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At least 325 records · Page 18

Performance analysis of emerging data analytics and HPC workloads

Supercomputers are increasingly being used to run a data analytics workload in addition to a traditional simulation science workload. This mixed workload must be rigorously characterized to ensure that appropriately balanced machines are deployed. In this paper we analyze a suite of applications representing the simulation science and data workload at the NERSC supercomputing center. We show how time is spent in application compute, library compute, communication and I/O, and present application performance on both the Intel Xeon and Intel Xeon-Phi partitions of the Cori supercomputer. We find commonality in the libraries used, I/O motifs and methods of parallelism, and obtain similar node-to-node performance for the base application configurations. We demonstrate that features of the Intel Xeon-Phi node architecture and a Burst Buffer can improve application performance, providing evidence that an exascale-era energy-efficient platform can support a mixed workload.

Daley, Christopher S.↗

Three-beam rotational coherent anti-Stokes Raman spectroscopy thermometry in scattering environments

Three-beam rotational coherent anti-Stokes Raman scattering (CARS) measurements performed in highly scattering environments are susceptible to contamination by two-beam CARS signals generated by the pump–probe and Stokes–probe interactions at the measurement volume. If this occurs, differences in the Raman excitation bandwidth between the two-beam and three-beam CARS signals can add significant errors to the spectral analysis. This interference to the best of our knowledge has not been acknowledged in previous three-beam rotational CARS experiments, but may introduce measurement errors up to 25% depending on the temperature, amount of scattering, and differences between the two-beam and three-beam Raman excitation bandwidths. Here, the presence of two-beam CARS signal contamination was experimentally verified using a femtosecond–picosecond rotational CARS instrument in two scattering environments: (1) a fireball generated by a laboratory-scale explosion that contained particulate matter, metal fragments, and soot, and (2) a flow of air and small liquid droplets. A polarization scheme is presented to overcome this interference. By rotating the pump and Stokes polarizations +55° and –55° from the probe, respectively, the two-beam and three-beam CARS signals are orthogonally polarized and can be separated using a polarization analyzer. Using this polarization arrangement, the Raman-resonant three-beam CARS signal amplitude is reduced by a factor of 2.3 compared to the case where all polarizations are parallel. This method is successfully demonstrated in both scattering environments. A theoretical model is presented, and the temperature measurement error is studied for different experimental conditions. The criteria for when this interference may be present are discussed.

42 ENGINEERING↗

Generalized Bootstrap AMG and AIR-AMG for coupled PDE systems with a focus on spacetime discretizatoins

The Pennsylvania State University (“Subcontractor”) has worked on the design of new algebraic, parallel, multilevel methods that obtain the full space and time solution of systems of PDEs. In particular, the PI and his collaborators explored semi-intrusive approaches based on algebraic multigrid (AMG). The focus of the research has been on the development of these techniques for the Euler equations in 1d and 2d. The overall research focused on the development of adaptive AIR (approximate ideal restriction) AMG solvers for these problems. The PI also explored the use of smoothed aggregation and root-node energy-based AMG solvers for these problems.

97 MATHEMATICS AND COMPUTING↗

Lagrangian simulations of spray interaction with a surface using a stochastic multi-regime impingement model

Modeling of spray impingement upon the piston or cylinder surface is important for hydrocarbon emission and soot predictions in high-fidelity simulation of internal combustion engines with direct injections. Due to the complexity of the physical process of spray impingement, current computational models heavily rely on the empirical studies which involve large uncertainties. A computational model is presented for spray impingement on solid walls in general computational fluid dynamics (CFD) simulations. The model adopts the Marmanis-Thoroddsen theory for determining the number of secondary droplets and a stochastic method for calculating the velocities of the secondary droplets. The numerical methods and parallel implementation of the impingement model are presented in detail. The model is implemented in Grit, which is a recently developed CPU/GPU performance-portable Lagrangian particle library, for accelerating spray simulations. The model and its implementation are tested for examples of spray impingements on flat and smooth surfaces with different impingement angles.

Ge, Wenjun↗

rustpix

rustpix is a high-performance, open-source Rust library with first-class Python bindings (via PyO3) for processing pixel-detector data in neutron imaging. It targets time-stamping detectors such as Timepix3 (TPX3) at ORNL's Spallation Neutron Source (VENUS beamline), where each detected neutron deposits charge across a cluster of pixels within a very high-rate event stream (96M+ hits/sec). rustpix parses TPX3 event data in parallel using memory-mapped I/O, offers four interchangeable clustering algorithms (ABS adjacency-based search, DBSCAN, graph/union-find connected components, and a parallel grid method), and extracts weighted, super-resolved centroids to produce neutron-event lists. A streaming architecture lets it process files larger than available memory. rustpix is distributed as a pip-installable Python package (with NumPy integration), Rust crates, a command-line tool, and an interactive GUI; it writes HDF5, Apache Arrow, and CSV; and it is designed to extend to TPX4 and other detector types. Released as open-source under the MIT License.

Zhang, Chen [Oak Ridge National Laboratory (ORNL),↗

Analysis of Infrastructures for Processing Plastic Waste using Pyrolysis-Based Chemical Upcycling Pathways

Modern mechanical recycling infrastructure for plastic is capable of processing only a small subset of waste plastics, reinforcing the need for parallel disposal methods such as landfilling and incineration. Emerging pyrolysis-based chemical technologies can "upcycle" plastic waste into high-value polymer and chemical products and process a broader range of waste plastics. In this work, we study the economic and environmental benefits of deploying an upcycling infrastructure in the continental United States for producing low-density polyethylene (LDPE) and polypropylene (PP) from post-consumer mixed plastic waste. Our analysis aims to determine the market size that the infrastructure can create, the degree of circularity that it can achieve, the prices for waste and derived products it can propagate, and the environmental benefits of diverting plastic waste from landfill and incineration facilities it can produce. We apply a computational framework that integrates techno-economic analysis, life cycle assessment, and value chain optimization. Our results demonstrate that the infrastructure generates an economy of nearly 20 billion USD and positive prices for plastic waste, opening opportunities for compensation to residents who provide plastic waste. Our analysis also indicates that the infrastructure can achieve a plastic-to-plastic degree of circularity of 34% and remains viable under various external factors (including technology efficiencies, capital investment budgets, and polymer market values). Finally, we present significant environmental benefits of upcycling over alternative landfill and incineration waste disposal methods, and comment on ongoing work expanding our modeling methodology to other chemical upcycling pathway case studies, including hydroformylation of specific plastics to chemicals.

Interdisciplinary↗

Recent developments in CID imaging

Readout of CID imaging arrays was first performed by injecting and detecting the signal charge from each sensing site in sequence. A new readout method, termed parallel injection, has been developed in which the functions of signal charge detection and injection have been separated. The level of signal charge at each sensing site is detected during a line scan, and during the line retrace interval, all charge in the selected line is injected. The parallel injection technique is well adapted to TV scan formats in that the signal is read out at high speed, line by line. A 244 line by 248 element TV compatible imager, employing this technique and including an on chip preamplifier, has been constructed and operation demonstrated.

Michon, G. J.↗

The motion of a satellite in resonance with the longitude-dependent harmonics

The solution to the motion of a satellite in an eccentric orbit and in resonance with one or more of the longitude-dependent harmonics of the central planet is developed. The method of solution parallels the well known von Zeipel method of general perturbations. The solution consists of expressions for the variations of the Delaunay variables. These expressions are composed of the perturbations developed by Brouwer in 1959 for the motion of an artificial satellite plus first-order resonant perturbations due to longitude-dependent harmonics (in terms of Legendre normal elliptic integrals of the first and second kind).

Dallas, S. S.↗

The motion of a satellite in resonance with the longitude-dependent harmonics

The solution to the motion of a satellite in an eccentric orbit and in resonance with one or more of the longitude-dependent harmonics of the central planet is developed. The method of solution parallels the well known von Zeipel method of general perturbations. The solution consists of expressions for the variations of the Delaunay variables. These expressions are composed of the perturbations developed by Brouwer in 1959 for the motion of an artificial satellite plus first-order resonant perturbations due to longitude-dependent harmonics (in terms of Legendre normal elliptic integrals of the first and second kind).

Dallas, S. S.↗

Computational aerodynamics on large computers

Three examples of advances in computational aerodynamics; (1) three-dimensional inviscid transonic analysis, (2) design calculations for wings, and (3) the computation of viscous-induced aileron buzz, are reviewed. Attention is given to wing surface pressures, design optimization, computer memory, speed and advanced solution methods on parallel computer architecture. It is determined that many implicit approximate-factorization schemes, that have been developed for Navier-Stokes equations, can be coded to run efficiently on microprocessors.

Ballhaus, W. F.↗

The TEKLIB graphic library

TEKLIB is a library of procedures written in TI PASCAL to perform basic graphic tasks. TEKLIB was written to provide an interface between a graphics terminal and the TI 990. The TI 990 is used as a controller for the Finite Element Machine which is an array of microprocessors designed to solve problems by finite element methods in parallel. The use of TEKLIB provides a means of inputting data graphically and displaying output.

Bostic, S. W.↗

Welded solar cell interconnection

The efficiency of the welding of solar-cell interconnects is compared with the efficiency of soldering such interconnects, and the cases in which welding may be superior are examined. Emphasis is placed on ultrasonic welding; attention is given to the solar-cell welding machine, the application of the welding process to different solar-cell configurations, producibility, and long-life performance of welded interconnects. Much of the present work has been directed toward providing increased confidence in the reliability of welding using conditions approximating those that would occur with large-scale array production. It is concluded that there is as yet insufficient data to determine which of three methods (soldering, parallel gap welding, and ultrasonic welding) provides the longest-duration solar panel life.

Stofel, E. J.↗

Systolic VLSI for Kalman filters

A novel two-dimensional parallel computing method for real-time Kalman filtering is presented. The mathematical formulation of a Kalman filter algorithm is rearranged to be the type of Faddeev algorithm for generalizing signal processing. The data flow mapping from the Faddeev algorithm to a two-dimensional concurrent computing structure is developed. The architecture of the resulting processor cells is regular, simple, expandable, and therefore naturally suitable for VLSI chip implementation. The computing methodology and the two-dimensional systolic arrays are useful for Kalman filter applications as well as other matrix/vector based algebraic computations.

Yeh, H.-G.↗

Run-time scheduling and execution of loops on message passing machines

Sparse system solvers and general purpose codes for solving partial differential equations are examples of the many types of problems whose irregularity can result in poor performance on distributed memory machines. Often, the data structures used in these problems are very flexible. Crucial details concerning loop dependences are encoded in these structures rather than being explicitly represented in the program. Good methods for parallelizing and partitioning these types of problems require assignment of computations in rather arbitrary ways. Naive implementations of programs on distributed memory machines requiring general loop partitions can be extremely inefficient. Instead, the scheduling mechanism needs to capture the data reference patterns of the loops in order to partition the problem. First, the indices assigned to each processor must be locally numbered. Next, it is necessary to precompute what information is needed by each processor at various points in the computation. The precomputed information is then used to generate an execution template designed to carry out the computation, communication, and partitioning of data, in an optimized manner. The design is presented for a general preprocessor and schedule executer, the structures of which do not vary, even though the details of the computation and of the type of information are problem dependent.

Crowley, Kay↗