevation focus. This paper suggests to post-focus the RF lines from several adjacent planes in the elevation direction using the elevation focal point of the transducer as a virtual source element, in order to obtain...... dynamic focusing in the elevation plane. A 0.1 mm point scatterer was mounted in an agar block and scanned in a water bath. The transducer is a 64 elements linear array with a pitch of 209 μm. The transducer height is 4 mm in the elevation plane and it is focused at 20 mm giving a F-number of 5. The point...... are passed through a second beamformer, in which the fixed focal points in the elevation plane are treated as virtual sources of spherical waves. Synthetic aperture focusing is applied on them. The -6 dB resolution in the elevation plane is increased from 7 mm to 2 mm. This gives a uniform point spread...

2D full-wave simulation of waves in space and tokamak plasmas

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Kim Eun-Hwa

2017-01-01

Full Text Available Simulation results using a 2D full-wave code (FW2D for space and NSTX fusion plasmas are presented. The FW2D code solves the cold plasma wave equations using the finite element method. The wave code has been successfully applied to describe low frequency waves in planetary magnetospheres (i.e., dipole geometry and the results include generation and propagation of externally driven ultra-low frequency waves via mode conversion at Mercury and mode coupling, refraction and reflection of internally driven field-aligned propagating left-handed electromagnetic ion cyclotron (EMIC waves at Earth. In this paper, global structure of linearly polarized EMIC waves is examined and the result shows such resonant wave modes can be localized near the equatorial plane. We also adopt the FW2D code to tokamak geometry and examine radio frequency (RF waves in the scape-off layer (SOL of tokamaks. By adopting the rectangular and limiter boundary, we compare the results with existing AORSA simulations. The FW2D code results for the high harmonic fast wave heating case on NSTX with a rectangular vessel boundary shows excellent agreement with the AORSA code.

2D full-wave simulation of waves in space and tokamak plasmas

Science.gov (United States)

Kim, Eun-Hwa; Bertelli, Nicola; Johnson, Jay; Valeo, Ernest; Hosea, Joel

2017-10-01

Simulation results using a 2D full-wave code (FW2D) for space and NSTX fusion plasmas are presented. The FW2D code solves the cold plasma wave equations using the finite element method. The wave code has been successfully applied to describe low frequency waves in planetary magnetospheres (i.e., dipole geometry) and the results include generation and propagation of externally driven ultra-low frequency waves via mode conversion at Mercury and mode coupling, refraction and reflection of internally driven field-aligned propagating left-handed electromagnetic ion cyclotron (EMIC) waves at Earth. In this paper, global structure of linearly polarized EMIC waves is examined and the result shows such resonant wave modes can be localized near the equatorial plane. We also adopt the FW2D code to tokamak geometry and examine radio frequency (RF) waves in the scape-off layer (SOL) of tokamaks. By adopting the rectangular and limiter boundary, we compare the results with existing AORSA simulations. The FW2D code results for the high harmonic fast wave heating case on NSTX with a rectangular vessel boundary shows excellent agreement with the AORSA code.