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At least 163 records · Page 9

Boundary conditions manipulation of polar vortex domains in BiFeO 3 membranes via phase-field simulations

Polar vortex domains have recently become an emergent research field due to the abundant physical phenomena and potential applications in high-density memories. Here, we explore the mechanisms of creating polar vortex domains in the BiFeO3 (BFO) membranes subjected to different boundary conditions using phase-field simulations. A major difference is that the vortex in membrane can be stabilized even under short-circuit electrical boundary conditions compared to vortex in other systems, such as thin film or superlattice. We found that (a) the formation of polar vortex domains at the membrane interior under bending is mainly driven by the reduction of elastic energy under short-circuit boundary condition, and the vortex chirality (namely, clockwise and counterclockwise) could be identified by n-shape and u-shape bending; (b) in the unbent open-circuit BFO membrane case, exotic trapezoid-shaped vortex nanodomains form at the terminations of 109 degrees domain walls (DWs) and partially charged 71 degrees DWs, which is driven by the local depolarization field and the interplay among electrostatic, elastic, and gradient and Landau energies. We also examine Kittel's law by establishing the dependence of vortex periods on the membrane thickness. Furthermore, these results give further understanding of the effect of boundary conditions on the formation of polar vortex domains, guiding experimental designs of vortex-based high-density memories.

36 MATERIALS SCIENCE↗

Global Discrete Artificial Boundary Conditions for Time-Dependent Wave Propagation

We construct global artificial boundary conditions (ABCs) for the numerical simulation of wave processes on unbounded domains using a special non-deteriorating algorithm that has been developed previously for the long-term computation of wave-radiation solutions. The ABCs are obtained directly for the discrete formulation of the problem; in so doing, neither a rational approximation of 'non-reflecting kernels,' nor discretization of the continuous boundary conditions is required. The extent of temporal nonlocality of the new ABCs appears fixed and limited; in addition, the ABCs can handle artificial boundaries of irregular shape on regular grids with no fitting/adaptation needed and no accuracy loss induced. The non-deteriorating algorithm, which is the core of the new ABCs is inherently three-dimensional, it guarantees temporally uniform grid convergence of the solution driven by a continuously operating source on arbitrarily long time intervals, and provides unimprovable linear computational complexity with respect to the grid dimension. The algorithm is based on the presence of lacunae, i.e., aft fronts of the waves, in wave-type solutions in odd-dimension spaces, It can, in fact, be built as a modification on top of any consistent and stable finite-difference scheme, making its grid convergence uniform in time and at the same time keeping the rate of convergence the same as that of the non-modified scheme. In the paper, we delineate the construction of the global lacunae-based ABCs in the framework of a discretized wave equation. The ABCs are obtained for the most general formulation of the problem that involves radiation of waves by moving sources (e.g., radiation of acoustic waves by a maneuvering aircraft). We also present systematic numerical results that corroborate the theoretical design properties of the ABCs' algorithm.

Ryabenkii, V. S.↗

Radiation boundary conditions for wave-like equations

In the numerical computation of hyperbolic equations it is not practical to use infinite domains; instead, the domain is truncated with an artificial boundary. In the present study, a sequence of radiating boundary conditions is constructed for wave-like equations. It is proved that as the artificial boundary is moved to infinity the solution approaches the solution of the infinite domain as O(r exp -m-1/2) for the m-th boundary condition. Numerical experiments with problems in jet acoustics verify the practical nature of the boundary conditions.

Bayliss, A.↗

Investigation of Boundary Conditions for Flexible Multibody Spacecraft Dynamics

In support of both the Space Shuttle and International Space Station programs, a set of generic multibody dynamics algorithms integrated within the Trick simulation environment have addressed the variety of on-orbit manipulator simulation requirements for engineering analysis, procedures development and crew familiarization/training at the NASA Johnson Space Center (JSC). Enhancements to these dynamics algorithms are now being driven by a new set of Constellation program requirements for flexible multibody spacecraft simulation. One particular issue that has been discussed within the NASA community is the assumption of cantilever-type flexible body boundary conditions. This assumption has been commonly utilized within manipulator multibody dynamics formulations as it simplifies the computation of relative motion for articulated flexible topologies. Moreover, its use for modeling of space-based manipulators such as the Shuttle Remote Manipulator System (SRMS) and Space Station Remote Manipulator System (SSRMS) has been extensively validated against flight data. For more general flexible spacecraft applications, however, the assumption of cantilever-type boundary conditions may not be sufficient. This paper describes the boundary condition assumptions that were used in the original formulation, demonstrates that this formulation can be augmented to accommodate systems in which the assumption of cantilever boundary conditions no longer applies, and verifies the approach through comparison with an independent model previously validated against experimental hardware test data from a spacecraft flexible dynamics emulator.

Boundary-value problems↗

Critical effects of downstream boundary conditions on vortex breakdown

The unsteady, compressible, full Navier-Stokes (NS) equations are used to study the critical effects of the downstream boundary conditions on the supersonic vortex breakdown. The present study is applied to two supersonic vortex breakdown cases. In the first case, quasi-axisymmetric supersonic swirling flow is considered in a configured circular duct, and in the second case, quasi-axisymmetric supersonic swirling jet, that is issued from a nozzle into a supersonic jet of lower Mach number, is considered. For the configured duct flow, four different types of downstream boundary conditions are used, and for the swirling jet flow from the nozzle, two types of downstream boundary conditions are used. The solutions are time accurate which are obtained using an implicit, upwind, flux-difference splitting, finite-volume scheme.

Kandil, Osama↗

Numerical tests of a modified full implicit continuous Eulerian (FICE) scheme with projected normal characteristic boundary conditions for MHD flows

A numerical method has been developed based on a modified full implicit continuous Eulerian (FICE) scheme and projected normal characteristic boundary conditions for simulating MHD flows which undergo a long process of evolution. An astrophysical flow is chosen for illustration of this procedure, and numerical tests are made to verify the computational stability and physically realistic solution. Three computational tests have been accomplished; they are tests of solving methods, characteristic boundary condition, and time steps. The tests show that the program from the modified FICE scheme with proper boundary conditions and time steps can be made numerically stable for a time long enough to obtain physically plausible solutions.

Wu, S. T.↗

A new method of imposing boundary conditions in pseudospectral approximations of hyperbolic equations

A new method to impose boundary conditions for pseudospectral approximations to hyperbolic equations is suggested. This method involves the collocation of the equation at the boundary nodes as well as satisfying boundary conditions. Stability and convergence results are proven for the Chebyshev approximation of linear scalar hyperbolic equations. The eigenvalues of this method applied to parabolic equations are shown to be real and negative.

Funaro, D.↗

Integral boundary conditions in phase field models

Modeling the chemical, electric and thermal transport as well as phase transitions and the accompanying mesoscale microstructure evolution within a material in an electronic device setting involves the solution of partial differential equations often with integral boundary conditions. Employing the familiar Poisson equation describing the electric potential evolution in a material exhibiting insulator to metal transitions, we exploit a special property of such an integral boundary condition, and we properly formulate the variational problem and establish its well-posedness. Next, we compare our method with the commonly-used Lagrange multiplier method that can also handle such boundary conditions. Numerical experiments demonstrate that our new method achieves optimal convergence rate in contrast to the conventional Lagrange multiplier method. Furthermore, the linear system derived from our method is symmetric positive definite, and can be efficiently solved by Conjugate Gradient method with algebraic multigrid preconditioning.

97 MATHEMATICS AND COMPUTING↗

Nonreflecting far-field boundary conditions for unsteady transonic flow computation

The approximate nonreflecting far-field boundary condition, as proposed by Engquist and Majda, is implemented in the computer code LTRAN2. This code solves the implicit finite-difference representation of the small disturbance equations for unsteady transonic flows about airfoils. The nonreflecting boundary condition and the description of the algorithm for implementing these conditions in LTRAN2 are discussed. Various cases are computed and compared with results from the older, more conventional procedures. One concludes that the nonreflecting far-field boundary approximation allows the far-field boundary to be located closer to the airfoil; this permits a decrease in the computer time required to obtain the solution through the use of fewer mesh points.

Kwak, D.↗

Nonreflecting Far-Field Boundary Conditions for Unsteady Transonic Flow Computation

The approximate nonreflecting far-field boundary condition, as proposed by Engquisi and Majda, is implemented In the computer code LTRAN2. This code solves the Implicit finite-difference representation of the small-disturbance equations for unsteady transonic flows about airfoils. The nonreflecting boundary condition and the description of the algorithm for Implementing these conditions In LTRAN2 tire discussed. Various cases re computed and compared with results from the older, more conventional procedures. One concludes that the nonreflecting far-field boundary approximation allows the far-field boundary to be located closer to the airfoil; this permits a decrease in the computer lime required to obtain the solution through the use of fewer mesh points.

Kwak, D.↗

Periodic boundary conditions for arbitrary deformations in molecular dynamics simulations

A generalization of the Lees-Edwards periodic boundary conditions (gLE-PBC) for molecular dynamics (MD) simulations is developed to allow for arbitrary deformations to be applied to the domain. The gLE-PBC domain remains a rectangular cuboid regardless of the applied deformation in contrast with the Lagrangian-rhomboid periodic boundary conditions (LR-PBC) where the domain deforms according to the applied deformation. Furthermore, the kinematics of gLE-PBC are validated against pure shear. The gLE-PBC method for interacting systems is then validated against the LR-PBC method and analytical solutions for a solid under isotropic compression, one-dimensional shearing, three-dimensional extension and shearing and for a liquid under Couette flow. Bulk physical properties extracted from the gLE-PBC simulations agree well with values calculated from equilibrium MD simulations. Three dimensional shearing and a deformation with a full velocity gradient matrix are also simulated, showing the range of problems gLE-PBC can explore.

74 ATOMIC AND MOLECULAR PHYSICS↗

A stable penalty method for the compressible Navier-Stokes equations. 1: Open boundary conditions

The purpose of this paper is to present asymptotically stable open boundary conditions for the numerical approximation of the compressible Navier-Stokes equations in three spatial dimensions. The treatment uses the conservation form of the Navier-Stokes equations and utilizes linearization and localization at the boundaries based on these variables. The proposed boundary conditions are applied through a penalty procedure, thus ensuring correct behavior of the scheme as the Reynolds number tends to infinity. The versatility of this method is demonstrated for the problem of a compressible flow past a circular cylinder.

Hesthaven, J. S.↗

Vibration of thermally stressed plates with various boundary conditions.

By discarding Lurie's (1952) assumption of mode identity, it is shown that linear theory correctly predicts the frequency of all modes of a thermally stressed cantilever plate as well as the frequency and modes of plates with other boundary conditions. The thermal stress distribution is obtained for whatever temperature distribution and boundary conditions that may be specified. Experimental results are compared to calculated results for several different plates. Boundary conditions for the plates range from a plate with edges completely clamped to a plate with edges completely free with various other combinations of mixed and uniform edge conditions. Comparison of calculated data to experimental data shows that accurate, quantitative results can be obtained from linear theory for 'as cut' real plates for a significant range of heating when the assumption of mode identity is discarded.

Bailey, C. D.↗

An Extension of the Truncated Ingard-Myers Impedance Boundary Condition for High Mach Number Grazing Flows

The Ingard-Myers impedance boundary condition is widely recognized to be prone to hydrodynamic Kelvin-Helmholtz-type instability, primarily due to its use of a vortex sheet to model the flow at the boundary. Recently, a stabilized approximation of the Ingard-Myers condition, called the Truncated Ingard-Myers Impedance Boundary Condition (TIMIBC), has been introduced. This approximation offers a good representation of the Ingard-Myers condition for grazing flows characterized by low to mid subsonic Mach numbers. This paper explores an extension of the TIMIBC, referred to as TIMIBC-ext, designed for liners in grazing flows with high subsonic Mach numbers. The TIMIBC-ext introduces a tunable parameter and demonstrates that by judiciously selecting the parameter value, the accuracy of the TIMIBC can be improved for either upstream or downstream propagating waves in grazing flows with high subsonic Mach numbers. Consequently, the TIMIBC-ext represents an enhancement to the TIMIBC when the location of the source relative to the liner (upstream or downstream) is known. Time domain implementations of the TIMIBC-ext are also provided, employing a multipole expansion model for the impedance function. A numerical example is provided to assess the performance of the TIMIBC-ext, comparing computational results with measurements from a recent set of measurements in the NASA Langley Grazing Flow Impedance Tube.

time domain acoustic scattering↗

On the Effective Construction of Compactly Supported Wavelets Satisfying Homogenous Boundary Conditions on the Interval

We construct compactly supported wavelet bases satisfying homogeneous boundary conditions on the interval (0,1). The maximum features of multiresolution analysis on the line are retained, including polynomial approximation and tree algorithms. The case of H(sub 0)(sup 1)(0, 1)is detailed, and numerical values, required for the implementation, are provided for the Neumann and Dirichlet boundary conditions.

Chiavassa, G.↗

Unsteady Validation of a Mean Flow Boundary Condition for Computational Aeroacoustics

In this work, a previously developed mean flow boundary condition will be validated for unsteady flows. The test cases will be several reference benchmark flows consisting of vortical gusts convecting in a uniform mean flow, as well as the more realistic case of a vortical gust impinging on a loaded 2D cascade. The results will verify that the mean flow boundary condition both imposes the desired mean flow as well as having little or no effect on the instantaneous unsteady solution.

Hixon, R.↗