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At least 73 records · Page 4

A comparison study on peridynamic models using irregular non-uniform spatial discretization

The applicability of peridynamic models to problems with irregular non-uniformly discretized solution domain is critical. In this study, a systematic comparison study on results predicted by eight peridynamic models, including bond-based, ordinary state-based and non-ordinary state-based mechanics and heat conduction models, for three different types of problems, including thermal, mechanical and coupled thermo-mechanical, with irregular spatial discretization are performed. It’s found that for the case of irregular but semi-uniform spatial discretization, all these models yield good predictions compared to analytical local solutions. For the case of irregular and non-uniform spatial discretization, models formulated specifically for this configuration give much better results than the conventional formulations which don’t consider the neighborhood difference among material points in the spatial discretization. As a result for either cases of spatial discretization, the bond-associated correspondence material model predicts the most accurate results.

42 ENGINEERING↗

EXAGRAPH: Graph and combinatorial methods for enabling exascale applications

Combinatorial algorithms in general and graph algorithms in particular play a critical enabling role in numerous scientific applications. However, the irregular memory access nature of these algorithms makes them one of the hardest algorithmic kernels to implement on parallel systems. With tens of billions of hardware threads and deep memory hierarchies, the exascale computing systems in particular pose extreme challenges in scaling graph algorithms. The codesign center on combinatorial algorithms, ExaGraph, was established to design and develop methods and techniques for efficient implementation of key combinatorial (graph) algorithms chosen from a diverse set of exascale applications. Algebraic and combinatorial methods have a complementary role in the advancement of computational science and engineering, including playing an enabling role on each other. In this paper, we survey the algorithmic and software development activities performed under the auspices of ExaGraph from both a combinatorial and an algebraic perspective. In particular, we detail our recent efforts in porting the algorithms to manycore accelerator (GPU) architectures. We also provide a brief survey of the applications that have benefited from the scalable implementations of different combinatorial algorithms to enable scientific discovery at scale. We believe that several applications will benefit from the algorithmic and software tools developed by the ExaGraph team.

97 MATHEMATICS AND COMPUTING↗

Performance Modeling of Vectorized SNAP Inter-Atomic Potentials on CPU Architectures.

SNAP potentials are inter-atomic potentials for molecular dynamics that enable simulations at accuracy levels comparable to density functional theory(DFT) at a fraction of the cost. As such, SNAP scales to on the order of 10 4 — 10 6 atoms. In this work, we explore CPU optimization of potentials computation using SIMD. We note that efficient use of SIMD is non-obvious as the application features an irregular iteration space for various potential terms, necessitating use of SIMD across atoms in a cross matrix, batched fashion. We present a preliminary analytic model to determine the correct batch size for several CPU architectures across several vendors, and show end-to-end speedups between 1.66x and 3.22x compared to the original.

74 ATOMIC AND MOLECULAR PHYSICS↗

Robotic servicing system for space material experiment

A containerless image furnace with an electrostatic positioning device has been developed as one of the material experiment facilities on the Japanese experimental module (JEM). It is characterized by heating/melting/cooling the sample whose position is kept without any contacts by actively controlled electrostatic force exerted between the sample and a set of electrodes. The experiment using the image furnace requires various servicing operations. We have been developing a robotic servicing system with an internal robot accommodated in the rack as an alternative to the crew. It aims to reduce the load on the crew by automating regular tasks and to increase the flexibility applicable to simple irregular tasks by introducing a remote teleoperation scheme. The present robot has poor capability to replace the crew. In order to compensate it, introducing of the concept of the robot friendliness and improving the controllability of the teleoperation by the ground operator aids are essential. In this paper, we identify the tasks to be performed by the robotic servicing system and discuss the way to compensate the capability of the robot. In addition we describe the evaluation tests using an experimental model.

Yamawaki, Toshihiko↗

An Automated Approach to Very High Order Aeroacoustic Computations in Complex Geometries

Computational aeroacoustics requires efficient, high-resolution simulation tools. And for smooth problems, this is best accomplished with very high order in space and time methods on small stencils. But the complexity of highly accurate numerical methods can inhibit their practical application, especially in irregular geometries. This complexity is reduced by using a special form of Hermite divided-difference spatial interpolation on Cartesian grids, and a Cauchy-Kowalewslci recursion procedure for time advancement. In addition, a stencil constraint tree reduces the complexity of interpolating grid points that are located near wall boundaries. These procedures are used to automatically develop and implement very high order methods (>15) for solving the linearized Euler equations that can achieve less than one grid point per wavelength resolution away from boundaries by including spatial derivatives of the primitive variables at each grid point. The accuracy of stable surface treatments is currently limited to 11th order for grid aligned boundaries and to 2nd order for irregular boundaries.

Dyson, Rodger W.↗

Automated Approach to Very High-Order Aeroacoustic Computations

Computational aeroacoustics requires efficient, high-resolution simulation tools. For smooth problems, this is best accomplished with very high-order in space and time methods on small stencils. However, the complexity of highly accurate numerical methods can inhibit their practical application, especially in irregular geometries. This complexity is reduced by using a special form of Hermite divided-difference spatial interpolation on Cartesian grids, and a Cauchy-Kowalewski recursion procedure for time advancement. In addition, a stencil constraint tree reduces the complexity of interpolating grid points that am located near wall boundaries. These procedures are used to develop automatically and to implement very high-order methods (> 15) for solving the linearized Euler equations that can achieve less than one grid point per wavelength resolution away from boundaries by including spatial derivatives of the primitive variables at each grid point. The accuracy of stable surface treatments is currently limited to 11th order for grid aligned boundaries and to 2nd order for irregular boundaries.

Dyson, Rodger W.↗

Runtime Scheduling Policies for Distributed Graph Algorithms

In this paper we explore scheduling and runtime system support for unordered distributed graph computations that rely on optimistic (speculative) execution. Performance of such algorithms is impacted by two competing trends: the higher degree of parallelism enabled by optimistic execution in turn requires substantial runtime support. To address the potentially high overhead and scheduling complexity introduced by the runtime, we investigate customizable scheduling policies that augment the scheduler of the underlying runtime to adapt it to a specific graph application. We present several implementations of Distributed Control (DC), a data-driven unordered approach with work prioritization and demonstrate that customizable scheduling policies result in the most efficient implementation, outperforming the well-known -stepping Single-Source Shortest Paths (SSSP) and Jones-Plassmann vertex-coloring algorithms. We apply two scheduling techniques, flow control and adaptive frequency of network progress, which allow application-level control over the balance of domain work and the runtime work. Experimental results show the benefit of such application-aware scheduling for irregular distributed graph algorithms.

Firoz, Jesun S.↗

Software support for irregular and loosely synchronous problems

A large class of scientific and engineering applications may be classified as irregular and loosely synchronous from the perspective of parallel processing. We present a partial classification of such problems. This classification has motivated us to enhance FORTRAN D to provide language support for irregular, loosely synchronous problems. We present techniques for parallelization of such problems in the context of FORTRAN D.

Choudhary, A.↗

Performance characterization of irregular I/O at the extreme scale

Here, this paper reports our experience with irregular I/O and describes lessons learned when running applications with such I/O on supercomputers at the extreme scale. Specifically, we study how irregularities in I/O patterns (i.e., irregular amount of data written per process at each I/O step) in scientific simulations can cause increasing I/O times and substantial loss in scalability. To this end, we quantify the impact of irregular I/O patterns on the I/O performance of scientific applications at the extreme scale by statistically modeling the irregular I/O behavior of two scientific applications: the Monte Carlo application QMCPack and the adaptive mesh refinement application ENZO. For our testing, we feed our model into I/O kernels of two well-known I/O data models (i.e., ADIOS and HDF) to measure the performance of the two applications’ I/O under different I/O settings. Empirically, we show how the growing data sizes and the irregular I/O patterns in these applications are both relevant factors impacting performance.

97 MATHEMATICS AND COMPUTING↗

Light Scattering by Gaussian Particles: A Solution with Finite-Difference Time Domain Technique

The understanding of single-scattering properties of complex ice crystals has significance in atmospheric radiative transfer and remote-sensing applications. In this work, light scattering by irregularly shaped Gaussian ice crystals is studied with the finite-difference time-domain (FDTD) technique. For given sample particle shapes and size parameters in the resonance region, the scattering phase matrices and asymmetry factors are calculated. It is found that the deformation of the particle surface can significantly smooth the scattering phase functions and slightly reduce the asymmetry factors. The polarization properties of irregular ice crystals are also significantly different from those of spherical cloud particles. These FDTD results could provide a reference for approximate light-scattering models developed for irregular particle shapes and can have potential applications in developing a much simpler practical light scattering model for ice clouds angular-distribution models and for remote sensing of ice clouds and aerosols using polarized light. (copyright) 2003 Elsevier Science Ltd. All rights reserved.

Sun, W.↗

Simple method for highlighting the temperature distribution into a liquid sample heated by microwave power field

Microwave induced heating is widely used in medical treatments, scientific and industrial applications. The temperature field inside a microwave heated sample is often inhomogenous, therefore multiple temperature sensors are required for an accurate result. Nowadays, non-contact (Infra Red thermography or microwave radiometry) or direct contact temperature measurement methods (expensive and sophisticated fiber optic temperature sensors transparent to microwave radiation) are mainly used. IR thermography gives only the surface temperature and can not be used for measuring temperature distributions in cross sections of a sample. In this paper we present a very simple experimental method for temperature distribution highlighting inside a cross section of a liquid sample, heated by a microwave radiation through a coaxial applicator. The method proposed is able to offer qualitative information about the heating distribution, using a temperature sensitive liquid crystal sheet. Inhomogeneities as smaller as 1°-2°C produced by the symmetry irregularities of the microwave applicator can be easily detected by visual inspection or by computer assisted color to temperature conversion. Therefore, the microwave applicator is tuned and verified with described method until the temperature inhomogeneities are solved.

36 MATERIALS SCIENCE↗

A Block-Structured Adaptive Mesh Framework to Solve Radiation Transfer Equation in Irregular Embedded Geometries

Radiation transport arises in various scientific, industrial, and medical fields, and understanding its effect in applications is needed to make accurate predictions, safety assessments and performance optimizations. Solving the Radiation Transport Equation (RTE) is challenging due to its integro-differential nature, which involves both differential and integral terms. The differential term describes the change in radiation intensity due to absorption and emission, while the integral term accounts for scattering. The accurate modeling of radiation is further complicated in many applications due to the complex, irregular geometries. Various methods exist for solving the RTE, including the zonal, Monte Carlo, spherical harmonics, discrete ordinates, and finite volume methods. Traditional mesh-based approaches, which rely on structured or unstructured meshes, struggle with irregular geometries due to: a) the difficulty of conforming structured grids to irregular domains, b) challenges in enforcing boundary conditions correctly, and c) the additional computational cost of unstructured mesh methods. This work presents a second-order accurate method for solving the RTE in irregular geometries. The radiation intensity is discretized using the finite-volume method in both spatial and angular directions on regular Cartesian grid blocks. Leveraging the block-structured adaptive mesh refinement (AMR) framework provided by AMReX, our method refines the grid locally to reduce spatial discretization error, ensuring a converged numerical solution while minimizing computational costs elsewhere. A two-stage deferred correction approach is employed: First, a first-order discretization on grid blocks is solved using an algebraic multigrid method in HYPRE. Second, a correction term is applied explicitly to achieve second-order accuracy. The correction term is calculated by approximating the radiation flux on cell faces using a Total Variation Diminishing (TVD) scheme. This approach ensures quick convergence of the multigrid method while preserving higher-order accuracy of the numerical solution. Irregular geometries are resolved as embedded boundaries (EB), resulting in both cut cells and regular cells. In cut cells, we modify the fluxes using face fractions and incorporate additional contributions from EB boundary conditions. To ensure higher-order convergence near the EB interface, the correction term is modified by interpolating the radiation intensity to fictitious ghost points. The implementation takes advantage of modern supercomputers by leveraging AMReX’sMPI/X parallelization strategy where X can be MPI or a GPU accelerator including CUDA, HIP and DPC++. We validate our solver using classical test cases, both with and without EB, demonstrating accuracy and efficiency. Additionally, we analyze the impact of adaptive mesh refinement on solution accuracy and computational cost, highlighting the advantages of our approach for high-resolution radiation transport simulations.

computational fluid dynamics (CFD)↗

Experiments on the applicability of MAE techniques for predicting sound diffraction by irregular terrains

The sound field diffracted by a single smooth hill of finite impedance is studied both analytically, within the context of the theory of Matched Asymptotic Expansions (MAE), and experimentally, under laboratory scale modeling conditions. Special attention is given to the sound field on the diffracting surface and throughout the transition region between the illuminated and the shadow zones. The MAE theory yields integral equations that are amenable to numerical computations. Experimental results are obtained with a spark source producing a pulse of 42 microsec duration and about 130 Pa at 1 m. The insertion loss of the hill is inferred from measurements of the acoustic signals at two locations in the field, with subsequent Fourier analysis on an IBM PC/AT. In general, experimental results support the predictions of the MAE theory, and provide a basis for the analysis of more complicated geometries.

Berthelot, Yves H.↗

Composite Flywheels Assessed Analytically by NDE and FEA

As an alternative to expensive and short-lived lead-acid batteries, composite flywheels are being developed to provide an uninterruptible power supply for advanced aerospace and industrial applications. Flywheels can help prevent irregularities in voltage caused by power spikes, sags, surges, burnout, and blackouts. Other applications include load-leveling systems for wind and solar power facilities, where energy output fluctuates with weather. Advanced composite materials are being considered for these components because they are significantly lighter than typical metallic alloys and have high specific strength and stiffness. However, much more research is needed before these materials can be fully utilized, because there is insufficient data concerning their fatigue characteristics and nonlinear behavior, especially at elevated temperatures. Moreover, these advanced types of structural composites pose greater challenges for nondestructive evaluation (NDE) techniques than are encountered with typical monolithic engineering metals. This is particularly true for ceramic polymer and metal matrix composites, where structural properties are tailored during the processing stages. Current efforts involving the NDE group at the NASA Glenn Research Center at Lewis Field are focused on evaluating many important structural components, including the flywheel system. Glenn's in-house analytical and experimental capabilities are being applied to analyze data produced by computed tomography (CT) scans to help assess the damage and defects of high-temperature structural composite materials. Finite element analysis (FEA) has been used extensively to model the effects of static and dynamic loading on aerospace propulsion components. This technique allows the use of complicated loading schemes by breaking the complex part geometry into many smaller, geometrically simple elements.

Abdul-Aziz, Ali↗

In-Memory Data Rearrangement for Irregular, Data-Intensive Computing

The data rearrangement engine (DRE) performs in-memory data restructuring to accelerate irregular, data-intensive applications. An emulation on a field-programmable gate array demonstrates how the DRE could improve speedup, memory bandwidth, and energy consumption on three representative benchmarks.

97 MATHEMATICS AND COMPUTING↗

Profiles of fatigue damage in graphite/epoxy composites from ultrasonic transmission power spectra

Early fatigue damage in non-unidirectional multi-ply graphite/epoxy composites is manifested by a distribution of cracks and disbonds through the bulk of the material. Such damage is subtle and is difficult to detect with conventional ultrasonic technology. Consequently, a new ultrasonic measurement technique called phase-insensitive tone-burst spectroscopy has been developed. The new technique eliminates problems associated with phase cancellation and pulse shape artifacts inherent to conventional broadband ultrasonic spectral measurement systems and produces clean spectral information irrespective of specimen inhomogeneity or irregularities in surface geometry. Application of the new technique to measurements of graphite/epoxy composites has yielded frequency-domain profiles that show distinct differences in ultrasonic attenuation, attenuation slope, and velocity for each specimen experiencing a different level of fatigue damage.

Cantrell, J. H., Jr.↗

Output calculation of electron therapy at extended SSD using an improved LBR method

Purpose: To calculate the output factor (OPF) of any irregularly shaped electron beam at extended SSD. Methods: Circular cutouts were prepared from 2.0 cm diameter to the maximum possible size for 15 × 15 applicator cone. In addition, two irregular cutouts were prepared. For each cutout, percentage depth dose (PDD) at the standard SSD and doses at different SSD values were measured using 6, 9, 12, and 16 MeV electron beam energies on a Varian 2100C LINAC and the distance at which the central axis electron fluence becomes independent of cutout size was determined. The measurements were repeated with an ELEKTA Synergy LINAC using 14 × 14 applicator cone and electron beam energies of 6, 9, 12, and 15 MeV. The PDD measurements were performed using a scanning system and two diodes—one for the signal and the other a stationary reference outside the tank. The doses of the circular cutouts at different SSDs were measured using PTW 0.125 cm{sup 3} Semiflex ion-chamber and EDR2 films. The electron fluence was measured using EDR2 films. Results: For each circular cutout, the lateral buildup ratio (LBR) was calculated from the measured PDD curve using the open applicator cone as the reference field. The effective SSD (SSD{sub eff}) of each circular cutout was calculated from the measured doses at different SSD values. Using the LBR value and the radius of the circular cutout, the corresponding lateral spread parameter [σ{sub R}(z)] was calculated. Taking the cutout size dependence of σ{sub R}(z) into account, the PDD curves of the irregularly shaped cutouts at the standard SSD were calculated. Using the calculated PDD curve of the irregularly shaped cutout along with the LBR and SSD{sub eff} values of the circular cutouts, the output factor of the irregularly shaped cutout at extended SSD was calculated. Finally, both the calculated PDD curves and output factor values were compared with the measured values. Conclusions: The improved LBR method has been generalized to calculate the output factor of electron therapy at extended SSD. The percentage difference between the calculated and the measured output factors of irregularly shaped cutouts in a clinical useful SSD region was within 2%. Similar results were obtained for all available electron energies of both Varian 2100C and ELEKTA Synergy machines.

07 ISOTOPE AND RADIATION SOURCES↗

Analysis of electromagnetic scattering from irregularly shaped, thin, metallic flat plates

This report describes an application of the method of moments to calculate the electromagnetic scattering from irregularly shaped, thin, metallic flat plates in free space. In the present technique, an irregularly shaped plate is enclosed by a rectangle on which the surface-current density is then expressed in terms of subdomain functions by dividing the rectangle into subsections. A shape function is introduced to ensure zero current outside the patch. The surface-current density is determined using the electric field integral equation (EFIE) approach in conjunction with the method of moments, and from a knowledge of the surface-current density, the electromagnetic scattering from a plate is calculated. Using this technique, the electromagnetic scattering from a hexagonal plate; an equilateral triangular plate; an equilateral triangular plate with a concentric, equilateral triangular hole and an inverted, equilateral triangular hole; and a diamond-shaped plate is computed and compared with the numerical results obtained by using the Electromagnetic Surface Patch (ESP) code developed by Ohio State University. The numerical results compare favorably with the measurements performed on these shapes in the Langley Experimental Test Range facility.

Deshpande, Manohar D.↗