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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 1,405 records · Page 78

A Thermal Management Systems Model for the NASA GTX RBCC Concept

The Vehicle Integrated Thermal Management Analysis Code (VITMAC) was further developed to aid the analysis, design, and optimization of propellant and thermal management concepts for advanced propulsion systems. The computational tool is based on engineering level principles and models. A graphical user interface (GUI) provides a simple and straightforward method to assess and evaluate multiple concepts before undertaking more rigorous analysis of candidate systems. The tool incorporates the Chemical Equilibrium and Applications (CEA) program and the RJPA code to permit heat transfer analysis of both rocket and air breathing propulsion systems. Key parts of the code have been validated with experimental data. The tool was specifically tailored to analyze rocket-based combined-cycle (RBCC) propulsion systems being considered for space transportation applications. This report describes the computational tool and its development and verification for NASA GTX RBCC propulsion system applications.

Traci, Richard M.↗

Interactive Graphics Analysis for Aircraft Design

Program uses higher-order far field drag minimization. Computer program WDES WDEM preliminary aerodynamic design tool for one or two interacting, subsonic lifting surfaces. Subcritical wing design code employs higher-order far-field drag minimization technique. Linearized aerodynamic theory used. Program written in FORTRAN IV.

Townsend, J. C.↗

NASA charging analyzer program

Computer program predicts electrostatic charging of three dimensional, conducting object partially or completely covered with dielectric films. Program is useful in describing spacecraft charging and material accumulation in plasma environment of magnetosphere. Numerous graphic outputs are implemented. Language is FORTRAN V, for batch execution on 1100-series computer.

Cassidy, J. J., III↗

Scalable Cloning on Large-Scale GPU Platforms with Application to Time-Stepped Simulations on Grids

Cloning is a technique to efficiently simulate a tree of multiple what-if scenarios that are unraveled during the course of a base simulation. However, cloned execution is highly challenging to realize on large, distributed memory computing platforms, due to the dynamic nature of the computational load across clones, and due to the complex dependencies spanning the clone tree. In this paper, we present the conceptual simulation framework, algorithmic foundations, and runtime interface of CloneX, a new system we designed for scalable simulation cloning. It efficiently and dynamically creates whole logical copies of a dynamic tree of simulations across a large parallel system without full physical duplication of computation and memory. The performance of a prototype implementation executed on up to 1,024 graphical processing units of a supercomputing system has been evaluated with three benchmarks—heat diffusion, forest fire, and disease propagation models—delivering a speed up of over two orders of magnitude compared to replicated runs. Finally, the results demonstrate a significantly faster and scalable way to execute many what-if scenario ensembles of large simulations via cloning using the CloneX interface.

97 MATHEMATICS AND COMPUTING↗

Graphical interfaces for cooperative planning systems

Based on a cognitive task analysis of 5 airline flight crews in a simulator study, researchers have designed a testbed for studying computer aids for en route flight path planning. This testbed runs on a Mac II controlling three color monitors, and is being used to study the design of aids for both dispatchers and flight crews. Specifically, the research focuses on design concepts for developing cooperative problem-solving systems. We use en route flight planning (selecting alternate routes or destinations due to unanticipated weather, traffic, malfunctions, etc.) as the context for studying the design of such systems. Researchers are currently exploring three questions in this test environment: (1) When interacting with a flight planning aid, how does the role of the pilot influence overall system performance; (2) Can the architecture for a cooperative planning system be built around Sacerdoti's (1983) concept of an abstraction hierarchy, where the pilot can interact with the system at many different levels of detail (but where the computer aid by default handles lower level details that the pilot has chosen not to deat with); and (3) Can graphical displays and direct manipulation of these displays provide perceptual enhancements (Larkin and Simon, 1987) of the pilot's problem-solving activities. Information is given in viewgraph form.

Smith, Philip J.↗

VTK-m: Visualization for the Exascale Era and Beyond

A recent trend in modern high-performance computing is the increasing use of hybrid architectures, where the vast majority of performance comes from accelerators. Modern accelerators are based on Graphics Processing Units (GPU) that contain many low power cores that in their aggregate provides an extremely high computation rate. Current and future CPU processors are requiring more explicit parallelism as each successive version of the hardware packs in more cores, and technologies like hyperthreading and vector operations require even more parallel processing to leverage each core’s full potential. As an example, the Frontier supercomputer installed at Oak Ridge National Laboratories recently hit a record breaking 1.1 exaflops1 on the LINPACK HPC benchmark [Shoemaker 2022]. The system contains 37632 AMD MI250x GPUs which requires more than half a billion threads to keep the system fully utilized [Khizeran 2022].VTK-m is a toolkit of scientific visualization algorithms for these emerging processor architectures. VTK-m supports the fine-grained concurrency for data analysis and visualization algorithms required to drive extreme scale computing by providing abstract models for data and execution that can be applied to a variety of algorithms across many different processor architectures.

Bolstad, Mark↗

An adaptive structure data acquisition system using a graphical-based programming language

An example of the implementation of data fusion using a PC and a graphical programming language is discussed. A schematic of the data acquisition system and user interface panel for an adaptive structure test are presented. The computer programs (a series of icons 'wired' together) are also discussed. The way in which using graphical-based programming software to control a data acquisition system can simplify analysis of data, promote multidisciplinary interaction, and provide users a more visual key to understanding their data are shown.

Baroth, Edmund C.↗

Acoustic scattering by circular cylinders of various aspect ratios

The effects of acoustic scattering on the useful frequency range of pressure gradient microphones were investigated experimentally between ka values of 0.407 and 4.232 using two circular cylindrical models (L/D = 0.5 and 0.25) having a 25 cm outside diameter. Small condenser microphones, attached to preamplifiers by flexible connectors, were installed from inside the cylindrical bodies, and flush mounted on the exterior surface of the cylinders. A 38 cm diameter woofer in a large speaker enclosure was used as the sound source. Surface pressure augmentation and phase differences were computed from measured data for various sound wave incidence angles. Results are graphically compared with theoretical predictions supplied by NASA for ka = 0.407, 2.288, and 4.232. All other results are tabulated in the appendices. With minor exceptions, the experimentally determined pressure augmentations agreed within 0.75 dB with theoretical predictions. The agreement for relative phase angles was within 5 percent without any exceptions. Scattering parameter variations with ka and L/D ratio, as computed from experimental data, are also presented.

Maciulaitis, A.↗

Achieving performance portability in Gaussian basis set density functional theory on accelerator based architectures in NWChemEx

The numerical integration of the exchange–correlation (XC) potential is one of the primary computational bottlenecks in Gaussian basis set Kohn–Sham density functional theory (KS-DFT). To achieve optimal performance and accuracy, care must be taken in this numerical integration to preserve local sparsity as to allow for near linear weak scaling with system size. This leads to an integration scheme with several performance critical kernels which must be hand optimized for each architecture of interest. As the set of available accelerator hardware goes more diverse, a key challenge for developers of KS-DFT software is to maintain performance portability across a wide range of computational architectures. In this article, we examine a modular software design pattern which decouples the implementation details of performance critical kernels from the expression of high-level algorithmic workflows in a device-agnostic language such as C++; thus allowing for developers to target existing and emerging accelerator hardware within a single code base. We consider the efficacy of such a design pattern in the numerical integration of the XC potential by demonstrating its ability to achieve performance portability across a set of accelerator architectures which are representative of those on current and future U.S. Department of Energy Leadership Computing Facilities.

97 MATHEMATICS AND COMPUTING↗

Unsteady magnetohydrodynamics mixed convection flow in a rotating medium with double diffusion

Exact solutions of an unsteady Magnetohydrodynamics (MHD) flow over an impulsively started vertical plate in a rotating medium are presented. The effects of thermal radiative and thermal diffusion on the fluid flow are also considered. The governing equations are modelled and solved for velocity, temperature and concentration using Laplace transforms technique. Expressions of velocity, temperature and concentration profiles are obtained and their numerical results are presented graphically. Skin friction, Sherwood number and Nusselt number are also computed and presented in tabular forms. The determined solutions can generate a large class of solutions as special cases corresponding to different motions with technical relevance. The results obtained herein may be used to verify the validation of obtained numerical solutions for more complicated fluid flow problems.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Parallel interior-point solver for block-structured nonlinear programs on SIMD/GPU architectures

Here, we investigate how to port the standard interior-point method to new exascale architectures for block-structured nonlinear programs with state equations. Computationally, we decompose the interior-point algorithm into two successive operations: the evaluation of the derivatives and the solution of the associated Karush-Kuhn-Tucker (KKT) linear system. Our method accelerates both operations using two levels of parallelism. First, we distribute the computations on multiple processes using coarse parallelism. Second, each process uses SIMD/GPU accelerators locally to accelerate the operations using fine-grained parallelism. The KKT system is reduced by eliminating the inequalities and the state variables from the corresponding equations. We demonstrate our method's capability on the supercomputer Polaris, a testbed for the future exascale Aurora system. Each node is equipped with four GPUs, a setup amenable to our two-level approach. Our experiments on the stochastic optimal power flow problem show that the reduction method is 50x faster than the sparse linear solver HSL MA57 running in serial on the CPU, and 6x faster than Pardiso running in parallel on CPU on the same number of processes.

97 MATHEMATICS AND COMPUTING↗

Fixed-target serial crystallography at the Structural Biology Center

Serial synchrotron crystallography enables the study of protein structures under physiological temperature and reduced radiation damage by collection of data from thousands of crystals. The Structural Biology Center at Sector 19 of the Advanced Photon Source has implemented a fixed-target approach with a new 3D-printed mesh-holder optimized for sample handling. The holder immobilizes a crystal suspension or droplet emulsion on a nylon mesh, trapping and sealing a near-monolayer of crystals in its mother liquor between two thin Mylar films. Data can be rapidly collected in scan mode and analyzed in near real-time using piezoelectric linear stages assembled in an XYZ arrangement, controlled with a graphical user interface and analyzed using a high-performance computing pipeline. Here, the system was applied to two β-lactamases: a class D serine β-lactamase from Chitinophaga pinensis DSM 2588 and L1 metallo-β-lactamase from Stenotrophomonas maltophilia K279a.

59 BASIC BIOLOGICAL SCIENCES↗

A Performance Model of In-Situ Techniques

The computational capacity of High-Performance Computing (HPC) systems increases continuously with the rapid development of central processing units (CPUs) and graphic processing units (GPUs), while the in-/output (IO) subsystem develops relatively slowly and storage capacity is also limited. Data-intensive applications, which are designed to leverage the high computational capacity of HPC resources, typically generate a considerable amount of data for post-processing visualizations and data analytics. The limited IO speed and storage space could lead to constraints in the actual performance of these applications and, therefore, scientific discovery. In-situ techniques, where data is visualized/analysed while still in memory rather than through disk, can contribute to alleviating these problems as they can reduce or even fully avoid data writing/reading through the IO subsystem to/from storage. However, the overall efficiency of insitu techniques crucially depends on the characteristics of both the in-situ tasks and the applications, and the resource distribution among them. Therefore, choosing the right in-situ approach (synchronous, asynchronous, or hybrid) and resource allocation is essential to minimize overhead and maximize the benefits of concurrent execution. In this paper, we present a performance model of in-situ techniques to find the most beneficial in-situ approach and the preferred resource configuration. We verify the high accuracy of our approach with over 6800 measurements and provide use cases with different applications.

Ju, Yi [Max Planck Computing and Data Facility, Ga↗

A performance model for GPUs with caches

To exploit the abundant computational power of the world's fastest supercomputers, an even workload distribution to the typically heterogeneous compute devices is necessary. While relatively accurate performance models exist for conventional CPUs, accurate performance estimation models for modern GPUs do not exist. This paper presents two accurate models for modern GPUs: a sampling-based linear model, and a model based on machine-learning (ML) techniques which improves the accuracy of the linear model and is applicable to modern GPUs with and without caches. We first construct the sampling-based linear model to predict the runtime of an arbitrary OpenCL kernel. Based on an analysis of NVIDIA GPUs' scheduling policies we determine the earliest sampling points that allow an accurate estimation. The linear model cannot capture well the significant effects that memory coalescing or caching as implemented in modern GPUs have on performance. We therefore propose a model based on ML techniques that takes several compiler-generated statistics about the kernel as well as the GPU's hardware performance counters as additional inputs to obtain a more accurate runtime performance estimation for modern GPUs. We demonstrate the effectiveness and broad applicability of the model by applying it to three different NVIDIA GPU architectures and one AMD GPU architecture. On an extensive set of OpenCL benchmarks, on average, the proposed model estimates the runtime performance with less than 7 percent error for a second-generation GTX 280 with no on-chip caches and less than 5 percent for the Fermi-based GTX 580 with hardware caches. On the Kepler-based GTX 680, the linear model has an error of less than 10 percent. On an AMD GPU architecture, Radeon HD 6970, the model estimates with 8 percent of error rates. As a result, the proposed technique outperforms existing models by a factor of 5 to 6 in terms of accuracy.

97 MATHEMATICS AND COMPUTING↗

Seismic Analysis Code 2000

The Seismic Analysis Code (SAC2000) is a general purpose interactive program designed for the study of sequential signals, especially time-series data. Emphasis has been placed on analysis tools used by research seismologists in the detailed study of seismic events. Analysis capabilities include general arithmetic operations, Fourier transforms, spectral estimation techniques, IIR and FIR filtering, signal stacking, decimation, interpolation, correlation, and seismic phase picking. SAC2000 also contains an extensive graphics capability. Versions are available for a wide variety of computer systems. SAC2000 was developed at Lawrence Livermore National Laboratory.

Barno, Justin↗

Block-Iterative Methods for 3D Constant-Coefficient Stencils on GPUs and Multicore CPUs

Block iterative methods are extremely important as smoothers for multigrid methods, as preconditioners for Krylov methods, and as solvers for diagonally dominant linear systems. Developing robust and efficient smoother algorithms suitable for current and evolving GPU and multicore CPU systems is a significant challenge. We address this issue in the case of constant-coefficient stencils arising in the solution of elliptic partial differential equations on structured 3D uniform and adaptively refined block structured grids. Robust, highly parallel implementations of block Jacobi and chaotic block Gauss-Seidel algorithms with exact inversion of the blocks are developed using different parallelization techniques. Experimental results for NVIDIA Fermi/Kepler GPUs and AMD multicore systems are presented.

97 MATHEMATICS AND COMPUTING↗

Introducing Kynema, an Open-Source Performance-Portable Flexible-Multibody-Dynamics Solver

In this talk we introduce Kynema, an open-source general flexible-multibody-dynamics solver that is well suited for simulating wind turbine structural dynamics. Kynema uses a Lie-group time integrator for constrained systems and runs on both CPUs and GPUs. Timing results for simulations are presented for the IEA 15-MW turbine with and without aerodynamic forces.

17 WIND ENERGY↗