KAUST Supercomputing Laboratory

KAUST Repository

Bailey, April Renee

2011-11-15

KAUST has partnered with IBM to establish a Supercomputing Research Center. KAUST is hosting the Shaheen supercomputer, named after the Arabian falcon famed for its swiftness of flight. This 16-rack IBM Blue Gene/P system is equipped with 4 gigabyte memory per node and capable of 222 teraflops, making KAUST campus the site of one of the world’s fastest supercomputers in an academic environment. KAUST is targeting petaflop capability within 3 years.

KAUST Supercomputing Laboratory

KAUST Repository

Bailey, April Renee; Kaushik, Dinesh; Winfer, Andrew

2011-01-01

KAUST has partnered with IBM to establish a Supercomputing Research Center. KAUST is hosting the Shaheen supercomputer, named after the Arabian falcon famed for its swiftness of flight. This 16-rack IBM Blue Gene/P system is equipped with 4 gigabyte memory per node and capable of 222 teraflops, making KAUST campus the site of one of the world’s fastest supercomputers in an academic environment. KAUST is targeting petaflop capability within 3 years.

Multi-petascale highly efficient parallel supercomputer

Science.gov (United States)

Asaad, Sameh; Bellofatto, Ralph E.; Blocksome, Michael A.; Blumrich, Matthias A.; Boyle, Peter; Brunheroto, Jose R.; Chen, Dong; Cher, Chen -Yong; Chiu, George L.; Christ, Norman; Coteus, Paul W.; Davis, Kristan D.; Dozsa, Gabor J.; Eichenberger, Alexandre E.; Eisley, Noel A.; Ellavsky, Matthew R.; Evans, Kahn C.; Fleischer, Bruce M.; Fox, Thomas W.; Gara, Alan; Giampapa, Mark E.; Gooding, Thomas M.; Gschwind, Michael K.; Gunnels, John A.; Hall, Shawn A.; Haring, Rudolf A.; Heidelberger, Philip; Inglett, Todd A.; Knudson, Brant L.; Kopcsay, Gerard V.; Kumar, Sameer; Mamidala, Amith R.; Marcella, James A.; Megerian, Mark G.; Miller, Douglas R.; Miller, Samuel J.; Muff, Adam J.; Mundy, Michael B.; O'Brien, John K.; O'Brien, Kathryn M.; Ohmacht, Martin; Parker, Jeffrey J.; Poole, Ruth J.; Ratterman, Joseph D.; Salapura, Valentina; Satterfield, David L.; Senger, Robert M.; Smith, Brian; Steinmacher-Burow, Burkhard; Stockdell, William M.; Stunkel, Craig B.; Sugavanam, Krishnan; Sugawara, Yutaka; Takken, Todd E.; Trager, Barry M.; Van Oosten, James L.; Wait, Charles D.; Walkup, Robert E.; Watson, Alfred T.; Wisniewski, Robert W.; Wu, Peng

2015-07-14

A Multi-Petascale Highly Efficient Parallel Supercomputer of 100 petaOPS-scale computing, at decreased cost, power and footprint, and that allows for a maximum packaging density of processing nodes from an interconnect point of view. The Supercomputer exploits technological advances in VLSI that enables a computing model where many processors can be integrated into a single Application Specific Integrated Circuit (ASIC). Each ASIC computing node comprises a system-on-chip ASIC utilizing four or more processors integrated into one die, with each having full access to all system resources and enabling adaptive partitioning of the processors to functions such as compute or messaging I/O on an application by application basis, and preferably, enable adaptive partitioning of functions in accordance with various algorithmic phases within an application, or if I/O or other processors are underutilized, then can participate in computation or communication nodes are interconnected by a five dimensional torus network with DMA that optimally maximize the throughput of packet communications between nodes and minimize latency.

Introduction to Reconfigurable Supercomputing

CERN Document Server

Lanzagorta, Marco; Rosenberg, Robert

2010-01-01

This book covers technologies, applications, tools, languages, procedures, advantages, and disadvantages of reconfigurable supercomputing using Field Programmable Gate Arrays (FPGAs). The target audience is the community of users of High Performance Computers (HPe who may benefit from porting their applications into a reconfigurable environment. As such, this book is intended to guide the HPC user through the many algorithmic considerations, hardware alternatives, usability issues, programming languages, and design tools that need to be understood before embarking on the creation of reconfigur

Exploiting Thread Parallelism for Ocean Modeling on Cray XC Supercomputers

Energy Technology Data Exchange (ETDEWEB)

Sarje, Abhinav [Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States); Jacobsen, Douglas W. [Los Alamos National Lab. (LANL), Los Alamos, NM (United States); Williams, Samuel W. [Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States); Ringler, Todd [Los Alamos National Lab. (LANL), Los Alamos, NM (United States); Oliker, Leonid [Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States)

2016-05-01

The incorporation of increasing core counts in modern processors used to build state-of-the-art supercomputers is driving application development towards exploitation of thread parallelism, in addition to distributed memory parallelism, with the goal of delivering efficient high-performance codes. In this work we describe the exploitation of threading and our experiences with it with respect to a real-world ocean modeling application code, MPAS-Ocean. We present detailed performance analysis and comparisons of various approaches and configurations for threading on the Cray XC series supercomputers.

Automatic discovery of the communication network topology for building a supercomputer model

Science.gov (United States)

Sobolev, Sergey; Stefanov, Konstantin; Voevodin, Vadim

2016-10-01

The Research Computing Center of Lomonosov Moscow State University is developing the Octotron software suite for automatic monitoring and mitigation of emergency situations in supercomputers so as to maximize hardware reliability. The suite is based on a software model of the supercomputer. The model uses a graph to describe the computing system components and their interconnections. One of the most complex components of a supercomputer that needs to be included in the model is its communication network. This work describes the proposed approach for automatically discovering the Ethernet communication network topology in a supercomputer and its description in terms of the Octotron model. This suite automatically detects computing nodes and switches, collects information about them and identifies their interconnections. The application of this approach is demonstrated on the "Lomonosov" and "Lomonosov-2" supercomputers.

Computational Dimensionalities of Global Supercomputing

Directory of Open Access Journals (Sweden)

Richard S. Segall

2013-12-01

Full Text Available This Invited Paper pertains to subject of my Plenary Keynote Speech at the 17th World Multi-Conference on Systemics, Cybernetics and Informatics (WMSCI 2013 held in Orlando, Florida on July 9-12, 2013. The title of my Plenary Keynote Speech was: "Dimensionalities of Computation: from Global Supercomputing to Data, Text and Web Mining" but this Invited Paper will focus only on the "Computational Dimensionalities of Global Supercomputing" and is based upon a summary of the contents of several individual articles that have been previously written with myself as lead author and published in [75], [76], [77], [78], [79], [80] and [11]. The topics of these of the Plenary Speech included Overview of Current Research in Global Supercomputing [75], Open-Source Software Tools for Data Mining Analysis of Genomic and Spatial Images using High Performance Computing [76], Data Mining Supercomputing with SAS™ JMP® Genomics ([77], [79], [80], and Visualization by Supercomputing Data Mining [81]. ______________________ [11.] Committee on the Future of Supercomputing, National Research Council (2003, The Future of Supercomputing: An Interim Report, ISBN-13: 978-0-309-09016- 2, http://www.nap.edu/catalog/10784.html [75.] Segall, Richard S.; Zhang, Qingyu and Cook, Jeffrey S.(2013, "Overview of Current Research in Global Supercomputing", Proceedings of Forty- Fourth Meeting of Southwest Decision Sciences Institute (SWDSI, Albuquerque, NM, March 12-16, 2013. [76.] Segall, Richard S. and Zhang, Qingyu (2010, "Open-Source Software Tools for Data Mining Analysis of Genomic and Spatial Images using High Performance Computing", Proceedings of 5th INFORMS Workshop on Data Mining and Health Informatics, Austin, TX, November 6, 2010. [77.] Segall, Richard S., Zhang, Qingyu and Pierce, Ryan M.(2010, "Data Mining Supercomputing with SAS™ JMP®; Genomics: Research-in-Progress, Proceedings of 2010 Conference on Applied Research in Information Technology, sponsored by

Japanese supercomputer technology

International Nuclear Information System (INIS)

Buzbee, B.L.; Ewald, R.H.; Worlton, W.J.

1982-01-01

In February 1982, computer scientists from the Los Alamos National Laboratory and Lawrence Livermore National Laboratory visited several Japanese computer manufacturers. The purpose of these visits was to assess the state of the art of Japanese supercomputer technology and to advise Japanese computer vendors of the needs of the US Department of Energy (DOE) for more powerful supercomputers. The Japanese foresee a domestic need for large-scale computing capabilities for nuclear fusion, image analysis for the Earth Resources Satellite, meteorological forecast, electrical power system analysis (power flow, stability, optimization), structural and thermal analysis of satellites, and very large scale integrated circuit design and simulation. To meet this need, Japan has launched an ambitious program to advance supercomputer technology. This program is described

An assessment of worldwide supercomputer usage

Energy Technology Data Exchange (ETDEWEB)

Wasserman, H.J.; Simmons, M.L.; Hayes, A.H.

1995-01-01

This report provides a comparative study of advanced supercomputing usage in Japan and the United States as of Spring 1994. It is based on the findings of a group of US scientists whose careers have centered on programming, evaluating, and designing high-performance supercomputers for over ten years. The report is a follow-on to an assessment of supercomputing technology in Europe and Japan that was published in 1993. Whereas the previous study focused on supercomputer manufacturing capabilities, the primary focus of the current work was to compare where and how supercomputers are used. Research for this report was conducted through both literature studies and field research in Japan.

Status of supercomputers in the US

International Nuclear Information System (INIS)

Fernbach, S.

1985-01-01

Current Supercomputers; that is, the Class VI machines which first became available in 1976 are being delivered in greater quantity than ever before. In addition, manufacturers are busily working on Class VII machines to be ready for delivery in CY 1987. Mainframes are being modified or designed to take on some features of the supercomputers and new companies with the intent of either competing directly in the supercomputer arena or in providing entry-level systems from which to graduate to supercomputers are springing up everywhere. Even well founded organizations like IBM and CDC are adding machines with vector instructions in their repertoires. Japanese - manufactured supercomputers are also being introduced into the U.S. Will these begin to compete with those of U.S. manufacture. Are they truly competitive. It turns out that both from the hardware and software points of view they may be superior. We may be facing the same problems in supercomputers that we faced in videosystems

Evolving the NCSA CyberCollaboratory for Distributed Environmental Observatory Networks

Science.gov (United States)

Myers, J.; Liu, Y.; Minsker, B.; Futrelle, J.; Downey, S.; Kim, I.; Rantanen, E.

2007-12-01

Since 2004, NCSA's Cybercollaboratory, which is built on top of the open source Liferay portal framework, has been evolving as part of NCSA's efforts to build national cyberinfrastructure to support collaborative research in environmental engineering and hydrological sciences and allow users to efficiently share contents (sensors, data, model, documents, etc.) in a context-sensitive way (e.g., providing different tools/data based on group affiliation and geospatial contexts). During this period, we provided the CyberCollaboratory to users in CLEANER (Collaborative Large-scale Engineering Analysis Network for Environmental Research, now WATer and Environmental Research Systems (WATERS) network) Project Office and several CLEANER /WATERS testbed projects. Preliminary statistics shows that one in four users (among over 400 registered users) provided contents with many other reading/accessing those contents (such as messages, documents, wikis). During the course of this use, and in evaluation by others including representatives from the CUAHSI (Consortium of Universities for the Advancement of Hydrologic Science) community, we have received significant feedback on issues of usability and suitability to various communities involved in environmental observatories. Much of this feedback applies to collaborative portals in general and some reflect a comparison of portals with newer Web 2.0 style social -networking sites. For example, users working in multiple groups found it difficult to get an overview of all of their activities and found differences in group layouts to be confusing. Users also found the standard account creation and group management processes cumbersome compared to inviting people to be friends on social sites and wanted a better sense of presence and social networks within the portal. The fragmentation of group documents between local stores, the portal document repository and email, and issues of "lost updates" was another significant concern. This

Performance Characteristics of Hybrid MPI/OpenMP Scientific Applications on a Large-Scale Multithreaded BlueGene/Q Supercomputer

KAUST Repository

Wu, Xingfu; Taylor, Valerie

2013-01-01

In this paper, we investigate the performance characteristics of five hybrid MPI/OpenMP scientific applications (two NAS Parallel benchmarks Multi-Zone SP-MZ and BT-MZ, an earthquake simulation PEQdyna, an aerospace application PMLB and a 3D particle-in-cell application GTC) on a large-scale multithreaded Blue Gene/Q supercomputer at Argonne National laboratory, and quantify the performance gap resulting from using different number of threads per node. We use performance tools and MPI profile and trace libraries available on the supercomputer to analyze and compare the performance of these hybrid scientific applications with increasing the number OpenMP threads per node, and find that increasing the number of threads to some extent saturates or worsens performance of these hybrid applications. For the strong-scaling hybrid scientific applications such as SP-MZ, BT-MZ, PEQdyna and PLMB, using 32 threads per node results in much better application efficiency than using 64 threads per node, and as increasing the number of threads per node, the FPU (Floating Point Unit) percentage decreases, and the MPI percentage (except PMLB) and IPC (Instructions per cycle) per core (except BT-MZ) increase. For the weak-scaling hybrid scientific application such as GTC, the performance trend (relative speedup) is very similar with increasing number of threads per node no matter how many nodes (32, 128, 512) are used. © 2013 IEEE.

Performance Characteristics of Hybrid MPI/OpenMP Scientific Applications on a Large-Scale Multithreaded BlueGene/Q Supercomputer

KAUST Repository

Wu, Xingfu

2013-07-01

In this paper, we investigate the performance characteristics of five hybrid MPI/OpenMP scientific applications (two NAS Parallel benchmarks Multi-Zone SP-MZ and BT-MZ, an earthquake simulation PEQdyna, an aerospace application PMLB and a 3D particle-in-cell application GTC) on a large-scale multithreaded Blue Gene/Q supercomputer at Argonne National laboratory, and quantify the performance gap resulting from using different number of threads per node. We use performance tools and MPI profile and trace libraries available on the supercomputer to analyze and compare the performance of these hybrid scientific applications with increasing the number OpenMP threads per node, and find that increasing the number of threads to some extent saturates or worsens performance of these hybrid applications. For the strong-scaling hybrid scientific applications such as SP-MZ, BT-MZ, PEQdyna and PLMB, using 32 threads per node results in much better application efficiency than using 64 threads per node, and as increasing the number of threads per node, the FPU (Floating Point Unit) percentage decreases, and the MPI percentage (except PMLB) and IPC (Instructions per cycle) per core (except BT-MZ) increase. For the weak-scaling hybrid scientific application such as GTC, the performance trend (relative speedup) is very similar with increasing number of threads per node no matter how many nodes (32, 128, 512) are used. © 2013 IEEE.

NASA Advanced Supercomputing Facility Expansion

Science.gov (United States)

Thigpen, William W.

2017-01-01

The NASA Advanced Supercomputing (NAS) Division enables advances in high-end computing technologies and in modeling and simulation methods to tackle some of the toughest science and engineering challenges facing NASA today. The name "NAS" has long been associated with leadership and innovation throughout the high-end computing (HEC) community. We play a significant role in shaping HEC standards and paradigms, and provide leadership in the areas of large-scale InfiniBand fabrics, Lustre open-source filesystems, and hyperwall technologies. We provide an integrated high-end computing environment to accelerate NASA missions and make revolutionary advances in science. Pleiades, a petaflop-scale supercomputer, is used by scientists throughout the U.S. to support NASA missions, and is ranked among the most powerful systems in the world. One of our key focus areas is in modeling and simulation to support NASA's real-world engineering applications and make fundamental advances in modeling and simulation methods.

ATLAS Software Installation on Supercomputers

CERN Document Server

Undrus, Alexander; The ATLAS collaboration

2018-01-01

PowerPC and high performance computers (HPC) are important resources for computing in the ATLAS experiment. The future LHC data processing will require more resources than Grid computing, currently using approximately 100,000 cores at well over 100 sites, can provide. Supercomputers are extremely powerful as they use resources of hundreds of thousands CPUs joined together. However their architectures have different instruction sets. ATLAS binary software distributions for x86 chipsets do not fit these architectures, as emulation of these chipsets results in huge performance loss. This presentation describes the methodology of ATLAS software installation from source code on supercomputers. The installation procedure includes downloading the ATLAS code base as well as the source of about 50 external packages, such as ROOT and Geant4, followed by compilation, and rigorous unit and integration testing. The presentation reports the application of this procedure at Titan HPC and Summit PowerPC at Oak Ridge Computin...

A visual analytics system for optimizing the performance of large-scale networks in supercomputing systems

Directory of Open Access Journals (Sweden)

Takanori Fujiwara

2018-03-01

Full Text Available The overall efficiency of an extreme-scale supercomputer largely relies on the performance of its network interconnects. Several of the state of the art supercomputers use networks based on the increasingly popular Dragonfly topology. It is crucial to study the behavior and performance of different parallel applications running on Dragonfly networks in order to make optimal system configurations and design choices, such as job scheduling and routing strategies. However, in order to study these temporal network behavior, we would need a tool to analyze and correlate numerous sets of multivariate time-series data collected from the Dragonfly’s multi-level hierarchies. This paper presents such a tool–a visual analytics system–that uses the Dragonfly network to investigate the temporal behavior and optimize the communication performance of a supercomputer. We coupled interactive visualization with time-series analysis methods to help reveal hidden patterns in the network behavior with respect to different parallel applications and system configurations. Our system also provides multiple coordinated views for connecting behaviors observed at different levels of the network hierarchies, which effectively helps visual analysis tasks. We demonstrate the effectiveness of the system with a set of case studies. Our system and findings can not only help improve the communication performance of supercomputing applications, but also the network performance of next-generation supercomputers. Keywords: Supercomputing, Parallel communication network, Dragonfly networks, Time-series data, Performance analysis, Visual analytics

Lifetime Prevalence of Mental Disorders in U.S. Adolescents: Results from the National Comorbidity Survey Replication-Adolescent Supplement (NCS-A)

Science.gov (United States)

Merikangas, Kathleen Ries; He, Jian-ping; Burstein, Marcy; Swanson, Sonja A.; Avenevoli, Shelli; Cui, Lihong; Benjet, Corina; Georgiades, Katholiki; Swendsen, Joel

2010-01-01

Objective: To present estimates of the lifetime prevalence of "DSM-IV" mental disorders with and without severe impairment, their comorbidity across broad classes of disorder, and their sociodemographic correlates. Method: The National Comorbidity Survey-Adolescent Supplement NCS-A is a nationally representative face-to-face survey of…

Integration of Panda Workload Management System with supercomputers

Science.gov (United States)

De, K.; Jha, S.; Klimentov, A.; Maeno, T.; Mashinistov, R.; Nilsson, P.; Novikov, A.; Oleynik, D.; Panitkin, S.; Poyda, A.; Read, K. F.; Ryabinkin, E.; Teslyuk, A.; Velikhov, V.; Wells, J. C.; Wenaus, T.

2016-09-01

on several supercomputing platforms. We will present our current accomplishments in running PanDA WMS at supercomputers and demonstrate our ability to use PanDA as a portal independent of the computing facility's infrastructure for High Energy and Nuclear Physics, as well as other data-intensive science applications, such as bioinformatics and astro-particle physics.

A workbench for tera-flop supercomputing

International Nuclear Information System (INIS)

Resch, M.M.; Kuester, U.; Mueller, M.S.; Lang, U.

2003-01-01

Supercomputers currently reach a peak performance in the range of TFlop/s. With but one exception - the Japanese Earth Simulator - none of these systems has so far been able to also show a level of sustained performance for a variety of applications that comes close to the peak performance. Sustained TFlop/s are therefore rarely seen. The reasons are manifold and are well known: Bandwidth and latency both for main memory and for the internal network are the key internal technical problems. Cache hierarchies with large caches can bring relief but are no remedy to the problem. However, there are not only technical problems that inhibit the full exploitation by scientists of the potential of modern supercomputers. More and more organizational issues come to the forefront. This paper shows the approach of the High Performance Computing Center Stuttgart (HLRS) to deliver a sustained performance of TFlop/s for a wide range of applications from a large group of users spread over Germany. The core of the concept is the role of the data. Around this we design a simulation workbench that hides the complexity of interacting computers, networks and file systems from the user. (authors)

High Performance Networks From Supercomputing to Cloud Computing

CERN Document Server

Abts, Dennis

2011-01-01

Datacenter networks provide the communication substrate for large parallel computer systems that form the ecosystem for high performance computing (HPC) systems and modern Internet applications. The design of new datacenter networks is motivated by an array of applications ranging from communication intensive climatology, complex material simulations and molecular dynamics to such Internet applications as Web search, language translation, collaborative Internet applications, streaming video and voice-over-IP. For both Supercomputing and Cloud Computing the network enables distributed applicati

KfK-seminar series on supercomputing und visualization from May till September 1992

International Nuclear Information System (INIS)

Hohenhinnebusch, W.

1993-05-01

During the period of may 1992 to september 1992 a series of seminars was held at KfK on several topics of supercomputing in different fields of application. The aim was to demonstrate the importance of supercomputing and visualization in numerical simulations of complex physical and technical phenomena. This report contains the collection of all submitted seminar papers. (orig./HP) [de

TOP500 Supercomputers for June 2004

Energy Technology Data Exchange (ETDEWEB)

Strohmaier, Erich; Meuer, Hans W.; Dongarra, Jack; Simon, Horst D.

2004-06-23

23rd Edition of TOP500 List of World's Fastest Supercomputers Released: Japan's Earth Simulator Enters Third Year in Top Position MANNHEIM, Germany; KNOXVILLE, Tenn.;&BERKELEY, Calif. In what has become a closely watched event in the world of high-performance computing, the 23rd edition of the TOP500 list of the world's fastest supercomputers was released today (June 23, 2004) at the International Supercomputer Conference in Heidelberg, Germany.

TOP500 Supercomputers for June 2005

Energy Technology Data Exchange (ETDEWEB)

Strohmaier, Erich; Meuer, Hans W.; Dongarra, Jack; Simon, Horst D.

2005-06-22

25th Edition of TOP500 List of World's Fastest Supercomputers Released: DOE/L LNL BlueGene/L and IBM gain Top Positions MANNHEIM, Germany; KNOXVILLE, Tenn.; BERKELEY, Calif. In what has become a closely watched event in the world of high-performance computing, the 25th edition of the TOP500 list of the world's fastest supercomputers was released today (June 22, 2005) at the 20th International Supercomputing Conference (ISC2005) in Heidelberg Germany.

TOP500 Supercomputers for November 2003

Energy Technology Data Exchange (ETDEWEB)

Strohmaier, Erich; Meuer, Hans W.; Dongarra, Jack; Simon, Horst D.

2003-11-16

22nd Edition of TOP500 List of World s Fastest Supercomputers Released MANNHEIM, Germany; KNOXVILLE, Tenn.; BERKELEY, Calif. In what has become a much-anticipated event in the world of high-performance computing, the 22nd edition of the TOP500 list of the worlds fastest supercomputers was released today (November 16, 2003). The Earth Simulator supercomputer retains the number one position with its Linpack benchmark performance of 35.86 Tflop/s (''teraflops'' or trillions of calculations per second). It was built by NEC and installed last year at the Earth Simulator Center in Yokohama, Japan.

INTEL: Intel based systems move up in supercomputing ranks

CERN Multimedia

2002-01-01

"The TOP500 supercomputer rankings released today at the Supercomputing 2002 conference show a dramatic increase in the number of Intel-based systems being deployed in high-performance computing (HPC) or supercomputing areas" (1/2 page).

World's fastest supercomputer opens up to users

Science.gov (United States)

Xin, Ling

2016-08-01

China's latest supercomputer - Sunway TaihuLight - has claimed the crown as the world's fastest computer according to the latest TOP500 list, released at the International Supercomputer Conference in Frankfurt in late June.

OpenMP Performance on the Columbia Supercomputer

Science.gov (United States)

Haoqiang, Jin; Hood, Robert

2005-01-01

This presentation discusses Columbia World Class Supercomputer which is one of the world's fastest supercomputers providing 61 TFLOPs (10/20/04). Conceived, designed, built, and deployed in just 120 days. A 20-node supercomputer built on proven 512-processor nodes. The largest SGI system in the world with over 10,000 Intel Itanium 2 processors and provides the largest node size incorporating commodity parts (512) and the largest shared-memory environment (2048) with 88% efficiency tops the scalar systems on the Top500 list.

Guide to dataflow supercomputing basic concepts, case studies, and a detailed example

CERN Document Server

Milutinovic, Veljko; Trifunovic, Nemanja; Giorgi, Roberto

2015-01-01

This unique text/reference describes an exciting and novel approach to supercomputing in the DataFlow paradigm. The major advantages and applications of this approach are clearly described, and a detailed explanation of the programming model is provided using simple yet effective examples. The work is developed from a series of lecture courses taught by the authors in more than 40 universities across more than 20 countries, and from research carried out by Maxeler Technologies, Inc. Topics and features: presents a thorough introduction to DataFlow supercomputing for big data problems; revie

Supercomputer and cluster performance modeling and analysis efforts:2004-2006.

Energy Technology Data Exchange (ETDEWEB)

Sturtevant, Judith E.; Ganti, Anand; Meyer, Harold (Hal) Edward; Stevenson, Joel O.; Benner, Robert E., Jr. (.,; .); Goudy, Susan Phelps; Doerfler, Douglas W.; Domino, Stefan Paul; Taylor, Mark A.; Malins, Robert Joseph; Scott, Ryan T.; Barnette, Daniel Wayne; Rajan, Mahesh; Ang, James Alfred; Black, Amalia Rebecca; Laub, Thomas William; Vaughan, Courtenay Thomas; Franke, Brian Claude

2007-02-01

This report describes efforts by the Performance Modeling and Analysis Team to investigate performance characteristics of Sandia's engineering and scientific applications on the ASC capability and advanced architecture supercomputers, and Sandia's capacity Linux clusters. Efforts to model various aspects of these computers are also discussed. The goals of these efforts are to quantify and compare Sandia's supercomputer and cluster performance characteristics; to reveal strengths and weaknesses in such systems; and to predict performance characteristics of, and provide guidelines for, future acquisitions and follow-on systems. Described herein are the results obtained from running benchmarks and applications to extract performance characteristics and comparisons, as well as modeling efforts, obtained during the time period 2004-2006. The format of the report, with hypertext links to numerous additional documents, purposefully minimizes the document size needed to disseminate the extensive results from our research.

IMIRSEL: a secure music retrieval testing environment

Science.gov (United States)

Downie, John S.

2004-10-01

The Music Information Retrieval (MIR) and Music Digital Library (MDL) research communities have long noted the need for formal evaluation mechanisms. Issues concerning the unavailability of freely-available music materials have greatly hindered the creation of standardized test collections with which these communities could scientifically assess the strengths and weaknesses of their various music retrieval techniques. The International Music Information Retrieval Systems Evaluation Laboratory (IMIRSEL) is being developed at the University of Illinois at Urbana-Champaign (UIUC) specifically to overcome this hindrance to the scientific evaluation of MIR/MDL systems. Together with its subsidiary Human Use of Music Information Retrieval Systems (HUMIRS) project, IMIRSEL will allow MIR/MDL researchers access to the standardized large-scale collection of copyright-sensitive music materials and standardized test queries being housed at UIUC's National Center for Supercomputing Applications (NCSA). Virtual Research Labs (VRL), based upon NCSA's Data-to-Knowledge (D2K) tool set, are being developed through which MIR/MDL researchers will interact with the music materials under a "trusted code" security model.

Supercomputing - Use Cases, Advances, The Future (1/2)

CERN Multimedia

CERN. Geneva

2017-01-01

Supercomputing has become a staple of science and the poster child for aggressive developments in silicon technology, energy efficiency and programming. In this series we examine the key components of supercomputing setups and the various advances – recent and past – that made headlines and delivered bigger and bigger machines. We also take a closer look at the future prospects of supercomputing, and the extent of its overlap with high throughput computing, in the context of main use cases ranging from oil exploration to market simulation. On the first day, we will focus on the history and theory of supercomputing, the top500 list and the hardware that makes supercomputers tick. Lecturer's short bio: Andrzej Nowak has 10 years of experience in computing technologies, primarily from CERN openlab and Intel. At CERN, he managed a research lab collaborating with Intel and was part of the openlab Chief Technology Office. Andrzej also worked closely and initiated projects with the private sector (e.g. HP an...

Supercomputing - Use Cases, Advances, The Future (2/2)

CERN Multimedia

CERN. Geneva

2017-01-01

Supercomputing has become a staple of science and the poster child for aggressive developments in silicon technology, energy efficiency and programming. In this series we examine the key components of supercomputing setups and the various advances – recent and past – that made headlines and delivered bigger and bigger machines. We also take a closer look at the future prospects of supercomputing, and the extent of its overlap with high throughput computing, in the context of main use cases ranging from oil exploration to market simulation. On the second day, we will focus on software and software paradigms driving supercomputers, workloads that need supercomputing treatment, advances in technology and possible future developments. Lecturer's short bio: Andrzej Nowak has 10 years of experience in computing technologies, primarily from CERN openlab and Intel. At CERN, he managed a research lab collaborating with Intel and was part of the openlab Chief Technology Office. Andrzej also worked closely and i...

Adaptability of supercomputers to nuclear computations

International Nuclear Information System (INIS)

Asai, Kiyoshi; Ishiguro, Misako; Matsuura, Toshihiko.

1983-01-01

Recently in the field of scientific and technical calculation, the usefulness of supercomputers represented by CRAY-1 has been recognized, and they are utilized in various countries. The rapid computation of supercomputers is based on the function of vector computation. The authors investigated the adaptability to vector computation of about 40 typical atomic energy codes for the past six years. Based on the results of investigation, the adaptability of the function of vector computation that supercomputers have to atomic energy codes, the problem regarding the utilization and the future prospect are explained. The adaptability of individual calculation codes to vector computation is largely dependent on the algorithm and program structure used for the codes. The change to high speed by pipeline vector system, the investigation in the Japan Atomic Energy Research Institute and the results, and the examples of expressing the codes for atomic energy, environmental safety and nuclear fusion by vector are reported. The magnification of speed up for 40 examples was from 1.5 to 9.0. It can be said that the adaptability of supercomputers to atomic energy codes is fairly good. (Kako, I.)

Research to application: Supercomputing trends for the 90's - Opportunities for interdisciplinary computations

International Nuclear Information System (INIS)

Shankar, V.

1991-01-01

The progression of supercomputing is reviewed from the point of view of computational fluid dynamics (CFD), and multidisciplinary problems impacting the design of advanced aerospace configurations are addressed. The application of full potential and Euler equations to transonic and supersonic problems in the 70s and early 80s is outlined, along with Navier-Stokes computations widespread during the late 80s and early 90s. Multidisciplinary computations currently in progress are discussed, including CFD and aeroelastic coupling for both static and dynamic flexible computations, CFD, aeroelastic, and controls coupling for flutter suppression and active control, and the development of a computational electromagnetics technology based on CFD methods. Attention is given to computational challenges standing in a way of the concept of establishing a computational environment including many technologies. 40 refs

A supercomputing application for reactors core design and optimization

International Nuclear Information System (INIS)

Hourcade, Edouard; Gaudier, Fabrice; Arnaud, Gilles; Funtowiez, David; Ammar, Karim

2010-01-01

Advanced nuclear reactor designs are often intuition-driven processes where designers first develop or use simplified simulation tools for each physical phenomenon involved. Through the project development, complexity in each discipline increases and implementation of chaining/coupling capabilities adapted to supercomputing optimization process are often postponed to a further step so that task gets increasingly challenging. In the context of renewal in reactor designs, project of first realization are often run in parallel with advanced design although very dependant on final options. As a consequence, the development of tools to globally assess/optimize reactor core features, with the on-going design methods accuracy, is needed. This should be possible within reasonable simulation time and without advanced computer skills needed at project management scale. Also, these tools should be ready to easily cope with modeling progresses in each discipline through project life-time. An early stage development of multi-physics package adapted to supercomputing is presented. The URANIE platform, developed at CEA and based on the Data Analysis Framework ROOT, is very well adapted to this approach. It allows diversified sampling techniques (SRS, LHS, qMC), fitting tools (neuronal networks...) and optimization techniques (genetic algorithm). Also data-base management and visualization are made very easy. In this paper, we'll present the various implementing steps of this core physics tool where neutronics, thermo-hydraulics, and fuel mechanics codes are run simultaneously. A relevant example of optimization of nuclear reactor safety characteristics will be presented. Also, flexibility of URANIE tool will be illustrated with the presentation of several approaches to improve Pareto front quality. (author)

Analyzing the Interplay of Failures and Workload on a Leadership-Class Supercomputer

Energy Technology Data Exchange (ETDEWEB)

Meneses, Esteban [University of Pittsburgh; Ni, Xiang [University of Illinois at Urbana-Champaign; Jones, Terry R [ORNL; Maxwell, Don E [ORNL

2015-01-01

The unprecedented computational power of cur- rent supercomputers now makes possible the exploration of complex problems in many scientific fields, from genomic analysis to computational fluid dynamics. Modern machines are powerful because they are massive: they assemble millions of cores and a huge quantity of disks, cards, routers, and other components. But it is precisely the size of these machines that glooms the future of supercomputing. A system that comprises many components has a high chance to fail, and fail often. In order to make the next generation of supercomputers usable, it is imperative to use some type of fault tolerance platform to run applications on large machines. Most fault tolerance strategies can be optimized for the peculiarities of each system and boost efficacy by keeping the system productive. In this paper, we aim to understand how failure characterization can improve resilience in several layers of the software stack: applications, runtime systems, and job schedulers. We examine the Titan supercomputer, one of the fastest systems in the world. We analyze a full year of Titan in production and distill the failure patterns of the machine. By looking into Titan s log files and using the criteria of experts, we provide a detailed description of the types of failures. In addition, we inspect the job submission files and describe how the system is used. Using those two sources, we cross correlate failures in the machine to executing jobs and provide a picture of how failures affect the user experience. We believe such characterization is fundamental in developing appropriate fault tolerance solutions for Cray systems similar to Titan.

FPS scientific and supercomputers computers in chemistry

International Nuclear Information System (INIS)

Curington, I.J.

1987-01-01

FPS Array Processors, scientific computers, and highly parallel supercomputers are used in nearly all aspects of compute-intensive computational chemistry. A survey is made of work utilizing this equipment, both published and current research. The relationship of the computer architecture to computational chemistry is discussed, with specific reference to Molecular Dynamics, Quantum Monte Carlo simulations, and Molecular Graphics applications. Recent installations of the FPS T-Series are highlighted, and examples of Molecular Graphics programs running on the FPS-5000 are shown

TOP500 Supercomputers for November 2004

Energy Technology Data Exchange (ETDEWEB)

Strohmaier, Erich; Meuer, Hans W.; Dongarra, Jack; Simon, Horst D.

2004-11-08

24th Edition of TOP500 List of World's Fastest Supercomputers Released: DOE/IBM BlueGene/L and NASA/SGI's Columbia gain Top Positions MANNHEIM, Germany; KNOXVILLE, Tenn.; BERKELEY, Calif. In what has become a closely watched event in the world of high-performance computing, the 24th edition of the TOP500 list of the worlds fastest supercomputers was released today (November 8, 2004) at the SC2004 Conference in Pittsburgh, Pa.

TOP500 Supercomputers for June 2003

Energy Technology Data Exchange (ETDEWEB)

Strohmaier, Erich; Meuer, Hans W.; Dongarra, Jack; Simon, Horst D.

2003-06-23

21st Edition of TOP500 List of World's Fastest Supercomputers Released MANNHEIM, Germany; KNOXVILLE, Tenn.;&BERKELEY, Calif. In what has become a much-anticipated event in the world of high-performance computing, the 21st edition of the TOP500 list of the world's fastest supercomputers was released today (June 23, 2003). The Earth Simulator supercomputer built by NEC and installed last year at the Earth Simulator Center in Yokohama, Japan, with its Linpack benchmark performance of 35.86 Tflop/s (teraflops or trillions of calculations per second), retains the number one position. The number 2 position is held by the re-measured ASCI Q system at Los Alamos National Laboratory. With 13.88 Tflop/s, it is the second system ever to exceed the 10 Tflop/smark. ASCIQ was built by Hewlett-Packard and is based on the AlphaServerSC computer system.

TOP500 Supercomputers for June 2002

Energy Technology Data Exchange (ETDEWEB)

Strohmaier, Erich; Meuer, Hans W.; Dongarra, Jack; Simon, Horst D.

2002-06-20

19th Edition of TOP500 List of World's Fastest Supercomputers Released MANNHEIM, Germany; KNOXVILLE, Tenn.;&BERKELEY, Calif. In what has become a much-anticipated event in the world of high-performance computing, the 19th edition of the TOP500 list of the worlds fastest supercomputers was released today (June 20, 2002). The recently installed Earth Simulator supercomputer at the Earth Simulator Center in Yokohama, Japan, is as expected the clear new number 1. Its performance of 35.86 Tflop/s (trillions of calculations per second) running the Linpack benchmark is almost five times higher than the performance of the now No.2 IBM ASCI White system at Lawrence Livermore National Laboratory (7.2 Tflop/s). This powerful leap frogging to the top by a system so much faster than the previous top system is unparalleled in the history of the TOP500.

Status reports of supercomputing astrophysics in Japan

International Nuclear Information System (INIS)

Nakamura, Takashi; Nagasawa, Mikio

1990-01-01

The Workshop on Supercomputing Astrophysics was held at National Laboratory for High Energy Physics (KEK, Tsukuba) from August 31 to September 2, 1989. More than 40 participants of physicists, astronomers were attendant and discussed many topics in the informal atmosphere. The main purpose of this workshop was focused on the theoretical activities in computational astrophysics in Japan. It was also aimed to promote effective collaboration between the numerical experimentists working on supercomputing technique. The various subjects of the presented papers of hydrodynamics, plasma physics, gravitating systems, radiative transfer and general relativity are all stimulating. In fact, these numerical calculations become possible now in Japan owing to the power of Japanese supercomputer such as HITAC S820, Fujitsu VP400E and NEC SX-2. (J.P.N.)

Development of seismic tomography software for hybrid supercomputers

Science.gov (United States)

Nikitin, Alexandr; Serdyukov, Alexandr; Duchkov, Anton

2015-04-01

Seismic tomography is a technique used for computing velocity model of geologic structure from first arrival travel times of seismic waves. The technique is used in processing of regional and global seismic data, in seismic exploration for prospecting and exploration of mineral and hydrocarbon deposits, and in seismic engineering for monitoring the condition of engineering structures and the surrounding host medium. As a consequence of development of seismic monitoring systems and increasing volume of seismic data, there is a growing need for new, more effective computational algorithms for use in seismic tomography applications with improved performance, accuracy and resolution. To achieve this goal, it is necessary to use modern high performance computing systems, such as supercomputers with hybrid architecture that use not only CPUs, but also accelerators and co-processors for computation. The goal of this research is the development of parallel seismic tomography algorithms and software package for such systems, to be used in processing of large volumes of seismic data (hundreds of gigabytes and more). These algorithms and software package will be optimized for the most common computing devices used in modern hybrid supercomputers, such as Intel Xeon CPUs, NVIDIA Tesla accelerators and Intel Xeon Phi co-processors. In this work, the following general scheme of seismic tomography is utilized. Using the eikonal equation solver, arrival times of seismic waves are computed based on assumed velocity model of geologic structure being analyzed. In order to solve the linearized inverse problem, tomographic matrix is computed that connects model adjustments with travel time residuals, and the resulting system of linear equations is regularized and solved to adjust the model. The effectiveness of parallel implementations of existing algorithms on target architectures is considered. During the first stage of this work, algorithms were developed for execution on

Comprehensive efficiency analysis of supercomputer resource usage based on system monitoring data

Science.gov (United States)

Mamaeva, A. A.; Shaykhislamov, D. I.; Voevodin, Vad V.; Zhumatiy, S. A.

2018-03-01

One of the main problems of modern supercomputers is the low efficiency of their usage, which leads to the significant idle time of computational resources, and, in turn, to the decrease in speed of scientific research. This paper presents three approaches to study the efficiency of supercomputer resource usage based on monitoring data analysis. The first approach performs an analysis of computing resource utilization statistics, which allows to identify different typical classes of programs, to explore the structure of the supercomputer job flow and to track overall trends in the supercomputer behavior. The second approach is aimed specifically at analyzing off-the-shelf software packages and libraries installed on the supercomputer, since efficiency of their usage is becoming an increasingly important factor for the efficient functioning of the entire supercomputer. Within the third approach, abnormal jobs – jobs with abnormally inefficient behavior that differs significantly from the standard behavior of the overall supercomputer job flow – are being detected. For each approach, the results obtained in practice in the Supercomputer Center of Moscow State University are demonstrated.

Comments on the parallelization efficiency of the Sunway TaihuLight supercomputer

OpenAIRE

Végh, János

2016-01-01

In the world of supercomputers, the large number of processors requires to minimize the inefficiencies of parallelization, which appear as a sequential part of the program from the point of view of Amdahl's law. The recently suggested new figure of merit is applied to the recently presented supercomputer, and the timeline of "Top 500" supercomputers is scrutinized using the metric. It is demonstrated, that in addition to the computing performance and power consumption, the new supercomputer i...

The ETA10 supercomputer system

International Nuclear Information System (INIS)

Swanson, C.D.

1987-01-01

The ETA Systems, Inc. ETA 10 is a next-generation supercomputer featuring multiprocessing, a large hierarchical memory system, high performance input/output, and network support for both batch and interactive processing. Advanced technology used in the ETA 10 includes liquid nitrogen cooled CMOS logic with 20,000 gates per chip, a single printed circuit board for each CPU, and high density static and dynamics MOS memory chips. Software for the ETA 10 includes an underlying kernel that supports multiple user environments, a new ETA FORTRAN compiler with an advanced automatic vectorizer, a multitasking library and debugging tools. Possible developments for future supercomputers from ETA Systems are discussed. (orig.)

Efficient development of memory bounded geo-applications to scale on modern supercomputers

Science.gov (United States)

Räss, Ludovic; Omlin, Samuel; Licul, Aleksandar; Podladchikov, Yuri; Herman, Frédéric

2016-04-01

Numerical modeling is an actual key tool in the area of geosciences. The current challenge is to solve problems that are multi-physics and for which the length scale and the place of occurrence might not be known in advance. Also, the spatial extend of the investigated domain might strongly vary in size, ranging from millimeters for reactive transport to kilometers for glacier erosion dynamics. An efficient way to proceed is to develop simple but robust algorithms that perform well and scale on modern supercomputers and permit therefore very high-resolution simulations. We propose an efficient approach to solve memory bounded real-world applications on modern supercomputers architectures. We optimize the software to run on our newly acquired state-of-the-art GPU cluster "octopus". Our approach shows promising preliminary results on important geodynamical and geomechanical problematics: we have developed a Stokes solver for glacier flow and a poromechanical solver including complex rheologies for nonlinear waves in stressed rocks porous rocks. We solve the system of partial differential equations on a regular Cartesian grid and use an iterative finite difference scheme with preconditioning of the residuals. The MPI communication happens only locally (point-to-point); this method is known to scale linearly by construction. The "octopus" GPU cluster, which we use for the computations, has been designed to achieve maximal data transfer throughput at minimal hardware cost. It is composed of twenty compute nodes, each hosting four Nvidia Titan X GPU accelerators. These high-density nodes are interconnected with a parallel (dual-rail) FDR InfiniBand network. Our efforts show promising preliminary results for the different physics investigated. The glacier flow solver achieves good accuracy in the relevant benchmarks and the coupled poromechanical solver permits to explain previously unresolvable focused fluid flow as a natural outcome of the porosity setup. In both cases

Ultrascalable petaflop parallel supercomputer

Science.gov (United States)

Blumrich, Matthias A [Ridgefield, CT; Chen, Dong [Croton On Hudson, NY; Chiu, George [Cross River, NY; Cipolla, Thomas M [Katonah, NY; Coteus, Paul W [Yorktown Heights, NY; Gara, Alan G [Mount Kisco, NY; Giampapa, Mark E [Irvington, NY; Hall, Shawn [Pleasantville, NY; Haring, Rudolf A [Cortlandt Manor, NY; Heidelberger, Philip [Cortlandt Manor, NY; Kopcsay, Gerard V [Yorktown Heights, NY; Ohmacht, Martin [Yorktown Heights, NY; Salapura, Valentina [Chappaqua, NY; Sugavanam, Krishnan [Mahopac, NY; Takken, Todd [Brewster, NY

2010-07-20

A massively parallel supercomputer of petaOPS-scale includes node architectures based upon System-On-a-Chip technology, where each processing node comprises a single Application Specific Integrated Circuit (ASIC) having up to four processing elements. The ASIC nodes are interconnected by multiple independent networks that optimally maximize the throughput of packet communications between nodes with minimal latency. The multiple networks may include three high-speed networks for parallel algorithm message passing including a Torus, collective network, and a Global Asynchronous network that provides global barrier and notification functions. These multiple independent networks may be collaboratively or independently utilized according to the needs or phases of an algorithm for optimizing algorithm processing performance. The use of a DMA engine is provided to facilitate message passing among the nodes without the expenditure of processing resources at the node.

Computational Science with the Titan Supercomputer: Early Outcomes and Lessons Learned

Science.gov (United States)

Wells, Jack

2014-03-01

Modeling and simulation with petascale computing has supercharged the process of innovation and understanding, dramatically accelerating time-to-insight and time-to-discovery. This presentation will focus on early outcomes from the Titan supercomputer at the Oak Ridge National Laboratory. Titan has over 18,000 hybrid compute nodes consisting of both CPUs and GPUs. In this presentation, I will discuss the lessons we have learned in deploying Titan and preparing applications to move from conventional CPU architectures to a hybrid machine. I will present early results of materials applications running on Titan and the implications for the research community as we prepare for exascale supercomputer in the next decade. Lastly, I will provide an overview of user programs at the Oak Ridge Leadership Computing Facility with specific information how researchers may apply for allocations of computing resources. This research used resources of the Oak Ridge Leadership Computing Facility at the Oak Ridge National Laboratory, which is supported by the Office of Science of the U.S. Department of Energy under Contract No. DE-AC05-00OR22725.

Cooperative visualization and simulation in a supercomputer environment

International Nuclear Information System (INIS)

Ruehle, R.; Lang, U.; Wierse, A.

1993-01-01

The article takes a closer look on the requirements being imposed by the idea to integrate all the components into a homogeneous software environment. To this end several methods for the distribtuion of applications in dependence of certain problem types are discussed. The currently available methods at the University of Stuttgart Computer Center for the distribution of applications are further explained. Finally the aims and characteristics of a European sponsored project, called PAGEIN, are explained, which fits perfectly into the line of developments at RUS. The aim of the project is to experiment with future cooperative working modes of aerospace scientists in a high speed distributed supercomputing environment. Project results will have an impact on the development of real future scientific application environments. (orig./DG)

Supercomputers to transform Science

CERN Multimedia

2006-01-01

"New insights into the structure of space and time, climate modeling, and the design of novel drugs, are but a few of the many research areas that will be transforned by the installation of three supercomputers at the Unversity of Bristol." (1/2 page)

Convex unwraps its first grown-up supercomputer

Energy Technology Data Exchange (ETDEWEB)

Manuel, T.

1988-03-03

Convex Computer Corp.'s new supercomputer family is even more of an industry blockbuster than its first system. At a tenfold jump in performance, it's far from just an incremental upgrade over its first minisupercomputer, the C-1. The heart of the new family, the new C-2 processor, churning at 50 million floating-point operations/s, spawns a group of systems whose performance could pass for some fancy supercomputers-namely those of the Cray Research Inc. family. When added to the C-1, Convex's five new supercomputers create the C series, a six-member product group offering a performance range from 20 to 200 Mflops. They mark an important transition for Convex from a one-product high-tech startup to a multinational company with a wide-ranging product line. It's a tough transition but the Richardson, Texas, company seems to be doing it. The extended product line propels Convex into the upper end of the minisupercomputer class and nudges it into the low end of the big supercomputers. It positions Convex in an uncrowded segment of the market in the $500,000 to $1 million range offering 50 to 200 Mflops of performance. The company is making this move because the minisuper area, which it pioneered, quickly became crowded with new vendors, causing prices and gross margins to drop drastically.

An Interface for Biomedical Big Data Processing on the Tianhe-2 Supercomputer.

Science.gov (United States)

Yang, Xi; Wu, Chengkun; Lu, Kai; Fang, Lin; Zhang, Yong; Li, Shengkang; Guo, Guixin; Du, YunFei

2017-12-01

Big data, cloud computing, and high-performance computing (HPC) are at the verge of convergence. Cloud computing is already playing an active part in big data processing with the help of big data frameworks like Hadoop and Spark. The recent upsurge of high-performance computing in China provides extra possibilities and capacity to address the challenges associated with big data. In this paper, we propose Orion-a big data interface on the Tianhe-2 supercomputer-to enable big data applications to run on Tianhe-2 via a single command or a shell script. Orion supports multiple users, and each user can launch multiple tasks. It minimizes the effort needed to initiate big data applications on the Tianhe-2 supercomputer via automated configuration. Orion follows the "allocate-when-needed" paradigm, and it avoids the idle occupation of computational resources. We tested the utility and performance of Orion using a big genomic dataset and achieved a satisfactory performance on Tianhe-2 with very few modifications to existing applications that were implemented in Hadoop/Spark. In summary, Orion provides a practical and economical interface for big data processing on Tianhe-2.

Supercomputer debugging workshop 1991 proceedings

Energy Technology Data Exchange (ETDEWEB)

Brown, J.

1991-01-01

This report discusses the following topics on supercomputer debugging: Distributed debugging; use interface to debugging tools and standards; debugging optimized codes; debugging parallel codes; and debugger performance and interface as analysis tools. (LSP)

Supercomputer debugging workshop 1991 proceedings

Energy Technology Data Exchange (ETDEWEB)

Brown, J.

1991-12-31

This report discusses the following topics on supercomputer debugging: Distributed debugging; use interface to debugging tools and standards; debugging optimized codes; debugging parallel codes; and debugger performance and interface as analysis tools. (LSP)

The ETA systems plans for supercomputers

International Nuclear Information System (INIS)

Swanson, C.D.

1987-01-01

The ETA Systems, is a class VII supercomputer featuring multiprocessing, a large hierarchical memory system, high performance input/output, and network support for both batch and interactive processing. Advanced technology used in the ETA 10 includes liquid nitrogen cooled CMOS logic with 20,000 gates per chip, a single printed circuit board for each CPU, and high density static and dynamic MOS memory chips. Software for the ETA 10 includes an underlying kernel that supports multiple user environments, a new ETA FORTRAN compiler with an advanced automatic vectorizer, a multitasking library and debugging tools. Possible developments for future supercomputers from ETA Systems are discussed

Multi-petascale highly efficient parallel supercomputer

Science.gov (United States)

Asaad, Sameh; Bellofatto, Ralph E.; Blocksome, Michael A.; Blumrich, Matthias A.; Boyle, Peter; Brunheroto, Jose R.; Chen, Dong; Cher, Chen-Yong; Chiu, George L.; Christ, Norman; Coteus, Paul W.; Davis, Kristan D.; Dozsa, Gabor J.; Eichenberger, Alexandre E.; Eisley, Noel A.; Ellavsky, Matthew R.; Evans, Kahn C.; Fleischer, Bruce M.; Fox, Thomas W.; Gara, Alan; Giampapa, Mark E.; Gooding, Thomas M.; Gschwind, Michael K.; Gunnels, John A.; Hall, Shawn A.; Haring, Rudolf A.; Heidelberger, Philip; Inglett, Todd A.; Knudson, Brant L.; Kopcsay, Gerard V.; Kumar, Sameer; Mamidala, Amith R.; Marcella, James A.; Megerian, Mark G.; Miller, Douglas R.; Miller, Samuel J.; Muff, Adam J.; Mundy, Michael B.; O'Brien, John K.; O'Brien, Kathryn M.; Ohmacht, Martin; Parker, Jeffrey J.; Poole, Ruth J.; Ratterman, Joseph D.; Salapura, Valentina; Satterfield, David L.; Senger, Robert M.; Steinmacher-Burow, Burkhard; Stockdell, William M.; Stunkel, Craig B.; Sugavanam, Krishnan; Sugawara, Yutaka; Takken, Todd E.; Trager, Barry M.; Van Oosten, James L.; Wait, Charles D.; Walkup, Robert E.; Watson, Alfred T.; Wisniewski, Robert W.; Wu, Peng

2018-05-15

A Multi-Petascale Highly Efficient Parallel Supercomputer of 100 petaflop-scale includes node architectures based upon System-On-a-Chip technology, where each processing node comprises a single Application Specific Integrated Circuit (ASIC). The ASIC nodes are interconnected by a five dimensional torus network that optimally maximize the throughput of packet communications between nodes and minimize latency. The network implements collective network and a global asynchronous network that provides global barrier and notification functions. Integrated in the node design include a list-based prefetcher. The memory system implements transaction memory, thread level speculation, and multiversioning cache that improves soft error rate at the same time and supports DMA functionality allowing for parallel processing message-passing.

PNNL supercomputer to become largest computing resource on the Grid

CERN Multimedia

2002-01-01

Hewlett Packard announced that the US DOE Pacific Northwest National Laboratory will connect a 9.3-teraflop HP supercomputer to the DOE Science Grid. This will be the largest supercomputer attached to a computer grid anywhere in the world (1 page).

Integration Of PanDA Workload Management System With Supercomputers for ATLAS and Data Intensive Science

Energy Technology Data Exchange (ETDEWEB)

De, K [University of Texas at Arlington; Jha, S [Rutgers University; Klimentov, A [Brookhaven National Laboratory (BNL); Maeno, T [Brookhaven National Laboratory (BNL); Nilsson, P [Brookhaven National Laboratory (BNL); Oleynik, D [University of Texas at Arlington; Panitkin, S [Brookhaven National Laboratory (BNL); Wells, Jack C [ORNL; Wenaus, T [Brookhaven National Laboratory (BNL)

2016-01-01

was tested with a variety of Monte-Carlo workloads on several supercomputing platforms for ALICE and ATLAS experiments and it is in full production for the ATLAS experiment since September 2015. We will present our current accomplishments with running PanDA WMS at supercomputers and demonstrate our ability to use PanDA as a portal independent of the computing facilities infrastructure for High Energy and Nuclear Physics as well as other data-intensive science applications, such as bioinformatics and astro-particle physics.

Performance Evaluation of an Intel Haswell- and Ivy Bridge-Based Supercomputer Using Scientific and Engineering Applications

Science.gov (United States)

Saini, Subhash; Hood, Robert T.; Chang, Johnny; Baron, John

2016-01-01

We present a performance evaluation conducted on a production supercomputer of the Intel Xeon Processor E5- 2680v3, a twelve-core implementation of the fourth-generation Haswell architecture, and compare it with Intel Xeon Processor E5-2680v2, an Ivy Bridge implementation of the third-generation Sandy Bridge architecture. Several new architectural features have been incorporated in Haswell including improvements in all levels of the memory hierarchy as well as improvements to vector instructions and power management. We critically evaluate these new features of Haswell and compare with Ivy Bridge using several low-level benchmarks including subset of HPCC, HPCG and four full-scale scientific and engineering applications. We also present a model to predict the performance of HPCG and Cart3D within 5%, and Overflow within 10% accuracy.

Dust modelling and forecasting in the Barcelona Supercomputing Center: Activities and developments

Energy Technology Data Exchange (ETDEWEB)

Perez, C; Baldasano, J M; Jimenez-Guerrero, P; Jorba, O; Haustein, K; Basart, S [Earth Sciences Department. Barcelona Supercomputing Center. Barcelona (Spain); Cuevas, E [Izanaa Atmospheric Research Center. Agencia Estatal de Meteorologia, Tenerife (Spain); Nickovic, S [Atmospheric Research and Environment Branch, World Meteorological Organization, Geneva (Switzerland)], E-mail: carlos.perez@bsc.es

2009-03-01

The Barcelona Supercomputing Center (BSC) is the National Supercomputer Facility in Spain, hosting MareNostrum, one of the most powerful Supercomputers in Europe. The Earth Sciences Department of BSC operates daily regional dust and air quality forecasts and conducts intensive modelling research for short-term operational prediction. This contribution summarizes the latest developments and current activities in the field of sand and dust storm modelling and forecasting.

Dust modelling and forecasting in the Barcelona Supercomputing Center: Activities and developments

International Nuclear Information System (INIS)

Perez, C; Baldasano, J M; Jimenez-Guerrero, P; Jorba, O; Haustein, K; Basart, S; Cuevas, E; Nickovic, S

2009-01-01

The Barcelona Supercomputing Center (BSC) is the National Supercomputer Facility in Spain, hosting MareNostrum, one of the most powerful Supercomputers in Europe. The Earth Sciences Department of BSC operates daily regional dust and air quality forecasts and conducts intensive modelling research for short-term operational prediction. This contribution summarizes the latest developments and current activities in the field of sand and dust storm modelling and forecasting.

Feynman diagrams sampling for quantum field theories on the QPACE 2 supercomputer

Energy Technology Data Exchange (ETDEWEB)

Rappl, Florian

2016-08-01

This work discusses the application of Feynman diagram sampling in quantum field theories. The method uses a computer simulation to sample the diagrammatic space obtained in a series expansion. For running large physical simulations powerful computers are obligatory, effectively splitting the thesis in two parts. The first part deals with the method of Feynman diagram sampling. Here the theoretical background of the method itself is discussed. Additionally, important statistical concepts and the theory of the strong force, quantum chromodynamics, are introduced. This sets the context of the simulations. We create and evaluate a variety of models to estimate the applicability of diagrammatic methods. The method is then applied to sample the perturbative expansion of the vertex correction. In the end we obtain the value for the anomalous magnetic moment of the electron. The second part looks at the QPACE 2 supercomputer. This includes a short introduction to supercomputers in general, as well as a closer look at the architecture and the cooling system of QPACE 2. Guiding benchmarks of the InfiniBand network are presented. At the core of this part, a collection of best practices and useful programming concepts are outlined, which enables the development of efficient, yet easily portable, applications for the QPACE 2 system.

Integration Of PanDA Workload Management System With Supercomputers for ATLAS and Data Intensive Science

Science.gov (United States)

Klimentov, A.; De, K.; Jha, S.; Maeno, T.; Nilsson, P.; Oleynik, D.; Panitkin, S.; Wells, J.; Wenaus, T.

2016-10-01

The.LHC, operating at CERN, is leading Big Data driven scientific explorations. Experiments at the LHC explore the fundamental nature of matter and the basic forces that shape our universe. ATLAS, one of the largest collaborations ever assembled in the sciences, is at the forefront of research at the LHC. To address an unprecedented multi-petabyte data processing challenge, the ATLAS experiment is relying on a heterogeneous distributed computational infrastructure. The ATLAS experiment uses PanDA (Production and Data Analysis) Workload Management System for managing the workflow for all data processing on over 150 data centers. Through PanDA, ATLAS physicists see a single computing facility that enables rapid scientific breakthroughs for the experiment, even though the data centers are physically scattered all over the world. While PanDA currently uses more than 250,000 cores with a peak performance of 0.3 petaFLOPS, LHC data taking runs require more resources than grid can possibly provide. To alleviate these challenges, LHC experiments are engaged in an ambitious program to expand the current computing model to include additional resources such as the opportunistic use of supercomputers. We will describe a project aimed at integration of PanDA WMS with supercomputers in United States, in particular with Titan supercomputer at Oak Ridge Leadership Computing Facility. Current approach utilizes modified PanDA pilot framework for job submission to the supercomputers batch queues and local data management, with light-weight MPI wrappers to run single threaded workloads in parallel on LCFs multi-core worker nodes. This implementation was tested with a variety of Monte-Carlo workloads on several supercomputing platforms for ALICE and ATLAS experiments and it is in full pro duction for the ATLAS since September 2015. We will present our current accomplishments with running PanDA at supercomputers and demonstrate our ability to use PanDA as a portal independent of the

Integration Of PanDA Workload Management System With Supercomputers for ATLAS and Data Intensive Science

International Nuclear Information System (INIS)

Klimentov, A; Maeno, T; Nilsson, P; Panitkin, S; Wenaus, T; De, K; Oleynik, D; Jha, S; Wells, J

2016-01-01

The.LHC, operating at CERN, is leading Big Data driven scientific explorations. Experiments at the LHC explore the fundamental nature of matter and the basic forces that shape our universe. ATLAS, one of the largest collaborations ever assembled in the sciences, is at the forefront of research at the LHC. To address an unprecedented multi-petabyte data processing challenge, the ATLAS experiment is relying on a heterogeneous distributed computational infrastructure. The ATLAS experiment uses PanDA (Production and Data Analysis) Workload Management System for managing the workflow for all data processing on over 150 data centers. Through PanDA, ATLAS physicists see a single computing facility that enables rapid scientific breakthroughs for the experiment, even though the data centers are physically scattered all over the world. While PanDA currently uses more than 250,000 cores with a peak performance of 0.3 petaFLOPS, LHC data taking runs require more resources than grid can possibly provide. To alleviate these challenges, LHC experiments are engaged in an ambitious program to expand the current computing model to include additional resources such as the opportunistic use of supercomputers. We will describe a project aimed at integration of PanDA WMS with supercomputers in United States, in particular with Titan supercomputer at Oak Ridge Leadership Computing Facility. Current approach utilizes modified PanDA pilot framework for job submission to the supercomputers batch queues and local data management, with light-weight MPI wrappers to run single threaded workloads in parallel on LCFs multi-core worker nodes. This implementation was tested with a variety of Monte-Carlo workloads on several supercomputing platforms for ALICE and ATLAS experiments and it is in full pro duction for the ATLAS since September 2015. We will present our current accomplishments with running PanDA at supercomputers and demonstrate our ability to use PanDA as a portal independent of the

Building more powerful less expensive supercomputers using Processing-In-Memory (PIM) LDRD final report.

Energy Technology Data Exchange (ETDEWEB)

Murphy, Richard C.

2009-09-01

This report details the accomplishments of the 'Building More Powerful Less Expensive Supercomputers Using Processing-In-Memory (PIM)' LDRD ('PIM LDRD', number 105809) for FY07-FY09. Latency dominates all levels of supercomputer design. Within a node, increasing memory latency, relative to processor cycle time, limits CPU performance. Between nodes, the same increase in relative latency impacts scalability. Processing-In-Memory (PIM) is an architecture that directly addresses this problem using enhanced chip fabrication technology and machine organization. PIMs combine high-speed logic and dense, low-latency, high-bandwidth DRAM, and lightweight threads that tolerate latency by performing useful work during memory transactions. This work examines the potential of PIM-based architectures to support mission critical Sandia applications and an emerging class of more data intensive informatics applications. This work has resulted in a stronger architecture/implementation collaboration between 1400 and 1700. Additionally, key technology components have impacted vendor roadmaps, and we are in the process of pursuing these new collaborations. This work has the potential to impact future supercomputer design and construction, reducing power and increasing performance. This final report is organized as follow: this summary chapter discusses the impact of the project (Section 1), provides an enumeration of publications and other public discussion of the work (Section 1), and concludes with a discussion of future work and impact from the project (Section 1). The appendix contains reprints of the refereed publications resulting from this work.

Supercomputers Of The Future

Science.gov (United States)

Peterson, Victor L.; Kim, John; Holst, Terry L.; Deiwert, George S.; Cooper, David M.; Watson, Andrew B.; Bailey, F. Ron

1992-01-01

Report evaluates supercomputer needs of five key disciplines: turbulence physics, aerodynamics, aerothermodynamics, chemistry, and mathematical modeling of human vision. Predicts these fields will require computer speed greater than 10(Sup 18) floating-point operations per second (FLOP's) and memory capacity greater than 10(Sup 15) words. Also, new parallel computer architectures and new structured numerical methods will make necessary speed and capacity available.

JINR supercomputer of the module type for event parallel analysis

International Nuclear Information System (INIS)

Kolpakov, I.F.; Senner, A.E.; Smirnov, V.A.

1987-01-01

A model of a supercomputer with 50 million of operations per second is suggested. Its realization allows one to solve JINR data analysis problems for large spectrometers (in particular DELPHY collaboration). The suggested module supercomputer is based on 32-bit commercial available microprocessor with a processing rate of about 1 MFLOPS. The processors are combined by means of VME standard busbars. MicroVAX-11 is a host computer organizing the operation of the system. Data input and output is realized via microVAX-11 computer periphery. Users' software is based on the FORTRAN-77. The supercomputer is connected with a JINR net port and all JINR users get an access to the suggested system

Supercomputers and quantum field theory

International Nuclear Information System (INIS)

Creutz, M.

1985-01-01

A review is given of why recent simulations of lattice gauge theories have resulted in substantial demands from particle theorists for supercomputer time. These calculations have yielded first principle results on non-perturbative aspects of the strong interactions. An algorithm for simulating dynamical quark fields is discussed. 14 refs

Computational fluid dynamics research at the United Technologies Research Center requiring supercomputers

Science.gov (United States)

Landgrebe, Anton J.

1987-01-01

An overview of research activities at the United Technologies Research Center (UTRC) in the area of Computational Fluid Dynamics (CFD) is presented. The requirement and use of various levels of computers, including supercomputers, for the CFD activities is described. Examples of CFD directed toward applications to helicopters, turbomachinery, heat exchangers, and the National Aerospace Plane are included. Helicopter rotor codes for the prediction of rotor and fuselage flow fields and airloads were developed with emphasis on rotor wake modeling. Airflow and airload predictions and comparisons with experimental data are presented. Examples are presented of recent parabolized Navier-Stokes and full Navier-Stokes solutions for hypersonic shock-wave/boundary layer interaction, and hydrogen/air supersonic combustion. In addition, other examples of CFD efforts in turbomachinery Navier-Stokes methodology and separated flow modeling are presented. A brief discussion of the 3-tier scientific computing environment is also presented, in which the researcher has access to workstations, mid-size computers, and supercomputers.

Computational plasma physics and supercomputers

International Nuclear Information System (INIS)

Killeen, J.; McNamara, B.

1984-09-01

The Supercomputers of the 80's are introduced. They are 10 to 100 times more powerful than today's machines. The range of physics modeling in the fusion program is outlined. New machine architecture will influence particular codes, but parallel processing poses new coding difficulties. Increasing realism in simulations will require better numerics and more elaborate mathematics

Mistral Supercomputer Job History Analysis

OpenAIRE

Zasadziński, Michał; Muntés-Mulero, Victor; Solé, Marc; Ludwig, Thomas

2018-01-01

In this technical report, we show insights and results of operational data analysis from petascale supercomputer Mistral, which is ranked as 42nd most powerful in the world as of January 2018. Data sources include hardware monitoring data, job scheduler history, topology, and hardware information. We explore job state sequences, spatial distribution, and electric power patterns.

Interactive real-time nuclear plant simulations on a UNIX based supercomputer

International Nuclear Information System (INIS)

Behling, S.R.

1990-01-01

Interactive real-time nuclear plant simulations are critically important to train nuclear power plant engineers and operators. In addition, real-time simulations can be used to test the validity and timing of plant technical specifications and operational procedures. To accurately and confidently simulate a nuclear power plant transient in real-time, sufficient computer resources must be available. Since some important transients cannot be simulated using preprogrammed responses or non-physical models, commonly used simulation techniques may not be adequate. However, the power of a supercomputer allows one to accurately calculate the behavior of nuclear power plants even during very complex transients. Many of these transients can be calculated in real-time or quicker on the fastest supercomputers. The concept of running interactive real-time nuclear power plant transients on a supercomputer has been tested. This paper describes the architecture of the simulation program, the techniques used to establish real-time synchronization, and other issues related to the use of supercomputers in a new and potentially very important area. (author)

Flux-Level Transit Injection Experiments with NASA Pleiades Supercomputer

Science.gov (United States)

Li, Jie; Burke, Christopher J.; Catanzarite, Joseph; Seader, Shawn; Haas, Michael R.; Batalha, Natalie; Henze, Christopher; Christiansen, Jessie; Kepler Project, NASA Advanced Supercomputing Division

2016-06-01

Flux-Level Transit Injection (FLTI) experiments are executed with NASA's Pleiades supercomputer for the Kepler Mission. The latest release (9.3, January 2016) of the Kepler Science Operations Center Pipeline is used in the FLTI experiments. Their purpose is to validate the Analytic Completeness Model (ACM), which can be computed for all Kepler target stars, thereby enabling exoplanet occurrence rate studies. Pleiades, a facility of NASA's Advanced Supercomputing Division, is one of the world's most powerful supercomputers and represents NASA's state-of-the-art technology. We discuss the details of implementing the FLTI experiments on the Pleiades supercomputer. For example, taking into account that ~16 injections are generated by one core of the Pleiades processors in an hour, the “shallow” FLTI experiment, in which ~2000 injections are required per target star, can be done for 16% of all Kepler target stars in about 200 hours. Stripping down the transit search to bare bones, i.e. only searching adjacent high/low periods at high/low pulse durations, makes the computationally intensive FLTI experiments affordable. The design of the FLTI experiments and the analysis of the resulting data are presented in “Validating an Analytic Completeness Model for Kepler Target Stars Based on Flux-level Transit Injection Experiments” by Catanzarite et al. (#2494058).Kepler was selected as the 10th mission of the Discovery Program. Funding for the Kepler Mission has been provided by the NASA Science Mission Directorate.

The Pawsey Supercomputer geothermal cooling project

Science.gov (United States)

Regenauer-Lieb, K.; Horowitz, F.; Western Australian Geothermal Centre Of Excellence, T.

2010-12-01

The Australian Government has funded the Pawsey supercomputer in Perth, Western Australia, providing computational infrastructure intended to support the future operations of the Australian Square Kilometre Array radiotelescope and to boost next-generation computational geosciences in Australia. Supplementary funds have been directed to the development of a geothermal exploration well to research the potential for direct heat use applications at the Pawsey Centre site. Cooling the Pawsey supercomputer may be achieved by geothermal heat exchange rather than by conventional electrical power cooling, thus reducing the carbon footprint of the Pawsey Centre and demonstrating an innovative green technology that is widely applicable in industry and urban centres across the world. The exploration well is scheduled to be completed in 2013, with drilling due to commence in the third quarter of 2011. One year is allocated to finalizing the design of the exploration, monitoring and research well. Success in the geothermal exploration and research program will result in an industrial-scale geothermal cooling facility at the Pawsey Centre, and will provide a world-class student training environment in geothermal energy systems. A similar system is partially funded and in advanced planning to provide base-load air-conditioning for the main campus of the University of Western Australia. Both systems are expected to draw ~80-95 degrees C water from aquifers lying between 2000 and 3000 meters depth from naturally permeable rocks of the Perth sedimentary basin. The geothermal water will be run through absorption chilling devices, which only require heat (as opposed to mechanical work) to power a chilled water stream adequate to meet the cooling requirements. Once the heat has been removed from the geothermal water, licensing issues require the water to be re-injected back into the aquifer system. These systems are intended to demonstrate the feasibility of powering large-scale air

Getting To Exascale: Applying Novel Parallel Programming Models To Lab Applications For The Next Generation Of Supercomputers

Energy Technology Data Exchange (ETDEWEB)

Dube, Evi [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States); Shereda, Charles [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States); Nau, Lee [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States); Harris, Lance [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States)

2010-09-27

As supercomputing moves toward exascale, node architectures will change significantly. CPU core counts on nodes will increase by an order of magnitude or more. Heterogeneous architectures will become more commonplace, with GPUs or FPGAs providing additional computational power. Novel programming models may make better use of on-node parallelism in these new architectures than do current models. In this paper we examine several of these novel models – UPC, CUDA, and OpenCL –to determine their suitability to LLNL scientific application codes. Our study consisted of several phases: We conducted interviews with code teams and selected two codes to port; We learned how to program in the new models and ported the codes; We debugged and tuned the ported applications; We measured results, and documented our findings. We conclude that UPC is a challenge for porting code, Berkeley UPC is not very robust, and UPC is not suitable as a general alternative to OpenMP for a number of reasons. CUDA is well supported and robust but is a proprietary NVIDIA standard, while OpenCL is an open standard. Both are well suited to a specific set of application problems that can be run on GPUs, but some problems are not suited to GPUs. Further study of the landscape of novel models is recommended.

Extracting the Textual and Temporal Structure of Supercomputing Logs

Energy Technology Data Exchange (ETDEWEB)

Jain, S; Singh, I; Chandra, A; Zhang, Z; Bronevetsky, G

2009-05-26

Supercomputers are prone to frequent faults that adversely affect their performance, reliability and functionality. System logs collected on these systems are a valuable resource of information about their operational status and health. However, their massive size, complexity, and lack of standard format makes it difficult to automatically extract information that can be used to improve system management. In this work we propose a novel method to succinctly represent the contents of supercomputing logs, by using textual clustering to automatically find the syntactic structures of log messages. This information is used to automatically classify messages into semantic groups via an online clustering algorithm. Further, we describe a methodology for using the temporal proximity between groups of log messages to identify correlated events in the system. We apply our proposed methods to two large, publicly available supercomputing logs and show that our technique features nearly perfect accuracy for online log-classification and extracts meaningful structural and temporal message patterns that can be used to improve the accuracy of other log analysis techniques.

Visualization on supercomputing platform level II ASC milestone (3537-1B) results from Sandia.

Energy Technology Data Exchange (ETDEWEB)

Geveci, Berk (Kitware, Inc., Clifton Park, NY); Fabian, Nathan; Marion, Patrick (Kitware, Inc., Clifton Park, NY); Moreland, Kenneth D.

2010-09-01

This report provides documentation for the completion of the Sandia portion of the ASC Level II Visualization on the platform milestone. This ASC Level II milestone is a joint milestone between Sandia National Laboratories and Los Alamos National Laboratories. This milestone contains functionality required for performing visualization directly on a supercomputing platform, which is necessary for peta-scale visualization. Sandia's contribution concerns in-situ visualization, running a visualization in tandem with a solver. Visualization and analysis of petascale data is limited by several factors which must be addressed as ACES delivers the Cielo platform. Two primary difficulties are: (1) Performance of interactive rendering, which is most computationally intensive portion of the visualization process. For terascale platforms, commodity clusters with graphics processors(GPUs) have been used for interactive rendering. For petascale platforms, visualization and rendering may be able to run efficiently on the supercomputer platform itself. (2) I/O bandwidth, which limits how much information can be written to disk. If we simply analyze the sparse information that is saved to disk we miss the opportunity to analyze the rich information produced every timestep by the simulation. For the first issue, we are pursuing in-situ analysis, in which simulations are coupled directly with analysis libraries at runtime. This milestone will evaluate the visualization and rendering performance of current and next generation supercomputers in contrast to GPU-based visualization clusters, and evaluate the performance of common analysis libraries coupled with the simulation that analyze and write data to disk during a running simulation. This milestone will explore, evaluate and advance the maturity level of these technologies and their applicability to problems of interest to the ASC program. Scientific simulation on parallel supercomputers is traditionally performed in four

Storage-Intensive Supercomputing Benchmark Study

Energy Technology Data Exchange (ETDEWEB)

Cohen, J; Dossa, D; Gokhale, M; Hysom, D; May, J; Pearce, R; Yoo, A

2007-10-30

Critical data science applications requiring frequent access to storage perform poorly on today's computing architectures. This project addresses efficient computation of data-intensive problems in national security and basic science by exploring, advancing, and applying a new form of computing called storage-intensive supercomputing (SISC). Our goal is to enable applications that simply cannot run on current systems, and, for a broad range of data-intensive problems, to deliver an order of magnitude improvement in price/performance over today's data-intensive architectures. This technical report documents much of the work done under LDRD 07-ERD-063 Storage Intensive Supercomputing during the period 05/07-09/07. The following chapters describe: (1) a new file I/O monitoring tool iotrace developed to capture the dynamic I/O profiles of Linux processes; (2) an out-of-core graph benchmark for level-set expansion of scale-free graphs; (3) an entity extraction benchmark consisting of a pipeline of eight components; and (4) an image resampling benchmark drawn from the SWarp program in the LSST data processing pipeline. The performance of the graph and entity extraction benchmarks was measured in three different scenarios: data sets residing on the NFS file server and accessed over the network; data sets stored on local disk; and data sets stored on the Fusion I/O parallel NAND Flash array. The image resampling benchmark compared performance of software-only to GPU-accelerated. In addition to the work reported here, an additional text processing application was developed that used an FPGA to accelerate n-gram profiling for language classification. The n-gram application will be presented at SC07 at the High Performance Reconfigurable Computing Technologies and Applications Workshop. The graph and entity extraction benchmarks were run on a Supermicro server housing the NAND Flash 40GB parallel disk array, the Fusion-io. The Fusion system specs are as follows

SUPERCOMPUTERS FOR AIDING ECONOMIC PROCESSES WITH REFERENCE TO THE FINANCIAL SECTOR

Directory of Open Access Journals (Sweden)

Jerzy Balicki

2014-12-01

Full Text Available The article discusses the use of supercomputers to support business processes with particular emphasis on the financial sector. A reference was made to the selected projects that support economic development. In particular, we propose the use of supercomputers to perform artificial intel-ligence methods in banking. The proposed methods combined with modern technology enables a significant increase in the competitiveness of enterprises and banks by adding new functionality.

Visualization environment of the large-scale data of JAEA's supercomputer system

Energy Technology Data Exchange (ETDEWEB)

Sakamoto, Kensaku [Japan Atomic Energy Agency, Center for Computational Science and e-Systems, Tokai, Ibaraki (Japan); Hoshi, Yoshiyuki [Research Organization for Information Science and Technology (RIST), Tokai, Ibaraki (Japan)

2013-11-15

On research and development of various fields of nuclear energy, visualization of calculated data is especially useful to understand the result of simulation in an intuitive way. Many researchers who run simulations on the supercomputer in Japan Atomic Energy Agency (JAEA) are used to transfer calculated data files from the supercomputer to their local PCs for visualization. In recent years, as the size of calculated data has gotten larger with improvement of supercomputer performance, reduction of visualization processing time as well as efficient use of JAEA network is being required. As a solution, we introduced a remote visualization system which has abilities to utilize parallel processors on the supercomputer and to reduce the usage of network resources by transferring data of intermediate visualization process. This paper reports a study on the performance of image processing with the remote visualization system. The visualization processing time is measured and the influence of network speed is evaluated by varying the drawing mode, the size of visualization data and the number of processors. Based on this study, a guideline for using the remote visualization system is provided to show how the system can be used effectively. An upgrade policy of the next system is also shown. (author)

QCD on the BlueGene/L Supercomputer

International Nuclear Information System (INIS)

Bhanot, G.; Chen, D.; Gara, A.; Sexton, J.; Vranas, P.

2005-01-01

In June 2004 QCD was simulated for the first time at sustained speed exceeding 1 TeraFlops in the BlueGene/L supercomputer at the IBM T.J. Watson Research Lab. The implementation and performance of QCD in the BlueGene/L is presented

QCD on the BlueGene/L Supercomputer

Science.gov (United States)

Bhanot, G.; Chen, D.; Gara, A.; Sexton, J.; Vranas, P.

2005-03-01

In June 2004 QCD was simulated for the first time at sustained speed exceeding 1 TeraFlops in the BlueGene/L supercomputer at the IBM T.J. Watson Research Lab. The implementation and performance of QCD in the BlueGene/L is presented.

Proceedings of the first energy research power supercomputer users symposium

International Nuclear Information System (INIS)

1991-01-01

The Energy Research Power Supercomputer Users Symposium was arranged to showcase the richness of science that has been pursued and accomplished in this program through the use of supercomputers and now high performance parallel computers over the last year: this report is the collection of the presentations given at the Symposium. ''Power users'' were invited by the ER Supercomputer Access Committee to show that the use of these computational tools and the associated data communications network, ESNet, go beyond merely speeding up computations. Today the work often directly contributes to the advancement of the conceptual developments in their fields and the computational and network resources form the very infrastructure of today's science. The Symposium also provided an opportunity, which is rare in this day of network access to computing resources, for the invited users to compare and discuss their techniques and approaches with those used in other ER disciplines. The significance of new parallel architectures was highlighted by the interesting evening talk given by Dr. Stephen Orszag of Princeton University

Graphics supercomputer for computational fluid dynamics research

Science.gov (United States)

Liaw, Goang S.

1994-11-01

The objective of this project is to purchase a state-of-the-art graphics supercomputer to improve the Computational Fluid Dynamics (CFD) research capability at Alabama A & M University (AAMU) and to support the Air Force research projects. A cutting-edge graphics supercomputer system, Onyx VTX, from Silicon Graphics Computer Systems (SGI), was purchased and installed. Other equipment including a desktop personal computer, PC-486 DX2 with a built-in 10-BaseT Ethernet card, a 10-BaseT hub, an Apple Laser Printer Select 360, and a notebook computer from Zenith were also purchased. A reading room has been converted to a research computer lab by adding some furniture and an air conditioning unit in order to provide an appropriate working environments for researchers and the purchase equipment. All the purchased equipment were successfully installed and are fully functional. Several research projects, including two existing Air Force projects, are being performed using these facilities.

High temporal resolution mapping of seismic noise sources using heterogeneous supercomputers

Science.gov (United States)

Gokhberg, Alexey; Ermert, Laura; Paitz, Patrick; Fichtner, Andreas

2017-04-01

Time- and space-dependent distribution of seismic noise sources is becoming a key ingredient of modern real-time monitoring of various geo-systems. Significant interest in seismic noise source maps with high temporal resolution (days) is expected to come from a number of domains, including natural resources exploration, analysis of active earthquake fault zones and volcanoes, as well as geothermal and hydrocarbon reservoir monitoring. Currently, knowledge of noise sources is insufficient for high-resolution subsurface monitoring applications. Near-real-time seismic data, as well as advanced imaging methods to constrain seismic noise sources have recently become available. These methods are based on the massive cross-correlation of seismic noise records from all available seismic stations in the region of interest and are therefore very computationally intensive. Heterogeneous massively parallel supercomputing systems introduced in the recent years combine conventional multi-core CPU with GPU accelerators and provide an opportunity for manifold increase and computing performance. Therefore, these systems represent an efficient platform for implementation of a noise source mapping solution. We present the first results of an ongoing research project conducted in collaboration with the Swiss National Supercomputing Centre (CSCS). The project aims at building a service that provides seismic noise source maps for Central Europe with high temporal resolution (days to few weeks depending on frequency and data availability). The service is hosted on the CSCS computing infrastructure; all computationally intensive processing is performed on the massively parallel heterogeneous supercomputer "Piz Daint". The solution architecture is based on the Application-as-a-Service concept in order to provide the interested external researchers the regular access to the noise source maps. The solution architecture includes the following sub-systems: (1) data acquisition responsible for

Unique Methodologies for Nano/Micro Manufacturing Job Training Via Desktop Supercomputer Modeling and Simulation

Energy Technology Data Exchange (ETDEWEB)

Kimball, Clyde [Northern Illinois Univ., DeKalb, IL (United States); Karonis, Nicholas [Northern Illinois Univ., DeKalb, IL (United States); Lurio, Laurence [Northern Illinois Univ., DeKalb, IL (United States); Piot, Philippe [Northern Illinois Univ., DeKalb, IL (United States); Xiao, Zhili [Northern Illinois Univ., DeKalb, IL (United States); Glatz, Andreas [Northern Illinois Univ., DeKalb, IL (United States); Pohlman, Nicholas [Northern Illinois Univ., DeKalb, IL (United States); Hou, Minmei [Northern Illinois Univ., DeKalb, IL (United States); Demir, Veysel [Northern Illinois Univ., DeKalb, IL (United States); Song, Jie [Northern Illinois Univ., DeKalb, IL (United States); Duffin, Kirk [Northern Illinois Univ., DeKalb, IL (United States); Johns, Mitrick [Northern Illinois Univ., DeKalb, IL (United States); Sims, Thomas [Northern Illinois Univ., DeKalb, IL (United States); Yin, Yanbin [Northern Illinois Univ., DeKalb, IL (United States)

2012-11-21

This project establishes an initiative in high speed (Teraflop)/large-memory desktop supercomputing for modeling and simulation of dynamic processes important for energy and industrial applications. It provides a training ground for employment of current students in an emerging field with skills necessary to access the large supercomputing systems now present at DOE laboratories. It also provides a foundation for NIU faculty to quantum leap beyond their current small cluster facilities. The funding extends faculty and student capability to a new level of analytic skills with concomitant publication avenues. The components of the Hewlett Packard computer obtained by the DOE funds create a hybrid combination of a Graphics Processing System (12 GPU/Teraflops) and a Beowulf CPU system (144 CPU), the first expandable via the NIU GAEA system to ~60 Teraflops integrated with a 720 CPU Beowulf system. The software is based on access to the NVIDIA/CUDA library and the ability through MATLAB multiple licenses to create additional local programs. A number of existing programs are being transferred to the CPU Beowulf Cluster. Since the expertise necessary to create the parallel processing applications has recently been obtained at NIU, this effort for software development is in an early stage. The educational program has been initiated via formal tutorials and classroom curricula designed for the coming year. Specifically, the cost focus was on hardware acquisitions and appointment of graduate students for a wide range of applications in engineering, physics and computer science.

Use of high performance networks and supercomputers for real-time flight simulation

Science.gov (United States)

Cleveland, Jeff I., II

1993-01-01

In order to meet the stringent time-critical requirements for real-time man-in-the-loop flight simulation, computer processing operations must be consistent in processing time and be completed in as short a time as possible. These operations include simulation mathematical model computation and data input/output to the simulators. In 1986, in response to increased demands for flight simulation performance, NASA's Langley Research Center (LaRC), working with the contractor, developed extensions to the Computer Automated Measurement and Control (CAMAC) technology which resulted in a factor of ten increase in the effective bandwidth and reduced latency of modules necessary for simulator communication. This technology extension is being used by more than 80 leading technological developers in the United States, Canada, and Europe. Included among the commercial applications are nuclear process control, power grid analysis, process monitoring, real-time simulation, and radar data acquisition. Personnel at LaRC are completing the development of the use of supercomputers for mathematical model computation to support real-time flight simulation. This includes the development of a real-time operating system and development of specialized software and hardware for the simulator network. This paper describes the data acquisition technology and the development of supercomputing for flight simulation.

Computational plasma physics and supercomputers. Revision 1

International Nuclear Information System (INIS)

Killeen, J.; McNamara, B.

1985-01-01

The Supercomputers of the 80's are introduced. They are 10 to 100 times more powerful than today's machines. The range of physics modeling in the fusion program is outlined. New machine architecture will influence particular models, but parallel processing poses new programming difficulties. Increasing realism in simulations will require better numerics and more elaborate mathematical models

Centralized supercomputer support for magnetic fusion energy research

International Nuclear Information System (INIS)

Fuss, D.; Tull, G.G.

1984-01-01

High-speed computers with large memories are vital to magnetic fusion energy research. Magnetohydrodynamic (MHD), transport, equilibrium, Vlasov, particle, and Fokker-Planck codes that model plasma behavior play an important role in designing experimental hardware and interpreting the resulting data, as well as in advancing plasma theory itself. The size, architecture, and software of supercomputers to run these codes are often the crucial constraints on the benefits such computational modeling can provide. Hence, vector computers such as the CRAY-1 offer a valuable research resource. To meet the computational needs of the fusion program, the National Magnetic Fusion Energy Computer Center (NMFECC) was established in 1974 at the Lawrence Livermore National Laboratory. Supercomputers at the central computing facility are linked to smaller computer centers at each of the major fusion laboratories by a satellite communication network. In addition to providing large-scale computing, the NMFECC environment stimulates collaboration and the sharing of computer codes and data among the many fusion researchers in a cost-effective manner

Extending ATLAS Computing to Commercial Clouds and Supercomputers

CERN Document Server

Nilsson, P; The ATLAS collaboration; Filipcic, A; Klimentov, A; Maeno, T; Oleynik, D; Panitkin, S; Wenaus, T; Wu, W

2014-01-01

The Large Hadron Collider will resume data collection in 2015 with substantially increased computing requirements relative to its first 2009-2013 run. A near doubling of the energy and the data rate, high level of event pile-up, and detector upgrades will mean the number and complexity of events to be analyzed will increase dramatically. A naive extrapolation of the Run 1 experience would suggest that a 5-6 fold increase in computing resources are needed - impossible within the anticipated flat computing budgets in the near future. Consequently ATLAS is engaged in an ambitious program to expand its computing to all available resources, notably including opportunistic use of commercial clouds and supercomputers. Such resources present new challenges in managing heterogeneity, supporting data flows, parallelizing workflows, provisioning software, and other aspects of distributed computing, all while minimizing operational load. We will present the ATLAS experience to date with clouds and supercomputers, and des...

Performance characteristics of hybrid MPI/OpenMP implementations of NAS parallel benchmarks SP and BT on large-scale multicore supercomputers

KAUST Repository

Wu, Xingfu; Taylor, Valerie

2011-01-01

The NAS Parallel Benchmarks (NPB) are well-known applications with the fixed algorithms for evaluating parallel systems and tools. Multicore supercomputers provide a natural programming paradigm for hybrid programs, whereby OpenMP can be used with the data sharing with the multicores that comprise a node and MPI can be used with the communication between nodes. In this paper, we use SP and BT benchmarks of MPI NPB 3.3 as a basis for a comparative approach to implement hybrid MPI/OpenMP versions of SP and BT. In particular, we can compare the performance of the hybrid SP and BT with the MPI counterparts on large-scale multicore supercomputers. Our performance results indicate that the hybrid SP outperforms the MPI SP by up to 20.76%, and the hybrid BT outperforms the MPI BT by up to 8.58% on up to 10,000 cores on BlueGene/P at Argonne National Laboratory and Jaguar (Cray XT4/5) at Oak Ridge National Laboratory. We also use performance tools and MPI trace libraries available on these supercomputers to further investigate the performance characteristics of the hybrid SP and BT.

Performance characteristics of hybrid MPI/OpenMP implementations of NAS parallel benchmarks SP and BT on large-scale multicore supercomputers

KAUST Repository

Wu, Xingfu

2011-03-29

The NAS Parallel Benchmarks (NPB) are well-known applications with the fixed algorithms for evaluating parallel systems and tools. Multicore supercomputers provide a natural programming paradigm for hybrid programs, whereby OpenMP can be used with the data sharing with the multicores that comprise a node and MPI can be used with the communication between nodes. In this paper, we use SP and BT benchmarks of MPI NPB 3.3 as a basis for a comparative approach to implement hybrid MPI/OpenMP versions of SP and BT. In particular, we can compare the performance of the hybrid SP and BT with the MPI counterparts on large-scale multicore supercomputers. Our performance results indicate that the hybrid SP outperforms the MPI SP by up to 20.76%, and the hybrid BT outperforms the MPI BT by up to 8.58% on up to 10,000 cores on BlueGene/P at Argonne National Laboratory and Jaguar (Cray XT4/5) at Oak Ridge National Laboratory. We also use performance tools and MPI trace libraries available on these supercomputers to further investigate the performance characteristics of the hybrid SP and BT.

Tryton Supercomputer Capabilities for Analysis of Massive Data Streams

Directory of Open Access Journals (Sweden)

Krawczyk Henryk

2015-09-01

Full Text Available The recently deployed supercomputer Tryton, located in the Academic Computer Center of Gdansk University of Technology, provides great means for massive parallel processing. Moreover, the status of the Center as one of the main network nodes in the PIONIER network enables the fast and reliable transfer of data produced by miscellaneous devices scattered in the area of the whole country. The typical examples of such data are streams containing radio-telescope and satellite observations. Their analysis, especially with real-time constraints, can be challenging and requires the usage of dedicated software components. We propose a solution for such parallel analysis using the supercomputer, supervised by the KASKADA platform, which with the conjunction with immerse 3D visualization techniques can be used to solve problems such as pulsar detection and chronometric or oil-spill simulation on the sea surface.

Portable implementation model for CFD simulations. Application to hybrid CPU/GPU supercomputers

Science.gov (United States)

Oyarzun, Guillermo; Borrell, Ricard; Gorobets, Andrey; Oliva, Assensi

2017-10-01

Nowadays, high performance computing (HPC) systems experience a disruptive moment with a variety of novel architectures and frameworks, without any clarity of which one is going to prevail. In this context, the portability of codes across different architectures is of major importance. This paper presents a portable implementation model based on an algebraic operational approach for direct numerical simulation (DNS) and large eddy simulation (LES) of incompressible turbulent flows using unstructured hybrid meshes. The strategy proposed consists in representing the whole time-integration algorithm using only three basic algebraic operations: sparse matrix-vector product, a linear combination of vectors and dot product. The main idea is based on decomposing the nonlinear operators into a concatenation of two SpMV operations. This provides high modularity and portability. An exhaustive analysis of the proposed implementation for hybrid CPU/GPU supercomputers has been conducted with tests using up to 128 GPUs. The main objective consists in understanding the challenges of implementing CFD codes on new architectures.

Enabling Diverse Software Stacks on Supercomputers using High Performance Virtual Clusters.

Energy Technology Data Exchange (ETDEWEB)

Younge, Andrew J. [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States); Pedretti, Kevin [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States); Grant, Ryan [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States); Brightwell, Ron [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States)

2017-05-01

While large-scale simulations have been the hallmark of the High Performance Computing (HPC) community for decades, Large Scale Data Analytics (LSDA) workloads are gaining attention within the scientific community not only as a processing component to large HPC simulations, but also as standalone scientific tools for knowledge discovery. With the path towards Exascale, new HPC runtime systems are also emerging in a way that differs from classical distributed com- puting models. However, system software for such capabilities on the latest extreme-scale DOE supercomputing needs to be enhanced to more appropriately support these types of emerging soft- ware ecosystems. In this paper, we propose the use of Virtual Clusters on advanced supercomputing resources to enable systems to support not only HPC workloads, but also emerging big data stacks. Specifi- cally, we have deployed the KVM hypervisor within Cray's Compute Node Linux on a XC-series supercomputer testbed. We also use libvirt and QEMU to manage and provision VMs directly on compute nodes, leveraging Ethernet-over-Aries network emulation. To our knowledge, this is the first known use of KVM on a true MPP supercomputer. We investigate the overhead our solution using HPC benchmarks, both evaluating single-node performance as well as weak scaling of a 32-node virtual cluster. Overall, we find single node performance of our solution using KVM on a Cray is very efficient with near-native performance. However overhead increases by up to 20% as virtual cluster size increases, due to limitations of the Ethernet-over-Aries bridged network. Furthermore, we deploy Apache Spark with large data analysis workloads in a Virtual Cluster, ef- fectively demonstrating how diverse software ecosystems can be supported by High Performance Virtual Clusters.

Cellular-automata supercomputers for fluid-dynamics modeling

International Nuclear Information System (INIS)

Margolus, N.; Toffoli, T.; Vichniac, G.

1986-01-01

We report recent developments in the modeling of fluid dynamics, and give experimental results (including dynamical exponents) obtained using cellular automata machines. Because of their locality and uniformity, cellular automata lend themselves to an extremely efficient physical realization; with a suitable architecture, an amount of hardware resources comparable to that of a home computer can achieve (in the simulation of cellular automata) the performance of a conventional supercomputer

The TeraGyroid Experiment – Supercomputing 2003

Directory of Open Access Journals (Sweden)

R.J. Blake

2005-01-01

Full Text Available Amphiphiles are molecules with hydrophobic tails and hydrophilic heads. When dispersed in solvents, they self assemble into complex mesophases including the beautiful cubic gyroid phase. The goal of the TeraGyroid experiment was to study defect pathways and dynamics in these gyroids. The UK's supercomputing and USA's TeraGrid facilities were coupled together, through a dedicated high-speed network, into a single computational Grid for research work that peaked around the Supercomputing 2003 conference. The gyroids were modeled using lattice Boltzmann methods with parameter spaces explored using many 1283 and 3grid point simulations, this data being used to inform the world's largest three-dimensional time dependent simulation with 10243-grid points. The experiment generated some 2 TBytes of useful data. In terms of Grid technology the project demonstrated the migration of simulations (using Globus middleware to and fro across the Atlantic exploiting the availability of resources. Integration of the systems accelerated the time to insight. Distributed visualisation of the output datasets enabled the parameter space of the interactions within the complex fluid to be explored from a number of sites, informed by discourse over the Access Grid. The project was sponsored by EPSRC (UK and NSF (USA with trans-Atlantic optical bandwidth provided by British Telecommunications.

SUPERCOMPUTER SIMULATION OF CRITICAL PHENOMENA IN COMPLEX SOCIAL SYSTEMS

Directory of Open Access Journals (Sweden)

Petrus M.A. Sloot

2014-09-01

Full Text Available The paper describes a problem of computer simulation of critical phenomena in complex social systems on a petascale computing systems in frames of complex networks approach. The three-layer system of nested models of complex networks is proposed including aggregated analytical model to identify critical phenomena, detailed model of individualized network dynamics and model to adjust a topological structure of a complex network. The scalable parallel algorithm covering all layers of complex networks simulation is proposed. Performance of the algorithm is studied on different supercomputing systems. The issues of software and information infrastructure of complex networks simulation are discussed including organization of distributed calculations, crawling the data in social networks and results visualization. The applications of developed methods and technologies are considered including simulation of criminal networks disruption, fast rumors spreading in social networks, evolution of financial networks and epidemics spreading.

Lectures in Supercomputational Neurosciences Dynamics in Complex Brain Networks

CERN Document Server

Graben, Peter beim; Thiel, Marco; Kurths, Jürgen

2008-01-01

Computational Neuroscience is a burgeoning field of research where only the combined effort of neuroscientists, biologists, psychologists, physicists, mathematicians, computer scientists, engineers and other specialists, e.g. from linguistics and medicine, seem to be able to expand the limits of our knowledge. The present volume is an introduction, largely from the physicists' perspective, to the subject matter with in-depth contributions by system neuroscientists. A conceptual model for complex networks of neurons is introduced that incorporates many important features of the real brain, such as various types of neurons, various brain areas, inhibitory and excitatory coupling and the plasticity of the network. The computational implementation on supercomputers, which is introduced and discussed in detail in this book, will enable the readers to modify and adapt the algortihm for their own research. Worked-out examples of applications are presented for networks of Morris-Lecar neurons to model the cortical co...

Wavelet transform-vector quantization compression of supercomputer ocean model simulation output

Energy Technology Data Exchange (ETDEWEB)

Bradley, J N; Brislawn, C M

1992-11-12

We describe a new procedure for efficient compression of digital information for storage and transmission purposes. The algorithm involves a discrete wavelet transform subband decomposition of the data set, followed by vector quantization of the wavelet transform coefficients using application-specific vector quantizers. The new vector quantizer design procedure optimizes the assignment of both memory resources and vector dimensions to the transform subbands by minimizing an exponential rate-distortion functional subject to constraints on both overall bit-rate and encoder complexity. The wavelet-vector quantization method, which originates in digital image compression. is applicable to the compression of other multidimensional data sets possessing some degree of smoothness. In this paper we discuss the use of this technique for compressing the output of supercomputer simulations of global climate models. The data presented here comes from Semtner-Chervin global ocean models run at the National Center for Atmospheric Research and at the Los Alamos Advanced Computing Laboratory.

Re-inventing electromagnetics - Supercomputing solution of Maxwell's equations via direct time integration on space grids

International Nuclear Information System (INIS)

Taflove, A.

1992-01-01

This paper summarizes the present state and future directions of applying finite-difference and finite-volume time-domain techniques for Maxwell's equations on supercomputers to model complex electromagnetic wave interactions with structures. Applications so far have been dominated by radar cross section technology, but by no means are limited to this area. In fact, the gains we have made place us on the threshold of being able to make tremendous contributions to non-defense electronics and optical technology. Some of the most interesting research in these commercial areas is summarized. 47 refs

Role of supercomputers in magnetic fusion and energy research programs

International Nuclear Information System (INIS)

Killeen, J.

1985-06-01

The importance of computer modeling in magnetic fusion (MFE) and energy research (ER) programs is discussed. The need for the most advanced supercomputers is described, and the role of the National Magnetic Fusion Energy Computer Center in meeting these needs is explained

High Temporal Resolution Mapping of Seismic Noise Sources Using Heterogeneous Supercomputers

Science.gov (United States)

Paitz, P.; Gokhberg, A.; Ermert, L. A.; Fichtner, A.

2017-12-01

The time- and space-dependent distribution of seismic noise sources is becoming a key ingredient of modern real-time monitoring of various geo-systems like earthquake fault zones, volcanoes, geothermal and hydrocarbon reservoirs. We present results of an ongoing research project conducted in collaboration with the Swiss National Supercomputing Centre (CSCS). The project aims at building a service providing seismic noise source maps for Central Europe with high temporal resolution. We use source imaging methods based on the cross-correlation of seismic noise records from all seismic stations available in the region of interest. The service is hosted on the CSCS computing infrastructure; all computationally intensive processing is performed on the massively parallel heterogeneous supercomputer "Piz Daint". The solution architecture is based on the Application-as-a-Service concept to provide the interested researchers worldwide with regular access to the noise source maps. The solution architecture includes the following sub-systems: (1) data acquisition responsible for collecting, on a periodic basis, raw seismic records from the European seismic networks, (2) high-performance noise source mapping application responsible for the generation of source maps using cross-correlation of seismic records, (3) back-end infrastructure for the coordination of various tasks and computations, (4) front-end Web interface providing the service to the end-users and (5) data repository. The noise source mapping itself rests on the measurement of logarithmic amplitude ratios in suitably pre-processed noise correlations, and the use of simplified sensitivity kernels. During the implementation we addressed various challenges, in particular, selection of data sources and transfer protocols, automation and monitoring of daily data downloads, ensuring the required data processing performance, design of a general service-oriented architecture for coordination of various sub-systems, and

Application of the NCSA Habanero tool for collaboration on structural integrity assessments

International Nuclear Information System (INIS)

Bass, B.R.; Kruse, K.; Dodds, R.H. Jr.; Malik, S.N.M.

1998-11-01

The Habanero software was developed by the National Center for Superconducting Applications at the University of Illinois, Urbana-Champaign, as a framework for the collaborative sharing of Java applications. The Habanero tool performs distributed communication of single-user, computer software interactions to a multiuser collaborative environment. An investigation was conducted to evaluate the capabilities of the Habanero tool in providing an Internet-based collaborative framework for researchers located at different sites and operating on different workstations. These collaborative sessions focused on the sharing of test data and analysis results from materials engineering areas (i.e., fracture mechanics and structural integrity evaluations) related to reactor pressure vessel safety research sponsored by the US Nuclear Regulatory Commission. This report defines collaborative-system requirements for engineering applications and provides an overview of collaborative systems within the project. The installation, application, and detailed evaluation of the performance of the Habanero collaborative tool are compared to those of another commercially available collaborative product. Recommendations are given for future work in collaborative communications

Direct exploitation of a top 500 Supercomputer for Analysis of CMS Data

International Nuclear Information System (INIS)

Cabrillo, I; Cabellos, L; Marco, J; Fernandez, J; Gonzalez, I

2014-01-01

The Altamira Supercomputer hosted at the Instituto de Fisica de Cantatbria (IFCA) entered in operation in summer 2012. Its last generation FDR Infiniband network used (for message passing) in parallel jobs, supports the connection to General Parallel File System (GPFS) servers, enabling an efficient simultaneous processing of multiple data demanding jobs. Sharing a common GPFS system and a single LDAP-based identification with the existing Grid clusters at IFCA allows CMS researchers to exploit the large instantaneous capacity of this supercomputer to execute analysis jobs. The detailed experience describing this opportunistic use for skimming and final analysis of CMS 2012 data for a specific physics channel, resulting in an order of magnitude reduction of the waiting time, is presented.

Plane-wave electronic structure calculations on a parallel supercomputer

International Nuclear Information System (INIS)

Nelson, J.S.; Plimpton, S.J.; Sears, M.P.

1993-01-01

The development of iterative solutions of Schrodinger's equation in a plane-wave (pw) basis over the last several years has coincided with great advances in the computational power available for performing the calculations. These dual developments have enabled many new and interesting condensed matter phenomena to be studied from a first-principles approach. The authors present a detailed description of the implementation on a parallel supercomputer (hypercube) of the first-order equation-of-motion solution to Schrodinger's equation, using plane-wave basis functions and ab initio separable pseudopotentials. By distributing the plane-waves across the processors of the hypercube many of the computations can be performed in parallel, resulting in decreases in the overall computation time relative to conventional vector supercomputers. This partitioning also provides ample memory for large Fast Fourier Transform (FFT) meshes and the storage of plane-wave coefficients for many hundreds of energy bands. The usefulness of the parallel techniques is demonstrated by benchmark timings for both the FFT's and iterations of the self-consistent solution of Schrodinger's equation for different sized Si unit cells of up to 512 atoms

Problem solving in nuclear engineering using supercomputers

International Nuclear Information System (INIS)

Schmidt, F.; Scheuermann, W.; Schatz, A.

1987-01-01

The availability of supercomputers enables the engineer to formulate new strategies for problem solving. One such strategy is the Integrated Planning and Simulation System (IPSS). With the integrated systems, simulation models with greater consistency and good agreement with actual plant data can be effectively realized. In the present work some of the basic ideas of IPSS are described as well as some of the conditions necessary to build such systems. Hardware and software characteristics as realized are outlined. (orig.) [de

Visualizing quantum scattering on the CM-2 supercomputer

International Nuclear Information System (INIS)

Richardson, J.L.

1991-01-01

We implement parallel algorithms for solving the time-dependent Schroedinger equation on the CM-2 supercomputer. These methods are unconditionally stable as well as unitary at each time step and have the advantage of being spatially local and explicit. We show how to visualize the dynamics of quantum scattering using techniques for visualizing complex wave functions. Several scattering problems are solved to demonstrate the use of these methods. (orig.)

Integration of Titan supercomputer at OLCF with ATLAS Production System

CERN Document Server

AUTHOR|(SzGeCERN)643806; The ATLAS collaboration; De, Kaushik; Klimentov, Alexei; Nilsson, Paul; Oleynik, Danila; Padolski, Siarhei; Panitkin, Sergey; Wenaus, Torre

2017-01-01

The PanDA (Production and Distributed Analysis) workload management system was developed to meet the scale and complexity of distributed computing for the ATLAS experiment. PanDA managed resources are distributed worldwide, on hundreds of computing sites, with thousands of physicists accessing hundreds of Petabytes of data and the rate of data processing already exceeds Exabyte per year. While PanDA currently uses more than 200,000 cores at well over 100 Grid sites, future LHC data taking runs will require more resources than Grid computing can possibly provide. Additional computing and storage resources are required. Therefore ATLAS is engaged in an ambitious program to expand the current computing model to include additional resources such as the opportunistic use of supercomputers. In this paper we will describe a project aimed at integration of ATLAS Production System with Titan supercomputer at Oak Ridge Leadership Computing Facility (OLCF). Current approach utilizes modified PanDA Pilot framework for jo...

Integration of Titan supercomputer at OLCF with ATLAS production system

CERN Document Server

Panitkin, Sergey; The ATLAS collaboration

2016-01-01

The PanDA (Production and Distributed Analysis) workload management system was developed to meet the scale and complexity of distributed computing for the ATLAS experiment. PanDA managed resources are distributed worldwide, on hundreds of computing sites, with thousands of physicists accessing hundreds of Petabytes of data and the rate of data processing already exceeds Exabyte per year. While PanDA currently uses more than 200,000 cores at well over 100 Grid sites, future LHC data taking runs will require more resources than Grid computing can possibly provide. Additional computing and storage resources are required. Therefore ATLAS is engaged in an ambitious program to expand the current computing model to include additional resources such as the opportunistic use of supercomputers. In this talk we will describe a project aimed at integration of ATLAS Production System with Titan supercomputer at Oak Ridge Leadership Computing Facility (OLCF). Current approach utilizes modified PanDA Pilot framework for job...

Supercomputer algorithms for reactivity, dynamics and kinetics of small molecules

International Nuclear Information System (INIS)

Lagana, A.

1989-01-01

Even for small systems, the accurate characterization of reactive processes is so demanding of computer resources as to suggest the use of supercomputers having vector and parallel facilities. The full advantages of vector and parallel architectures can sometimes be obtained by simply modifying existing programs, vectorizing the manipulation of vectors and matrices, and requiring the parallel execution of independent tasks. More often, however, a significant time saving can be obtained only when the computer code undergoes a deeper restructuring, requiring a change in the computational strategy or, more radically, the adoption of a different theoretical treatment. This book discusses supercomputer strategies based upon act and approximate methods aimed at calculating the electronic structure and the reactive properties of small systems. The book shows how, in recent years, intense design activity has led to the ability to calculate accurate electronic structures for reactive systems, exact and high-level approximations to three-dimensional reactive dynamics, and to efficient directive and declaratory software for the modelling of complex systems

Design of multiple sequence alignment algorithms on parallel, distributed memory supercomputers.

Science.gov (United States)

Church, Philip C; Goscinski, Andrzej; Holt, Kathryn; Inouye, Michael; Ghoting, Amol; Makarychev, Konstantin; Reumann, Matthias

2011-01-01

The challenge of comparing two or more genomes that have undergone recombination and substantial amounts of segmental loss and gain has recently been addressed for small numbers of genomes. However, datasets of hundreds of genomes are now common and their sizes will only increase in the future. Multiple sequence alignment of hundreds of genomes remains an intractable problem due to quadratic increases in compute time and memory footprint. To date, most alignment algorithms are designed for commodity clusters without parallelism. Hence, we propose the design of a multiple sequence alignment algorithm on massively parallel, distributed memory supercomputers to enable research into comparative genomics on large data sets. Following the methodology of the sequential progressiveMauve algorithm, we design data structures including sequences and sorted k-mer lists on the IBM Blue Gene/P supercomputer (BG/P). Preliminary results show that we can reduce the memory footprint so that we can potentially align over 250 bacterial genomes on a single BG/P compute node. We verify our results on a dataset of E.coli, Shigella and S.pneumoniae genomes. Our implementation returns results matching those of the original algorithm but in 1/2 the time and with 1/4 the memory footprint for scaffold building. In this study, we have laid the basis for multiple sequence alignment of large-scale datasets on a massively parallel, distributed memory supercomputer, thus enabling comparison of hundreds instead of a few genome sequences within reasonable time.

MEGADOCK 4.0: an ultra-high-performance protein-protein docking software for heterogeneous supercomputers.

Science.gov (United States)

Ohue, Masahito; Shimoda, Takehiro; Suzuki, Shuji; Matsuzaki, Yuri; Ishida, Takashi; Akiyama, Yutaka

2014-11-15

The application of protein-protein docking in large-scale interactome analysis is a major challenge in structural bioinformatics and requires huge computing resources. In this work, we present MEGADOCK 4.0, an FFT-based docking software that makes extensive use of recent heterogeneous supercomputers and shows powerful, scalable performance of >97% strong scaling. MEGADOCK 4.0 is written in C++ with OpenMPI and NVIDIA CUDA 5.0 (or later) and is freely available to all academic and non-profit users at: http://www.bi.cs.titech.ac.jp/megadock. akiyama@cs.titech.ac.jp Supplementary data are available at Bioinformatics online. © The Author 2014. Published by Oxford University Press.

Palacios and Kitten : high performance operating systems for scalable virtualized and native supercomputing.

Energy Technology Data Exchange (ETDEWEB)

Widener, Patrick (University of New Mexico); Jaconette, Steven (Northwestern University); Bridges, Patrick G. (University of New Mexico); Xia, Lei (Northwestern University); Dinda, Peter (Northwestern University); Cui, Zheng.; Lange, John (Northwestern University); Hudson, Trammell B.; Levenhagen, Michael J.; Pedretti, Kevin Thomas Tauke; Brightwell, Ronald Brian

2009-09-01

Palacios and Kitten are new open source tools that enable applications, whether ported or not, to achieve scalable high performance on large machines. They provide a thin layer over the hardware to support both full-featured virtualized environments and native code bases. Kitten is an OS under development at Sandia that implements a lightweight kernel architecture to provide predictable behavior and increased flexibility on large machines, while also providing Linux binary compatibility. Palacios is a VMM that is under development at Northwestern University and the University of New Mexico. Palacios, which can be embedded into Kitten and other OSes, supports existing, unmodified applications and operating systems by using virtualization that leverages hardware technologies. We describe the design and implementation of both Kitten and Palacios. Our benchmarks show that they provide near native, scalable performance. Palacios and Kitten provide an incremental path to using supercomputer resources that is not performance-compromised.

Application experiences with the Globus toolkit.

Energy Technology Data Exchange (ETDEWEB)

Brunett, S.

1998-06-09

The Globus grid toolkit is a collection of software components designed to support the development of applications for high-performance distributed computing environments, or ''computational grids'' [14]. The Globus toolkit is an implementation of a ''bag of services'' architecture, which provides application and tool developers not with a monolithic system but rather with a set of stand-alone services. Each Globus component provides a basic service, such as authentication, resource allocation, information, communication, fault detection, and remote data access. Different applications and tools can combine these services in different ways to construct ''grid-enabled'' systems. The Globus toolkit has been used to construct the Globus Ubiquitous Supercomputing Testbed, or GUSTO: a large-scale testbed spanning 20 sites and included over 4000 compute nodes for a total compute power of over 2 TFLOPS. Over the past six months, we and others have used this testbed to conduct a variety of application experiments, including multi-user collaborative environments (tele-immersion), computational steering, distributed supercomputing, and high throughput computing. The goal of this paper is to review what has been learned from these experiments regarding the effectiveness of the toolkit approach. To this end, we describe two of the application experiments in detail, noting what worked well and what worked less well. The two applications are a distributed supercomputing application, SF-Express, in which multiple supercomputers are harnessed to perform large distributed interactive simulations; and a tele-immersion application, CAVERNsoft, in which the focus is on connecting multiple people to a distributed simulated world.

A user-friendly web portal for T-Coffee on supercomputers

Directory of Open Access Journals (Sweden)

Koetsier Jos

2011-05-01

Full Text Available Abstract Background Parallel T-Coffee (PTC was the first parallel implementation of the T-Coffee multiple sequence alignment tool. It is based on MPI and RMA mechanisms. Its purpose is to reduce the execution time of the large-scale sequence alignments. It can be run on distributed memory clusters allowing users to align data sets consisting of hundreds of proteins within a reasonable time. However, most of the potential users of this tool are not familiar with the use of grids or supercomputers. Results In this paper we show how PTC can be easily deployed and controlled on a super computer architecture using a web portal developed using Rapid. Rapid is a tool for efficiently generating standardized portlets for a wide range of applications and the approach described here is generic enough to be applied to other applications, or to deploy PTC on different HPC environments. Conclusions The PTC portal allows users to upload a large number of sequences to be aligned by the parallel version of TC that cannot be aligned by a single machine due to memory and execution time constraints. The web portal provides a user-friendly solution.

Novel Supercomputing Approaches for High Performance Linear Algebra Using FPGAs, Phase II

Data.gov (United States)

National Aeronautics and Space Administration — Supercomputing plays a major role in many areas of science and engineering, and it has had tremendous impact for decades in areas such as aerospace, defense, energy,...

BSMBench: a flexible and scalable supercomputer benchmark from computational particle physics

CERN Document Server

Bennett, Ed; Del Debbio, Luigi; Jordan, Kirk; Patella, Agostino; Pica, Claudio; Rago, Antonio

2016-01-01

Benchmarking plays a central role in the evaluation of High Performance Computing architectures. Several benchmarks have been designed that allow users to stress various components of supercomputers. In order for the figures they provide to be useful, benchmarks need to be representative of the most common real-world scenarios. In this work, we introduce BSMBench, a benchmarking suite derived from Monte Carlo code used in computational particle physics. The advantage of this suite (which can be freely downloaded from http://www.bsmbench.org/) over others is the capacity to vary the relative importance of computation and communication. This enables the tests to simulate various practical situations. To showcase BSMBench, we perform a wide range of tests on various architectures, from desktop computers to state-of-the-art supercomputers, and discuss the corresponding results. Possible future directions of development of the benchmark are also outlined.

Intelligent Personal Supercomputer for Solving Scientific and Technical Problems

Directory of Open Access Journals (Sweden)

Khimich, O.M.

2016-09-01

Full Text Available New domestic intellіgent personal supercomputer of hybrid architecture Inparkom_pg for the mathematical modeling of processes in the defense industry, engineering, construction, etc. was developed. Intelligent software for the automatic research and tasks of computational mathematics with approximate data of different structures was designed. Applied software to provide mathematical modeling problems in construction, welding and filtration processes was implemented.

Supercomputers and the future of computational atomic scattering physics

International Nuclear Information System (INIS)

Younger, S.M.

1989-01-01

The advent of the supercomputer has opened new vistas for the computational atomic physicist. Problems of hitherto unparalleled complexity are now being examined using these new machines, and important connections with other fields of physics are being established. This talk briefly reviews some of the most important trends in computational scattering physics and suggests some exciting possibilities for the future. 7 refs., 2 figs

Computational fluid dynamics: complex flows requiring supercomputers. January 1975-July 1988 (Citations from the INSPEC: Information Services for the Physics and Engineering Communities data base). Report for January 1975-July 1988

International Nuclear Information System (INIS)

1988-08-01

This bibliography contains citations concerning computational fluid dynamics (CFD), a new method in computational science to perform complex flow simulations in three dimensions. Applications include aerodynamic design and analysis for aircraft, rockets, and missiles, and automobiles; heat-transfer studies; and combustion processes. Included are references to supercomputers, array processors, and parallel processors where needed for complete, integrated design. Also included are software packages and grid-generation techniques required to apply CFD numerical solutions. Numerical methods for fluid dynamics, not requiring supercomputers, are found in a separate published search. (Contains 83 citations fully indexed and including a title list.)

Easy Access to HPC Resources through the Application GUI

KAUST Repository

van Waveren, Matthijs

2016-11-01

The computing environment at the King Abdullah University of Science and Technology (KAUST) is growing in size and complexity. KAUST hosts the tenth fastest supercomputer in the world (Shaheen II) and several HPC clusters. Researchers can be inhibited by the complexity, as they need to learn new languages and execute many tasks in order to access the HPC clusters and the supercomputer. In order to simplify the access, we have developed an interface between the applications and the clusters and supercomputer that automates the transfer of input data and job submission and also the retrieval of results to the researcher’s local workstation. The innovation is that the user now submits his jobs from within the application GUI on his workstation, and does not have to directly log into the clusters or supercomputer anymore. This article details the solution and its benefits to the researchers.

Personal Supercomputing for Monte Carlo Simulation Using a GPU

Energy Technology Data Exchange (ETDEWEB)

Oh, Jae-Yong; Koo, Yang-Hyun; Lee, Byung-Ho [Korea Atomic Energy Research Institute, Daejeon (Korea, Republic of)

2008-05-15

Since the usability, accessibility, and maintenance of a personal computer (PC) are very good, a PC is a useful computer simulation tool for researchers. It has enough calculation power to simulate a small scale system with the improved performance of a PC's CPU. However, if a system is large or long time scale, we need a cluster computer or supercomputer. Recently great changes have occurred in the PC calculation environment. A graphic process unit (GPU) on a graphic card, only used to calculate display data, has a superior calculation capability to a PC's CPU. This GPU calculation performance is a match for the supercomputer in 2000. Although it has such a great calculation potential, it is not easy to program a simulation code for GPU due to difficult programming techniques for converting a calculation matrix to a 3D rendering image using graphic APIs. In 2006, NVIDIA provided the Software Development Kit (SDK) for the programming environment for NVIDIA's graphic cards, which is called the Compute Unified Device Architecture (CUDA). It makes the programming on the GPU easy without knowledge of the graphic APIs. This paper describes the basic architectures of NVIDIA's GPU and CUDA, and carries out a performance benchmark for the Monte Carlo simulation.

Personal Supercomputing for Monte Carlo Simulation Using a GPU

International Nuclear Information System (INIS)

Oh, Jae-Yong; Koo, Yang-Hyun; Lee, Byung-Ho

2008-01-01

Since the usability, accessibility, and maintenance of a personal computer (PC) are very good, a PC is a useful computer simulation tool for researchers. It has enough calculation power to simulate a small scale system with the improved performance of a PC's CPU. However, if a system is large or long time scale, we need a cluster computer or supercomputer. Recently great changes have occurred in the PC calculation environment. A graphic process unit (GPU) on a graphic card, only used to calculate display data, has a superior calculation capability to a PC's CPU. This GPU calculation performance is a match for the supercomputer in 2000. Although it has such a great calculation potential, it is not easy to program a simulation code for GPU due to difficult programming techniques for converting a calculation matrix to a 3D rendering image using graphic APIs. In 2006, NVIDIA provided the Software Development Kit (SDK) for the programming environment for NVIDIA's graphic cards, which is called the Compute Unified Device Architecture (CUDA). It makes the programming on the GPU easy without knowledge of the graphic APIs. This paper describes the basic architectures of NVIDIA's GPU and CUDA, and carries out a performance benchmark for the Monte Carlo simulation

Design and performance characterization of electronic structure calculations on massively parallel supercomputers

DEFF Research Database (Denmark)

Romero, N. A.; Glinsvad, Christian; Larsen, Ask Hjorth

2013-01-01

Density function theory (DFT) is the most widely employed electronic structure method because of its favorable scaling with system size and accuracy for a broad range of molecular and condensed-phase systems. The advent of massively parallel supercomputers has enhanced the scientific community...

Integration of PanDA workload management system with Titan supercomputer at OLCF

CERN Document Server

AUTHOR|(INSPIRE)INSPIRE-00300320; Klimentov, Alexei; Oleynik, Danila; Panitkin, Sergey; Petrosyan, Artem; Vaniachine, Alexandre; Wenaus, Torre; Schovancova, Jaroslava

2015-01-01

The PanDA (Production and Distributed Analysis) workload management system (WMS) was developed to meet the scale and complexity of LHC distributed computing for the ATLAS experiment. While PanDA currently distributes jobs to more than 100,000 cores at well over 100 Grid sites, next LHC data taking run will require more resources than Grid computing can possibly provide. To alleviate these challenges, ATLAS is engaged in an ambitious program to expand the current computing model to include additional resources such as the opportunistic use of supercomputers. We will describe a project aimed at integration of PanDA WMS with Titan supercomputer at Oak Ridge Leadership Computing Facility (OLCF). Current approach utilizes modi ed PanDA pilot framework for job submission to Titan's batch queues and local data management, with light-weight MPI wrappers to run single threaded workloads in parallel on Titan's multi-core worker nodes. It also gives PanDA new capability to collect, in real time, information about unused...

Integration of PanDA workload management system with Titan supercomputer at OLCF

CERN Document Server

Panitkin, Sergey; The ATLAS collaboration; Klimentov, Alexei; Oleynik, Danila; Petrosyan, Artem; Schovancova, Jaroslava; Vaniachine, Alexandre; Wenaus, Torre

2015-01-01

The PanDA (Production and Distributed Analysis) workload management system (WMS) was developed to meet the scale and complexity of LHC distributed computing for the ATLAS experiment. While PanDA currently uses more than 100,000 cores at well over 100 Grid sites with a peak performance of 0.3 petaFLOPS, next LHC data taking run will require more resources than Grid computing can possibly provide. To alleviate these challenges, ATLAS is engaged in an ambitious program to expand the current computing model to include additional resources such as the opportunistic use of supercomputers. We will describe a project aimed at integration of PanDA WMS with Titan supercomputer at Oak Ridge Leadership Computing Facility (OLCF). Current approach utilizes modified PanDA pilot framework for job submission to Titan's batch queues and local data management, with light-weight MPI wrappers to run single threaded workloads in parallel on Titan's multi-core worker nodes. It also gives PanDA new capability to collect, in real tim...

ParaBTM: A Parallel Processing Framework for Biomedical Text Mining on Supercomputers.

Science.gov (United States)

Xing, Yuting; Wu, Chengkun; Yang, Xi; Wang, Wei; Zhu, En; Yin, Jianping

2018-04-27

A prevailing way of extracting valuable information from biomedical literature is to apply text mining methods on unstructured texts. However, the massive amount of literature that needs to be analyzed poses a big data challenge to the processing efficiency of text mining. In this paper, we address this challenge by introducing parallel processing on a supercomputer. We developed paraBTM, a runnable framework that enables parallel text mining on the Tianhe-2 supercomputer. It employs a low-cost yet effective load balancing strategy to maximize the efficiency of parallel processing. We evaluated the performance of paraBTM on several datasets, utilizing three types of named entity recognition tasks as demonstration. Results show that, in most cases, the processing efficiency can be greatly improved with parallel processing, and the proposed load balancing strategy is simple and effective. In addition, our framework can be readily applied to other tasks of biomedical text mining besides NER.

Explaining the gap between theoretical peak performance and real performance for supercomputer architectures

International Nuclear Information System (INIS)

Schoenauer, W.; Haefner, H.

1993-01-01

The basic architectures of vector and parallel computers with their properties are presented. Then the memory size and the arithmetic operations in the context of memory bandwidth are discussed. For the exemplary discussion of a single operation micro-measurements of the vector triad for the IBM 3090 VF and the CRAY Y-MP/8 are presented. They reveal the details of the losses for a single operation. Then we analyze the global performance of a whole supercomputer by identifying reduction factors that bring down the theoretical peak performance to the poor real performance. The responsibilities of the manufacturer and of the user for these losses are dicussed. Then the price-performance ratio for different architectures in a snapshot of January 1991 is briefly mentioned. Finally some remarks to a user-friendly architecture for a supercomputer will be made. (orig.)

HPL and STREAM Benchmarks on SANAM Supercomputer

KAUST Repository

Bin Sulaiman, Riman A.

2017-01-01

SANAM supercomputer was jointly built by KACST and FIAS in 2012 ranking second that year in the Green500 list with a power efficiency of 2.3 GFLOPS/W (Rohr et al., 2014). It is a heterogeneous accelerator-based HPC system that has 300 compute nodes. Each node includes two Intel Xeon E5?2650 CPUs, two AMD FirePro S10000 dual GPUs and 128 GiB of main memory. In this work, the seven benchmarks of HPCC were installed and configured to reassess the performance of SANAM, as part of an unpublished master thesis, after it was reassembled in the Kingdom of Saudi Arabia. We present here detailed results of HPL and STREAM benchmarks.

HPL and STREAM Benchmarks on SANAM Supercomputer

KAUST Repository

Bin Sulaiman, Riman A.

2017-03-13

SANAM supercomputer was jointly built by KACST and FIAS in 2012 ranking second that year in the Green500 list with a power efficiency of 2.3 GFLOPS/W (Rohr et al., 2014). It is a heterogeneous accelerator-based HPC system that has 300 compute nodes. Each node includes two Intel Xeon E5?2650 CPUs, two AMD FirePro S10000 dual GPUs and 128 GiB of main memory. In this work, the seven benchmarks of HPCC were installed and configured to reassess the performance of SANAM, as part of an unpublished master thesis, after it was reassembled in the Kingdom of Saudi Arabia. We present here detailed results of HPL and STREAM benchmarks.

Fast and Accurate Simulation of the Cray XMT Multithreaded Supercomputer

Energy Technology Data Exchange (ETDEWEB)

Villa, Oreste; Tumeo, Antonino; Secchi, Simone; Manzano Franco, Joseph B.

2012-12-31

Irregular applications, such as data mining and analysis or graph-based computations, show unpredictable memory/network access patterns and control structures. Highly multithreaded architectures with large processor counts, like the Cray MTA-1, MTA-2 and XMT, appear to address their requirements better than commodity clusters. However, the research on highly multithreaded systems is currently limited by the lack of adequate architectural simulation infrastructures due to issues such as size of the machines, memory footprint, simulation speed, accuracy and customization. At the same time, Shared-memory MultiProcessors (SMPs) with multi-core processors have become an attractive platform to simulate large scale machines. In this paper, we introduce a cycle-level simulator of the highly multithreaded Cray XMT supercomputer. The simulator runs unmodified XMT applications. We discuss how we tackled the challenges posed by its development, detailing the techniques introduced to make the simulation as fast as possible while maintaining a high accuracy. By mapping XMT processors (ThreadStorm with 128 hardware threads) to host computing cores, the simulation speed remains constant as the number of simulated processors increases, up to the number of available host cores. The simulator supports zero-overhead switching among different accuracy levels at run-time and includes a network model that takes into account contention. On a modern 48-core SMP host, our infrastructure simulates a large set of irregular applications 500 to 2000 times slower than real time when compared to a 128-processor XMT, while remaining within 10\\% of accuracy. Emulation is only from 25 to 200 times slower than real time.

An efficient implementation of a backpropagation learning algorithm on quadrics parallel supercomputer

International Nuclear Information System (INIS)

Taraglio, S.; Massaioli, F.

1995-08-01

A parallel implementation of a library to build and train Multi Layer Perceptrons via the Back Propagation algorithm is presented. The target machine is the SIMD massively parallel supercomputer Quadrics. Performance measures are provided on three different machines with different number of processors, for two network examples. A sample source code is given

Supercomputing Centers and Electricity Service Providers

DEFF Research Database (Denmark)

Patki, Tapasya; Bates, Natalie; Ghatikar, Girish

2016-01-01

from a detailed, quantitative survey-based analysis and compare the perspectives of the European grid and SCs to the ones of the United States (US). We then show that contrary to the expectation, SCs in the US are more open toward cooperating and developing demand-management strategies with their ESPs......Supercomputing Centers (SCs) have high and variable power demands, which increase the challenges of the Electricity Service Providers (ESPs) with regards to efficient electricity distribution and reliable grid operation. High penetration of renewable energy generation further exacerbates...... this problem. In order to develop a symbiotic relationship between the SCs and their ESPs and to support effective power management at all levels, it is critical to understand and analyze how the existing relationships were formed and how these are expected to evolve. In this paper, we first present results...

Integration of PanDA workload management system with Titan supercomputer at OLCF

Science.gov (United States)

De, K.; Klimentov, A.; Oleynik, D.; Panitkin, S.; Petrosyan, A.; Schovancova, J.; Vaniachine, A.; Wenaus, T.

2015-12-01

The PanDA (Production and Distributed Analysis) workload management system (WMS) was developed to meet the scale and complexity of LHC distributed computing for the ATLAS experiment. While PanDA currently distributes jobs to more than 100,000 cores at well over 100 Grid sites, the future LHC data taking runs will require more resources than Grid computing can possibly provide. To alleviate these challenges, ATLAS is engaged in an ambitious program to expand the current computing model to include additional resources such as the opportunistic use of supercomputers. We will describe a project aimed at integration of PanDA WMS with Titan supercomputer at Oak Ridge Leadership Computing Facility (OLCF). The current approach utilizes a modified PanDA pilot framework for job submission to Titan's batch queues and local data management, with light-weight MPI wrappers to run single threaded workloads in parallel on Titan's multicore worker nodes. It also gives PanDA new capability to collect, in real time, information about unused worker nodes on Titan, which allows precise definition of the size and duration of jobs submitted to Titan according to available free resources. This capability significantly reduces PanDA job wait time while improving Titan's utilization efficiency. This implementation was tested with a variety of Monte-Carlo workloads on Titan and is being tested on several other supercomputing platforms. Notice: This manuscript has been authored, by employees of Brookhaven Science Associates, LLC under Contract No. DE-AC02-98CH10886 with the U.S. Department of Energy. The publisher by accepting the manuscript for publication acknowledges that the United States Government retains a non-exclusive, paid-up, irrevocable, world-wide license to publish or reproduce the published form of this manuscript, or allow others to do so, for United States Government purposes.

Supercomputers and the mathematical modeling of high complexity problems

International Nuclear Information System (INIS)

Belotserkovskii, Oleg M

2010-01-01

This paper is a review of many works carried out by members of our scientific school in past years. The general principles of constructing numerical algorithms for high-performance computers are described. Several techniques are highlighted and these are based on the method of splitting with respect to physical processes and are widely used in computing nonlinear multidimensional processes in fluid dynamics, in studies of turbulence and hydrodynamic instabilities and in medicine and other natural sciences. The advances and developments related to the new generation of high-performance supercomputing in Russia are presented.

Heat dissipation computations of a HVDC ground electrode using a supercomputer

International Nuclear Information System (INIS)

Greiss, H.; Mukhedkar, D.; Lagace, P.J.

1990-01-01

This paper reports on the temperature, of soil surrounding a High Voltage Direct Current (HVDC) toroidal ground electrode of practical dimensions, in both homogeneous and non-homogeneous soils that was computed at incremental points in time using finite difference methods on a supercomputer. Curves of the response were computed and plotted at several locations within the soil in the vicinity of the ground electrode for various values of the soil parameters

Argonne National Lab deploys Force10 networks' massively dense ethernet switch for supercomputing cluster

CERN Multimedia

2003-01-01

"Force10 Networks, Inc. today announced that Argonne National Laboratory (Argonne, IL) has successfully deployed Force10 E-Series switch/routers to connect to the TeraGrid, the world's largest supercomputing grid, sponsored by the National Science Foundation (NSF)" (1/2 page).

Performance Analysis and Scaling Behavior of the Terrestrial Systems Modeling Platform TerrSysMP in Large-Scale Supercomputing Environments

Science.gov (United States)

Kollet, S. J.; Goergen, K.; Gasper, F.; Shresta, P.; Sulis, M.; Rihani, J.; Simmer, C.; Vereecken, H.

2013-12-01

In studies of the terrestrial hydrologic, energy and biogeochemical cycles, integrated multi-physics simulation platforms take a central role in characterizing non-linear interactions, variances and uncertainties of system states and fluxes in reciprocity with observations. Recently developed integrated simulation platforms attempt to honor the complexity of the terrestrial system across multiple time and space scales from the deeper subsurface including groundwater dynamics into the atmosphere. Technically, this requires the coupling of atmospheric, land surface, and subsurface-surface flow models in supercomputing environments, while ensuring a high-degree of efficiency in the utilization of e.g., standard Linux clusters and massively parallel resources. A systematic performance analysis including profiling and tracing in such an application is crucial in the understanding of the runtime behavior, to identify optimum model settings, and is an efficient way to distinguish potential parallel deficiencies. On sophisticated leadership-class supercomputers, such as the 28-rack 5.9 petaFLOP IBM Blue Gene/Q 'JUQUEEN' of the Jülich Supercomputing Centre (JSC), this is a challenging task, but even more so important, when complex coupled component models are to be analysed. Here we want to present our experience from coupling, application tuning (e.g. 5-times speedup through compiler optimizations), parallel scaling and performance monitoring of the parallel Terrestrial Systems Modeling Platform TerrSysMP. The modeling platform consists of the weather prediction system COSMO of the German Weather Service; the Community Land Model, CLM of NCAR; and the variably saturated surface-subsurface flow code ParFlow. The model system relies on the Multiple Program Multiple Data (MPMD) execution model where the external Ocean-Atmosphere-Sea-Ice-Soil coupler (OASIS3) links the component models. TerrSysMP has been instrumented with the performance analysis tool Scalasca and analyzed

Performance Evaluation of Supercomputers using HPCC and IMB Benchmarks

Science.gov (United States)

Saini, Subhash; Ciotti, Robert; Gunney, Brian T. N.; Spelce, Thomas E.; Koniges, Alice; Dossa, Don; Adamidis, Panagiotis; Rabenseifner, Rolf; Tiyyagura, Sunil R.; Mueller, Matthias;

Supercomputations and big-data analysis in strong-field ultrafast optical physics: filamentation of high-peak-power ultrashort laser pulses

Science.gov (United States)

Voronin, A. A.; Panchenko, V. Ya; Zheltikov, A. M.

2016-06-01

High-intensity ultrashort laser pulses propagating in gas media or in condensed matter undergo complex nonlinear spatiotemporal evolution where temporal transformations of optical field waveforms are strongly coupled to an intricate beam dynamics and ultrafast field-induced ionization processes. At the level of laser peak powers orders of magnitude above the critical power of self-focusing, the beam exhibits modulation instabilities, producing random field hot spots and breaking up into multiple noise-seeded filaments. This problem is described by a (3  +  1)-dimensional nonlinear field evolution equation, which needs to be solved jointly with the equation for ultrafast ionization of a medium. Analysis of this problem, which is equivalent to solving a billion-dimensional evolution problem, is only possible by means of supercomputer simulations augmented with coordinated big-data processing of large volumes of information acquired through theory-guiding experiments and supercomputations. Here, we review the main challenges of supercomputations and big-data processing encountered in strong-field ultrafast optical physics and discuss strategies to confront these challenges.

Quantum Hamiltonian Physics with Supercomputers

International Nuclear Information System (INIS)

Vary, James P.

2014-01-01

The vision of solving the nuclear many-body problem in a Hamiltonian framework with fundamental interactions tied to QCD via Chiral Perturbation Theory is gaining support. The goals are to preserve the predictive power of the underlying theory, to test fundamental symmetries with the nucleus as laboratory and to develop new understandings of the full range of complex quantum phenomena. Advances in theoretical frameworks (renormalization and many-body methods) as well as in computational resources (new algorithms and leadership-class parallel computers) signal a new generation of theory and simulations that will yield profound insights into the origins of nuclear shell structure, collective phenomena and complex reaction dynamics. Fundamental discovery opportunities also exist in such areas as physics beyond the Standard Model of Elementary Particles, the transition between hadronic and quark–gluon dominated dynamics in nuclei and signals that characterize dark matter. I will review some recent achievements and present ambitious consensus plans along with their challenges for a coming decade of research that will build new links between theory, simulations and experiment. Opportunities for graduate students to embark upon careers in the fast developing field of supercomputer simulations is also discussed

Quantum Hamiltonian Physics with Supercomputers

Energy Technology Data Exchange (ETDEWEB)

Vary, James P.

2014-06-15

The vision of solving the nuclear many-body problem in a Hamiltonian framework with fundamental interactions tied to QCD via Chiral Perturbation Theory is gaining support. The goals are to preserve the predictive power of the underlying theory, to test fundamental symmetries with the nucleus as laboratory and to develop new understandings of the full range of complex quantum phenomena. Advances in theoretical frameworks (renormalization and many-body methods) as well as in computational resources (new algorithms and leadership-class parallel computers) signal a new generation of theory and simulations that will yield profound insights into the origins of nuclear shell structure, collective phenomena and complex reaction dynamics. Fundamental discovery opportunities also exist in such areas as physics beyond the Standard Model of Elementary Particles, the transition between hadronic and quark–gluon dominated dynamics in nuclei and signals that characterize dark matter. I will review some recent achievements and present ambitious consensus plans along with their challenges for a coming decade of research that will build new links between theory, simulations and experiment. Opportunities for graduate students to embark upon careers in the fast developing field of supercomputer simulations is also discussed.

Coherent 40 Gb/s SP-16QAM and 80 Gb/s PDM-16QAM in an Optimal Supercomputer Optical Switch Fabric

DEFF Research Database (Denmark)

Karinou, Fotini; Borkowski, Robert; Zibar, Darko

2013-01-01

We demonstrate, for the first time, the feasibility of using 40 Gb/s SP-16QAM and 80 Gb/s PDM-16QAM in an optimized cell switching supercomputer optical interconnect architecture based on semiconductor optical amplifiers as ON/OFF gates.......We demonstrate, for the first time, the feasibility of using 40 Gb/s SP-16QAM and 80 Gb/s PDM-16QAM in an optimized cell switching supercomputer optical interconnect architecture based on semiconductor optical amplifiers as ON/OFF gates....

Federal Market Information Technology in the Post Flash Crash Era: Roles for Supercomputing

Energy Technology Data Exchange (ETDEWEB)

Bethel, E. Wes; Leinweber, David; Ruebel, Oliver; Wu, Kesheng

2011-09-16

This paper describes collaborative work between active traders, regulators, economists, and supercomputing researchers to replicate and extend investigations of the Flash Crash and other market anomalies in a National Laboratory HPC environment. Our work suggests that supercomputing tools and methods will be valuable to market regulators in achieving the goal of market safety, stability, and security. Research results using high frequency data and analytics are described, and directions for future development are discussed. Currently the key mechanism for preventing catastrophic market action are “circuit breakers.” We believe a more graduated approach, similar to the “yellow light” approach in motorsports to slow down traffic, might be a better way to achieve the same goal. To enable this objective, we study a number of indicators that could foresee hazards in market conditions and explore options to confirm such predictions. Our tests confirm that Volume Synchronized Probability of Informed Trading (VPIN) and a version of volume Herfindahl-Hirschman Index (HHI) for measuring market fragmentation can indeed give strong signals ahead of the Flash Crash event on May 6 2010. This is a preliminary step toward a full-fledged early-warning system for unusual market conditions.

A fast random number generator for the Intel Paragon supercomputer

Science.gov (United States)

Gutbrod, F.

1995-06-01

A pseudo-random number generator is presented which makes optimal use of the architecture of the i860-microprocessor and which is expected to have a very long period. It is therefore a good candidate for use on the parallel supercomputer Paragon XP. In the assembler version, it needs 6.4 cycles for a real∗4 random number. There is a FORTRAN routine which yields identical numbers up to rare and minor rounding discrepancies, and it needs 28 cycles. The FORTRAN performance on other microprocessors is somewhat better. Arguments for the quality of the generator and some numerical tests are given.

Development of a Cloud Resolving Model for Heterogeneous Supercomputers

Science.gov (United States)

Sreepathi, S.; Norman, M. R.; Pal, A.; Hannah, W.; Ponder, C.

2017-12-01

A cloud resolving climate model is needed to reduce major systematic errors in climate simulations due to structural uncertainty in numerical treatments of convection - such as convective storm systems. This research describes the porting effort to enable SAM (System for Atmosphere Modeling) cloud resolving model on heterogeneous supercomputers using GPUs (Graphical Processing Units). We have isolated a standalone configuration of SAM that is targeted to be integrated into the DOE ACME (Accelerated Climate Modeling for Energy) Earth System model. We have identified key computational kernels from the model and offloaded them to a GPU using the OpenACC programming model. Furthermore, we are investigating various optimization strategies intended to enhance GPU utilization including loop fusion/fission, coalesced data access and loop refactoring to a higher abstraction level. We will present early performance results, lessons learned as well as optimization strategies. The computational platform used in this study is the Summitdev system, an early testbed that is one generation removed from Summit, the next leadership class supercomputer at Oak Ridge National Laboratory. The system contains 54 nodes wherein each node has 2 IBM POWER8 CPUs and 4 NVIDIA Tesla P100 GPUs. This work is part of a larger project, ACME-MMF component of the U.S. Department of Energy(DOE) Exascale Computing Project. The ACME-MMF approach addresses structural uncertainty in cloud processes by replacing traditional parameterizations with cloud resolving "superparameterization" within each grid cell of global climate model. Super-parameterization dramatically increases arithmetic intensity, making the MMF approach an ideal strategy to achieve good performance on emerging exascale computing architectures. The goal of the project is to integrate superparameterization into ACME, and explore its full potential to scientifically and computationally advance climate simulation and prediction.

Reliability Lessons Learned From GPU Experience With The Titan Supercomputer at Oak Ridge Leadership Computing Facility

Energy Technology Data Exchange (ETDEWEB)

Gallarno, George [Christian Brothers University; Rogers, James H [ORNL; Maxwell, Don E [ORNL

2015-01-01

The high computational capability of graphics processing units (GPUs) is enabling and driving the scientific discovery process at large-scale. The world s second fastest supercomputer for open science, Titan, has more than 18,000 GPUs that computational scientists use to perform scientific simu- lations and data analysis. Understanding of GPU reliability characteristics, however, is still in its nascent stage since GPUs have only recently been deployed at large-scale. This paper presents a detailed study of GPU errors and their impact on system operations and applications, describing experiences with the 18,688 GPUs on the Titan supercom- puter as well as lessons learned in the process of efficient operation of GPUs at scale. These experiences are helpful to HPC sites which already have large-scale GPU clusters or plan to deploy GPUs in the future.

369 TFlop/s molecular dynamics simulations on the Roadrunner general-purpose heterogeneous supercomputer

Energy Technology Data Exchange (ETDEWEB)

Swaminarayan, Sriram [Los Alamos National Laboratory; Germann, Timothy C [Los Alamos National Laboratory; Kadau, Kai [Los Alamos National Laboratory; Fossum, Gordon C [IBM CORPORATION

2008-01-01

The authors present timing and performance numbers for a short-range parallel molecular dynamics (MD) code, SPaSM, that has been rewritten for the heterogeneous Roadrunner supercomputer. Each Roadrunner compute node consists of two AMD Opteron dual-core microprocessors and four PowerXCell 8i enhanced Cell microprocessors, so that there are four MPI ranks per node, each with one Opteron and one Cell. The interatomic forces are computed on the Cells (each with one PPU and eight SPU cores), while the Opterons are used to direct inter-rank communication and perform I/O-heavy periodic analysis, visualization, and checkpointing tasks. The performance measured for our initial implementation of a standard Lennard-Jones pair potential benchmark reached a peak of 369 Tflop/s double-precision floating-point performance on the full Roadrunner system (27.7% of peak), corresponding to 124 MFlop/Watt/s at a price of approximately 3.69 MFlops/dollar. They demonstrate an initial target application, the jetting and ejection of material from a shocked surface.

The BlueGene/L Supercomputer and Quantum ChromoDynamics

International Nuclear Information System (INIS)

Vranas, P; Soltz, R

2006-01-01

In summary our update contains: (1) Perfect speedup sustaining 19.3% of peak for the Wilson D D-slash Dirac operator. (2) Measurements of the full Conjugate Gradient (CG) inverter that inverts the Dirac operator. The CG inverter contains two global sums over the entire machine. Nevertheless, our measurements retain perfect speedup scaling demonstrating the robustness of our methods. (3) We ran on the largest BG/L system, the LLNL 64 rack BG/L supercomputer, and obtained a sustained speed of 59.1 TFlops. Furthermore, the speedup scaling of the Dirac operator and of the CG inverter are perfect all the way up to the full size of the machine, 131,072 cores (please see Figure II). The local lattice is rather small (4 x 4 x 4 x 16) while the total lattice has been a lattice QCD vision for thermodynamic studies (a total of 128 x 128 x 256 x 32 lattice sites). This speed is about five times larger compared to the speed we quoted in our submission. As we have pointed out in our paper QCD is notoriously sensitive to network and memory latencies, has a relatively high communication to computation ratio which can not be overlapped in BGL in virtual node mode, and as an application is in a class of its own. The above results are thrilling to us and a 30 year long dream for lattice QCD

Frequently updated noise threat maps created with use of supercomputing grid

Directory of Open Access Journals (Sweden)

Szczodrak Maciej

2014-09-01

Full Text Available An innovative supercomputing grid services devoted to noise threat evaluation were presented. The services described in this paper concern two issues, first is related to the noise mapping, while the second one focuses on assessment of the noise dose and its influence on the human hearing system. The discussed serviceswere developed within the PL-Grid Plus Infrastructure which accumulates Polish academic supercomputer centers. Selected experimental results achieved by the usage of the services proposed were presented. The assessment of the environmental noise threats includes creation of the noise maps using either ofline or online data, acquired through a grid of the monitoring stations. A concept of estimation of the source model parameters based on the measured sound level for the purpose of creating frequently updated noise maps was presented. Connecting the noise mapping grid service with a distributed sensor network enables to automatically update noise maps for a specified time period. Moreover, a unique attribute of the developed software is the estimation of the auditory effects evoked by the exposure to noise. The estimation method uses a modified psychoacoustic model of hearing and is based on the calculated noise level values and on the given exposure period. Potential use scenarios of the grid services for research or educational purpose were introduced. Presentation of the results of predicted hearing threshold shift caused by exposure to excessive noise can raise the public awareness of the noise threats.

Parallel supercomputing: Advanced methods, algorithms, and software for large-scale linear and nonlinear problems

Energy Technology Data Exchange (ETDEWEB)

Carey, G.F.; Young, D.M.

1993-12-31

The program outlined here is directed to research on methods, algorithms, and software for distributed parallel supercomputers. Of particular interest are finite element methods and finite difference methods together with sparse iterative solution schemes for scientific and engineering computations of very large-scale systems. Both linear and nonlinear problems will be investigated. In the nonlinear case, applications with bifurcation to multiple solutions will be considered using continuation strategies. The parallelizable numerical methods of particular interest are a family of partitioning schemes embracing domain decomposition, element-by-element strategies, and multi-level techniques. The methods will be further developed incorporating parallel iterative solution algorithms with associated preconditioners in parallel computer software. The schemes will be implemented on distributed memory parallel architectures such as the CRAY MPP, Intel Paragon, the NCUBE3, and the Connection Machine. We will also consider other new architectures such as the Kendall-Square (KSQ) and proposed machines such as the TERA. The applications will focus on large-scale three-dimensional nonlinear flow and reservoir problems with strong convective transport contributions. These are legitimate grand challenge class computational fluid dynamics (CFD) problems of significant practical interest to DOE. The methods developed and algorithms will, however, be of wider interest.

HEP Computing Tools, Grid and Supercomputers for Genome Sequencing Studies

Science.gov (United States)

De, K.; Klimentov, A.; Maeno, T.; Mashinistov, R.; Novikov, A.; Poyda, A.; Tertychnyy, I.; Wenaus, T.

2017-10-01

PanDA - Production and Distributed Analysis Workload Management System has been developed to address ATLAS experiment at LHC data processing and analysis challenges. Recently PanDA has been extended to run HEP scientific applications on Leadership Class Facilities and supercomputers. The success of the projects to use PanDA beyond HEP and Grid has drawn attention from other compute intensive sciences such as bioinformatics. Recent advances of Next Generation Genome Sequencing (NGS) technology led to increasing streams of sequencing data that need to be processed, analysed and made available for bioinformaticians worldwide. Analysis of genomes sequencing data using popular software pipeline PALEOMIX can take a month even running it on the powerful computer resource. In this paper we will describe the adaptation the PALEOMIX pipeline to run it on a distributed computing environment powered by PanDA. To run pipeline we split input files into chunks which are run separately on different nodes as separate inputs for PALEOMIX and finally merge output file, it is very similar to what it done by ATLAS to process and to simulate data. We dramatically decreased the total walltime because of jobs (re)submission automation and brokering within PanDA. Using software tools developed initially for HEP and Grid can reduce payload execution time for Mammoths DNA samples from weeks to days.

Simulation of x-rays in refractive structure by the Monte Carlo method using the supercomputer SKIF

International Nuclear Information System (INIS)

Yaskevich, Yu.R.; Kravchenko, O.I.; Soroka, I.I.; Chembrovskij, A.G.; Kolesnik, A.S.; Serikova, N.V.; Petrov, P.V.; Kol'chevskij, N.N.

2013-01-01

Software 'Xray-SKIF' for the simulation of the X-rays in refractive structures by the Monte-Carlo method using the supercomputer SKIF BSU are developed. The program generates a large number of rays propagated from a source to the refractive structure. The ray trajectory under assumption of geometrical optics is calculated. Absorption is calculated for each ray inside of refractive structure. Dynamic arrays are used for results of calculation rays parameters, its restore the X-ray field distributions very fast at different position of detector. It was found that increasing the number of processors leads to proportional decreasing of calculation time: simulation of 10 8 X-rays using supercomputer with the number of processors from 1 to 30 run-times equal 3 hours and 6 minutes, respectively. 10 9 X-rays are calculated by software 'Xray-SKIF' which allows to reconstruct the X-ray field after refractive structure with a special resolution of 1 micron. (authors)

PFLOTRAN: Reactive Flow & Transport Code for Use on Laptops to Leadership-Class Supercomputers

Energy Technology Data Exchange (ETDEWEB)

Hammond, Glenn E.; Lichtner, Peter C.; Lu, Chuan; Mills, Richard T.

2012-04-18

PFLOTRAN, a next-generation reactive flow and transport code for modeling subsurface processes, has been designed from the ground up to run efficiently on machines ranging from leadership-class supercomputers to laptops. Based on an object-oriented design, the code is easily extensible to incorporate additional processes. It can interface seamlessly with Fortran 9X, C and C++ codes. Domain decomposition parallelism is employed, with the PETSc parallel framework used to manage parallel solvers, data structures and communication. Features of the code include a modular input file, implementation of high-performance I/O using parallel HDF5, ability to perform multiple realization simulations with multiple processors per realization in a seamless manner, and multiple modes for multiphase flow and multicomponent geochemical transport. Chemical reactions currently implemented in the code include homogeneous aqueous complexing reactions and heterogeneous mineral precipitation/dissolution, ion exchange, surface complexation and a multirate kinetic sorption model. PFLOTRAN has demonstrated petascale performance using 2{sup 17} processor cores with over 2 billion degrees of freedom. Accomplishments achieved to date include applications to the Hanford 300 Area and modeling CO{sub 2} sequestration in deep geologic formations.

Evaluating the networking characteristics of the Cray XC-40 Intel Knights Landing-based Cori supercomputer at NERSC

Energy Technology Data Exchange (ETDEWEB)

Doerfler, Douglas [Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States); Austin, Brian [Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States); Cook, Brandon [Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States); Deslippe, Jack [Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States); Kandalla, Krishna [Cray Inc, Bloomington, MN (United States); Mendygral, Peter [Cray Inc, Bloomington, MN (United States)

2017-09-12

There are many potential issues associated with deploying the Intel Xeon Phi™ (code named Knights Landing [KNL]) manycore processor in a large-scale supercomputer. One in particular is the ability to fully utilize the high-speed communications network, given that the serial performance of a Xeon Phi TM core is a fraction of a Xeon®core. In this paper, we take a look at the trade-offs associated with allocating enough cores to fully utilize the Aries high-speed network versus cores dedicated to computation, e.g., the trade-off between MPI and OpenMP. In addition, we evaluate new features of Cray MPI in support of KNL, such as internode optimizations. We also evaluate one-sided programming models such as Unified Parallel C. We quantify the impact of the above trade-offs and features using a suite of National Energy Research Scientific Computing Center applications.

Plasma turbulence calculations on supercomputers

International Nuclear Information System (INIS)

Carreras, B.A.; Charlton, L.A.; Dominguez, N.; Drake, J.B.; Garcia, L.; Leboeuf, J.N.; Lee, D.K.; Lynch, V.E.; Sidikman, K.

1991-01-01

Although the single-particle picture of magnetic confinement is helpful in understanding some basic physics of plasma confinement, it does not give a full description. Collective effects dominate plasma behavior. Any analysis of plasma confinement requires a self-consistent treatment of the particles and fields. The general picture is further complicated because the plasma, in general, is turbulent. The study of fluid turbulence is a rather complex field by itself. In addition to the difficulties of classical fluid turbulence, plasma turbulence studies face the problems caused by the induced magnetic turbulence, which couples field by itself. In addition to the difficulties of classical fluid turbulence, plasma turbulence studies face the problems caused by the induced magnetic turbulence, which couples back to the fluid. Since the fluid is not a perfect conductor, this turbulence can lead to changes in the topology of the magnetic field structure, causing the magnetic field lines to wander radially. Because the plasma fluid flows along field lines, they carry the particles with them, and this enhances the losses caused by collisions. The changes in topology are critical for the plasma confinement. The study of plasma turbulence and the concomitant transport is a challenging problem. Because of the importance of solving the plasma turbulence problem for controlled thermonuclear research, the high complexity of the problem, and the necessity of attacking the problem with supercomputers, the study of plasma turbulence in magnetic confinement devices is a Grand Challenge problem

Reactive flow simulations in complex geometries with high-performance supercomputing

International Nuclear Information System (INIS)

Rehm, W.; Gerndt, M.; Jahn, W.; Vogelsang, R.; Binninger, B.; Herrmann, M.; Olivier, H.; Weber, M.

2000-01-01

In this paper, we report on a modern field code cluster consisting of state-of-the-art reactive Navier-Stokes- and reactive Euler solvers that has been developed on vector- and parallel supercomputers at the research center Juelich. This field code cluster is used for hydrogen safety analyses of technical systems, for example, in the field of nuclear reactor safety and conventional hydrogen demonstration plants with fuel cells. Emphasis is put on the assessment of combustion loads, which could result from slow, fast or rapid flames, including transition from deflagration to detonation. As a sample of proof tests, the special tools have been tested for specific tasks, based on the comparison of experimental and numerical results, which are in reasonable agreement. (author)

Parallel Multivariate Spatio-Temporal Clustering of Large Ecological Datasets on Hybrid Supercomputers

Energy Technology Data Exchange (ETDEWEB)

Sreepathi, Sarat [ORNL; Kumar, Jitendra [ORNL; Mills, Richard T. [Argonne National Laboratory; Hoffman, Forrest M. [ORNL; Sripathi, Vamsi [Intel Corporation; Hargrove, William Walter [United States Department of Agriculture (USDA), United States Forest Service (USFS)

2017-09-01

A proliferation of data from vast networks of remote sensing platforms (satellites, unmanned aircraft systems (UAS), airborne etc.), observational facilities (meteorological, eddy covariance etc.), state-of-the-art sensors, and simulation models offer unprecedented opportunities for scientific discovery. Unsupervised classification is a widely applied data mining approach to derive insights from such data. However, classification of very large data sets is a complex computational problem that requires efficient numerical algorithms and implementations on high performance computing (HPC) platforms. Additionally, increasing power, space, cooling and efficiency requirements has led to the deployment of hybrid supercomputing platforms with complex architectures and memory hierarchies like the Titan system at Oak Ridge National Laboratory. The advent of such accelerated computing architectures offers new challenges and opportunities for big data analytics in general and specifically, large scale cluster analysis in our case. Although there is an existing body of work on parallel cluster analysis, those approaches do not fully meet the needs imposed by the nature and size of our large data sets. Moreover, they had scaling limitations and were mostly limited to traditional distributed memory computing platforms. We present a parallel Multivariate Spatio-Temporal Clustering (MSTC) technique based on k-means cluster analysis that can target hybrid supercomputers like Titan. We developed a hybrid MPI, CUDA and OpenACC implementation that can utilize both CPU and GPU resources on computational nodes. We describe performance results on Titan that demonstrate the scalability and efficacy of our approach in processing large ecological data sets.

Harnessing Petaflop-Scale Multi-Core Supercomputing for Problems in Space Science

Science.gov (United States)

Albright, B. J.; Yin, L.; Bowers, K. J.; Daughton, W.; Bergen, B.; Kwan, T. J.

2008-12-01

The particle-in-cell kinetic plasma code VPIC has been migrated successfully to the world's fastest supercomputer, Roadrunner, a hybrid multi-core platform built by IBM for the Los Alamos National Laboratory. How this was achieved will be described and examples of state-of-the-art calculations in space science, in particular, the study of magnetic reconnection, will be presented. With VPIC on Roadrunner, we have performed, for the first time, plasma PIC calculations with over one trillion particles, >100× larger than calculations considered "heroic" by community standards. This allows examination of physics at unprecedented scale and fidelity. Roadrunner is an example of an emerging paradigm in supercomputing: the trend toward multi-core systems with deep hierarchies and where memory bandwidth optimization is vital to achieving high performance. Getting VPIC to perform well on such systems is a formidable challenge: the core algorithm is memory bandwidth limited with low compute-to-data ratio and requires random access to memory in its inner loop. That we were able to get VPIC to perform and scale well, achieving >0.374 Pflop/s and linear weak scaling on real physics problems on up to the full 12240-core Roadrunner machine, bodes well for harnessing these machines for our community's needs in the future. Many of the design considerations encountered commute to other multi-core and accelerated (e.g., via GPU) platforms and we modified VPIC with flexibility in mind. These will be summarized and strategies for how one might adapt a code for such platforms will be shared. Work performed under the auspices of the U.S. DOE by the LANS LLC Los Alamos National Laboratory. Dr. Bowers is a LANL Guest Scientist; he is presently at D. E. Shaw Research LLC, 120 W 45th Street, 39th Floor, New York, NY 10036.

Integration of Titan supercomputer at OLCF with ATLAS Production System

Science.gov (United States)

Barreiro Megino, F.; De, K.; Jha, S.; Klimentov, A.; Maeno, T.; Nilsson, P.; Oleynik, D.; Padolski, S.; Panitkin, S.; Wells, J.; Wenaus, T.; ATLAS Collaboration

2017-10-01

The PanDA (Production and Distributed Analysis) workload management system was developed to meet the scale and complexity of distributed computing for the ATLAS experiment. PanDA managed resources are distributed worldwide, on hundreds of computing sites, with thousands of physicists accessing hundreds of Petabytes of data and the rate of data processing already exceeds Exabyte per year. While PanDA currently uses more than 200,000 cores at well over 100 Grid sites, future LHC data taking runs will require more resources than Grid computing can possibly provide. Additional computing and storage resources are required. Therefore ATLAS is engaged in an ambitious program to expand the current computing model to include additional resources such as the opportunistic use of supercomputers. In this paper we will describe a project aimed at integration of ATLAS Production System with Titan supercomputer at Oak Ridge Leadership Computing Facility (OLCF). Current approach utilizes modified PanDA Pilot framework for job submission to Titan’s batch queues and local data management, with lightweight MPI wrappers to run single node workloads in parallel on Titan’s multi-core worker nodes. It provides for running of standard ATLAS production jobs on unused resources (backfill) on Titan. The system already allowed ATLAS to collect on Titan millions of core-hours per month, execute hundreds of thousands jobs, while simultaneously improving Titans utilization efficiency. We will discuss the details of the implementation, current experience with running the system, as well as future plans aimed at improvements in scalability and efficiency. Notice: This manuscript has been authored, by employees of Brookhaven Science Associates, LLC under Contract No. DE-AC02-98CH10886 with the U.S. Department of Energy. The publisher by accepting the manuscript for publication acknowledges that the United States Government retains a non-exclusive, paid-up, irrevocable, world-wide license to

Use of QUADRICS supercomputer as embedded simulator in emergency management systems

International Nuclear Information System (INIS)

Bove, R.; Di Costanzo, G.; Ziparo, A.

1996-07-01

The experience related to the implementation of a MRBT, atmospheric spreading model with a short duration releasing, are reported. This model was implemented on a QUADRICS-Q1 supercomputer. First is reported a description of the MRBT model. It is an analytical model to study the speadings of light gases realised in the atmosphere cause incidental releasing. The solution of diffusion equation is Gaussian like. It yield the concentration of pollutant substance released. The concentration is function of space and time. Thus the QUADRICS architecture is introduced. And the implementation of the model is described. At the end it will be consider the integration of the QUADRICS-based model as simulator in a emergency management system

MILC Code Performance on High End CPU and GPU Supercomputer Clusters

Science.gov (United States)

DeTar, Carleton; Gottlieb, Steven; Li, Ruizi; Toussaint, Doug

2018-03-01

With recent developments in parallel supercomputing architecture, many core, multi-core, and GPU processors are now commonplace, resulting in more levels of parallelism, memory hierarchy, and programming complexity. It has been necessary to adapt the MILC code to these new processors starting with NVIDIA GPUs, and more recently, the Intel Xeon Phi processors. We report on our efforts to port and optimize our code for the Intel Knights Landing architecture. We consider performance of the MILC code with MPI and OpenMP, and optimizations with QOPQDP and QPhiX. For the latter approach, we concentrate on the staggered conjugate gradient and gauge force. We also consider performance on recent NVIDIA GPUs using the QUDA library.

MILC Code Performance on High End CPU and GPU Supercomputer Clusters

Directory of Open Access Journals (Sweden)

DeTar Carleton

2018-01-01

Full Text Available With recent developments in parallel supercomputing architecture, many core, multi-core, and GPU processors are now commonplace, resulting in more levels of parallelism, memory hierarchy, and programming complexity. It has been necessary to adapt the MILC code to these new processors starting with NVIDIA GPUs, and more recently, the Intel Xeon Phi processors. We report on our efforts to port and optimize our code for the Intel Knights Landing architecture. We consider performance of the MILC code with MPI and OpenMP, and optimizations with QOPQDP and QPhiX. For the latter approach, we concentrate on the staggered conjugate gradient and gauge force. We also consider performance on recent NVIDIA GPUs using the QUDA library.

Argonne Leadership Computing Facility 2011 annual report : Shaping future supercomputing.

Energy Technology Data Exchange (ETDEWEB)

Papka, M.; Messina, P.; Coffey, R.; Drugan, C. (LCF)

2012-08-16

The ALCF's Early Science Program aims to prepare key applications for the architecture and scale of Mira and to solidify libraries and infrastructure that will pave the way for other future production applications. Two billion core-hours have been allocated to 16 Early Science projects on Mira. The projects, in addition to promising delivery of exciting new science, are all based on state-of-the-art, petascale, parallel applications. The project teams, in collaboration with ALCF staff and IBM, have undertaken intensive efforts to adapt their software to take advantage of Mira's Blue Gene/Q architecture, which, in a number of ways, is a precursor to future high-performance-computing architecture. The Argonne Leadership Computing Facility (ALCF) enables transformative science that solves some of the most difficult challenges in biology, chemistry, energy, climate, materials, physics, and other scientific realms. Users partnering with ALCF staff have reached research milestones previously unattainable, due to the ALCF's world-class supercomputing resources and expertise in computation science. In 2011, the ALCF's commitment to providing outstanding science and leadership-class resources was honored with several prestigious awards. Research on multiscale brain blood flow simulations was named a Gordon Bell Prize finalist. Intrepid, the ALCF's BG/P system, ranked No. 1 on the Graph 500 list for the second consecutive year. The next-generation BG/Q prototype again topped the Green500 list. Skilled experts at the ALCF enable researchers to conduct breakthrough science on the Blue Gene system in key ways. The Catalyst Team matches project PIs with experienced computational scientists to maximize and accelerate research in their specific scientific domains. The Performance Engineering Team facilitates the effective use of applications on the Blue Gene system by assessing and improving the algorithms used by applications and the techniques used to

DCA++: A case for science driven application development for leadership computing platforms

International Nuclear Information System (INIS)

Summers, Michael S; Alvarez, Gonzalo; Meredith, Jeremy; Maier, Thomas A; Schulthess, Thomas C

2009-01-01

The DCA++ code was one of the early science applications that ran on jaguar at the National Center for Computational Sciences, and the first application code to sustain a petaflop/s under production conditions on a general-purpose supercomputer. The code implements a quantum cluster method with a Quantum Monte Carlo kernel to solve the 2D Hubbard model for high-temperature superconductivity. It is implemented in C++, making heavy use of the generic programming model. In this paper, we discuss how this code was developed, reaching scalability and high efficiency on the world's fastest supercomputer in only a few years. We show how the use of generic concepts combined with systematic refactoring of codes is a better strategy for computational sciences than a comprehensive upfront design.

Symbolic simulation of engineering systems on a supercomputer

International Nuclear Information System (INIS)

Ragheb, M.; Gvillo, D.; Makowitz, H.

1986-01-01

Model-Based Production-Rule systems for analysis are developed for the symbolic simulation of Complex Engineering systems on a CRAY X-MP Supercomputer. The Fault-Tree and Event-Tree Analysis methodologies from Systems-Analysis are used for problem representation and are coupled to the Rule-Based System Paradigm from Knowledge Engineering to provide modelling of engineering devices. Modelling is based on knowledge of the structure and function of the device rather than on human expertise alone. To implement the methodology, we developed a production-Rule Analysis System that uses both backward-chaining and forward-chaining: HAL-1986. The inference engine uses an Induction-Deduction-Oriented antecedent-consequent logic and is programmed in Portable Standard Lisp (PSL). The inference engine is general and can accommodate general modifications and additions to the knowledge base. The methodologies used will be demonstrated using a model for the identification of faults, and subsequent recovery from abnormal situations in Nuclear Reactor Safety Analysis. The use of the exposed methodologies for the prognostication of future device responses under operational and accident conditions using coupled symbolic and procedural programming is discussed

Micro-mechanical Simulations of Soils using Massively Parallel Supercomputers

Directory of Open Access Journals (Sweden)

David W. Washington

2004-06-01

Full Text Available In this research a computer program, Trubal version 1.51, based on the Discrete Element Method was converted to run on a Connection Machine (CM-5,a massively parallel supercomputer with 512 nodes, to expedite the computational times of simulating Geotechnical boundary value problems. The dynamic memory algorithm in Trubal program did not perform efficiently in CM-2 machine with the Single Instruction Multiple Data (SIMD architecture. This was due to the communication overhead involving global array reductions, global array broadcast and random data movement. Therefore, a dynamic memory algorithm in Trubal program was converted to a static memory arrangement and Trubal program was successfully converted to run on CM-5 machines. The converted program was called "TRUBAL for Parallel Machines (TPM." Simulating two physical triaxial experiments and comparing simulation results with Trubal simulations validated the TPM program. With a 512 nodes CM-5 machine TPM produced a nine-fold speedup demonstrating the inherent parallelism within algorithms based on the Discrete Element Method.

Large scale simulations of lattice QCD thermodynamics on Columbia Parallel Supercomputers

International Nuclear Information System (INIS)

Ohta, Shigemi

1989-01-01

The Columbia Parallel Supercomputer project aims at the construction of a parallel processing, multi-gigaflop computer optimized for numerical simulations of lattice QCD. The project has three stages; 16-node, 1/4GF machine completed in April 1985, 64-node, 1GF machine completed in August 1987, and 256-node, 16GF machine now under construction. The machines all share a common architecture; a two dimensional torus formed from a rectangular array of N 1 x N 2 independent and identical processors. A processor is capable of operating in a multi-instruction multi-data mode, except for periods of synchronous interprocessor communication with its four nearest neighbors. Here the thermodynamics simulations on the two working machines are reported. (orig./HSI)

Visualization at supercomputing centers: the tale of little big iron and the three skinny guys.

Science.gov (United States)

Bethel, E W; van Rosendale, J; Southard, D; Gaither, K; Childs, H; Brugger, E; Ahern, S

2011-01-01

Supercomputing centers are unique resources that aim to enable scientific knowledge discovery by employing large computational resources-the "Big Iron." Design, acquisition, installation, and management of the Big Iron are carefully planned and monitored. Because these Big Iron systems produce a tsunami of data, it's natural to colocate the visualization and analysis infrastructure. This infrastructure consists of hardware (Little Iron) and staff (Skinny Guys). Our collective experience suggests that design, acquisition, installation, and management of the Little Iron and Skinny Guys doesn't receive the same level of treatment as that of the Big Iron. This article explores the following questions about the Little Iron: How should we size the Little Iron to adequately support visualization and analysis of data coming off the Big Iron? What sort of capabilities must it have? Related questions concern the size of visualization support staff: How big should a visualization program be-that is, how many Skinny Guys should it have? What should the staff do? How much of the visualization should be provided as a support service, and how much should applications scientists be expected to do on their own?

DCA++: A case for science driven application development for leadership computing platforms

Energy Technology Data Exchange (ETDEWEB)

Summers, Michael S; Alvarez, Gonzalo; Meredith, Jeremy; Maier, Thomas A [Computer Science and Mathematics Division, Oak Ridge National Laboratory, P. O. Box 2008, Mail Stop 6164, Oak Ridge, TN 37831 (United States); Schulthess, Thomas C, E-mail: schulthess@cscs.c [Swiss National Supercomputer Center and Institute for Theoretical Physics, ETH Zurich, CSCS MAN E 133, Galeria 2, CH-9628 Manno (Switzerland)

2009-07-01

The DCA++ code was one of the early science applications that ran on jaguar at the National Center for Computational Sciences, and the first application code to sustain a petaflop/s under production conditions on a general-purpose supercomputer. The code implements a quantum cluster method with a Quantum Monte Carlo kernel to solve the 2D Hubbard model for high-temperature superconductivity. It is implemented in C++, making heavy use of the generic programming model. In this paper, we discuss how this code was developed, reaching scalability and high efficiency on the world's fastest supercomputer in only a few years. We show how the use of generic concepts combined with systematic refactoring of codes is a better strategy for computational sciences than a comprehensive upfront design.

Easy Access to HPC Resources through the Application GUI

KAUST Repository

van Waveren, Matthijs; Seif, Ahmed; Hassanein, Nasr; Moon, David; O'Byrnes, Niall; Clo, Alain M.; Murugan, Karthikeyan; Arena, Antonio

2016-01-01

and supercomputer that automates the transfer of input data and job submission and also the retrieval of results to the researcher’s local workstation. The innovation is that the user now submits his jobs from within the application GUI on his workstation, and does

De Novo Ultrascale Atomistic Simulations On High-End Parallel Supercomputers

Energy Technology Data Exchange (ETDEWEB)

Nakano, A; Kalia, R K; Nomura, K; Sharma, A; Vashishta, P; Shimojo, F; van Duin, A; Goddard, III, W A; Biswas, R; Srivastava, D; Yang, L H

2006-09-04

We present a de novo hierarchical simulation framework for first-principles based predictive simulations of materials and their validation on high-end parallel supercomputers and geographically distributed clusters. In this framework, high-end chemically reactive and non-reactive molecular dynamics (MD) simulations explore a wide solution space to discover microscopic mechanisms that govern macroscopic material properties, into which highly accurate quantum mechanical (QM) simulations are embedded to validate the discovered mechanisms and quantify the uncertainty of the solution. The framework includes an embedded divide-and-conquer (EDC) algorithmic framework for the design of linear-scaling simulation algorithms with minimal bandwidth complexity and tight error control. The EDC framework also enables adaptive hierarchical simulation with automated model transitioning assisted by graph-based event tracking. A tunable hierarchical cellular decomposition parallelization framework then maps the O(N) EDC algorithms onto Petaflops computers, while achieving performance tunability through a hierarchy of parameterized cell data/computation structures, as well as its implementation using hybrid Grid remote procedure call + message passing + threads programming. High-end computing platforms such as IBM BlueGene/L, SGI Altix 3000 and the NSF TeraGrid provide an excellent test grounds for the framework. On these platforms, we have achieved unprecedented scales of quantum-mechanically accurate and well validated, chemically reactive atomistic simulations--1.06 billion-atom fast reactive force-field MD and 11.8 million-atom (1.04 trillion grid points) quantum-mechanical MD in the framework of the EDC density functional theory on adaptive multigrids--in addition to 134 billion-atom non-reactive space-time multiresolution MD, with the parallel efficiency as high as 0.998 on 65,536 dual-processor BlueGene/L nodes. We have also achieved an automated execution of hierarchical QM

An Optimized Parallel FDTD Topology for Challenging Electromagnetic Simulations on Supercomputers

Directory of Open Access Journals (Sweden)

Shugang Jiang

2015-01-01

Full Text Available It may not be a challenge to run a Finite-Difference Time-Domain (FDTD code for electromagnetic simulations on a supercomputer with more than 10 thousands of CPU cores; however, to make FDTD code work with the highest efficiency is a challenge. In this paper, the performance of parallel FDTD is optimized through MPI (message passing interface virtual topology, based on which a communication model is established. The general rules of optimal topology are presented according to the model. The performance of the method is tested and analyzed on three high performance computing platforms with different architectures in China. Simulations including an airplane with a 700-wavelength wingspan, and a complex microstrip antenna array with nearly 2000 elements are performed very efficiently using a maximum of 10240 CPU cores.

Introductory Talk: Whole Frog Project

Science.gov (United States)

from mathematical descriptions, is an important aspect of visualization. . Demonstrate the power of computing applications. The back-end computation can take place on as complex and powerful a distributed . ------------------ HTTP Server General Statistics Server: http://george.lbl.gov/ (NCSA Common) Local date: Fri Feb 03 19

Development of a high performance eigensolver on the peta-scale next generation supercomputer system

International Nuclear Information System (INIS)

Imamura, Toshiyuki; Yamada, Susumu; Machida, Masahiko

2010-01-01

For the present supercomputer systems, a multicore and multisocket processors are necessary to build a system, and choice of interconnection is essential. In addition, for effective development of a new code, high performance, scalable, and reliable numerical software is one of the key items. ScaLAPACK and PETSc are well-known software on distributed memory parallel computer systems. It is needless to say that highly tuned software towards new architecture like many-core processors must be chosen for real computation. In this study, we present a high-performance and high-scalable eigenvalue solver towards the next-generation supercomputer system, so called 'K-computer' system. We have developed two versions, the standard version (eigen s) and enhanced performance version (eigen sx), which are developed on the T2K cluster system housed at University of Tokyo. Eigen s employs the conventional algorithms; Householder tridiagonalization, divide and conquer (DC) algorithm, and Householder back-transformation. They are carefully implemented with blocking technique and flexible two-dimensional data-distribution to reduce the overhead of memory traffic and data transfer, respectively. Eigen s performs excellently on the T2K system with 4096 cores (theoretical peak is 37.6 TFLOPS), and it shows fine performance 3.0 TFLOPS with a two hundred thousand dimensional matrix. The enhanced version, eigen sx, uses more advanced algorithms; the narrow-band reduction algorithm, DC for band matrices, and the block Householder back-transformation with WY-representation. Even though this version is still on a test stage, it shows 4.7 TFLOPS with the same dimensional matrix on eigen s. (author)

Combining density functional theory calculations, supercomputing, and data-driven methods to design new materials (Conference Presentation)

Science.gov (United States)

Jain, Anubhav

2017-04-01

Density functional theory (DFT) simulations solve for the electronic structure of materials starting from the Schrödinger equation. Many case studies have now demonstrated that researchers can often use DFT to design new compounds in the computer (e.g., for batteries, catalysts, and hydrogen storage) before synthesis and characterization in the lab. In this talk, I will focus on how DFT calculations can be executed on large supercomputing resources in order to generate very large data sets on new materials for functional applications. First, I will briefly describe the Materials Project, an effort at LBNL that has virtually characterized over 60,000 materials using DFT and has shared the results with over 17,000 registered users. Next, I will talk about how such data can help discover new materials, describing how preliminary computational screening led to the identification and confirmation of a new family of bulk AMX2 thermoelectric compounds with measured zT reaching 0.8. I will outline future plans for how such data-driven methods can be used to better understand the factors that control thermoelectric behavior, e.g., for the rational design of electronic band structures, in ways that are different from conventional approaches.

A Parallel Supercomputer Implementation of a Biological Inspired Neural Network and its use for Pattern Recognition

International Nuclear Information System (INIS)

De Ladurantaye, Vincent; Lavoie, Jean; Bergeron, Jocelyn; Parenteau, Maxime; Lu Huizhong; Pichevar, Ramin; Rouat, Jean

2012-01-01

A parallel implementation of a large spiking neural network is proposed and evaluated. The neural network implements the binding by synchrony process using the Oscillatory Dynamic Link Matcher (ODLM). Scalability, speed and performance are compared for 2 implementations: Message Passing Interface (MPI) and Compute Unified Device Architecture (CUDA) running on clusters of multicore supercomputers and NVIDIA graphical processing units respectively. A global spiking list that represents at each instant the state of the neural network is described. This list indexes each neuron that fires during the current simulation time so that the influence of their spikes are simultaneously processed on all computing units. Our implementation shows a good scalability for very large networks. A complex and large spiking neural network has been implemented in parallel with success, thus paving the road towards real-life applications based on networks of spiking neurons. MPI offers a better scalability than CUDA, while the CUDA implementation on a GeForce GTX 285 gives the best cost to performance ratio. When running the neural network on the GTX 285, the processing speed is comparable to the MPI implementation on RQCHP's Mammouth parallel with 64 notes (128 cores).

Watson will see you now: a supercomputer to help clinicians make informed treatment decisions.

Science.gov (United States)

Doyle-Lindrud, Susan

2015-02-01

IBM has collaborated with several cancer care providers to develop and train the IBM supercomputer Watson to help clinicians make informed treatment decisions. When a patient is seen in clinic, the oncologist can input all of the clinical information into the computer system. Watson will then review all of the data and recommend treatment options based on the latest evidence and guidelines. Once the oncologist makes the treatment decision, this information can be sent directly to the insurance company for approval. Watson has the ability to standardize care and accelerate the approval process, a benefit to the healthcare provider and the patient.

Affordable and accurate large-scale hybrid-functional calculations on GPU-accelerated supercomputers

Science.gov (United States)

Ratcliff, Laura E.; Degomme, A.; Flores-Livas, José A.; Goedecker, Stefan; Genovese, Luigi

2018-03-01

Performing high accuracy hybrid functional calculations for condensed matter systems containing a large number of atoms is at present computationally very demanding or even out of reach if high quality basis sets are used. We present a highly optimized multiple graphics processing unit implementation of the exact exchange operator which allows one to perform fast hybrid functional density-functional theory (DFT) calculations with systematic basis sets without additional approximations for up to a thousand atoms. With this method hybrid DFT calculations of high quality become accessible on state-of-the-art supercomputers within a time-to-solution that is of the same order of magnitude as traditional semilocal-GGA functionals. The method is implemented in a portable open-source library.

Adventures in supercomputing: An innovative program for high school teachers

Energy Technology Data Exchange (ETDEWEB)

Oliver, C.E.; Hicks, H.R.; Summers, B.G. [Oak Ridge National Lab., TN (United States); Staten, D.G. [Wartburg Central High School, TN (United States)

1994-12-31

Within the realm of education, seldom does an innovative program become available with the potential to change an educator`s teaching methodology. Adventures in Supercomputing (AiS), sponsored by the U.S. Department of Energy (DOE), is such a program. It is a program for high school teachers that changes the teacher paradigm from a teacher-directed approach of teaching to a student-centered approach. {open_quotes}A student-centered classroom offers better opportunities for development of internal motivation, planning skills, goal setting and perseverance than does the traditional teacher-directed mode{close_quotes}. Not only is the process of teaching changed, but the cross-curricula integration within the AiS materials is remarkable. Written from a teacher`s perspective, this paper will describe the AiS program and its effects on teachers and students, primarily at Wartburg Central High School, in Wartburg, Tennessee. The AiS program in Tennessee is sponsored by Oak Ridge National Laboratory (ORNL).

Earth and environmental science in the 1980's: Part 1: Environmental data systems, supercomputer facilities and networks

Science.gov (United States)

1986-01-01

Overview descriptions of on-line environmental data systems, supercomputer facilities, and networks are presented. Each description addresses the concepts of content, capability, and user access relevant to the point of view of potential utilization by the Earth and environmental science community. The information on similar systems or facilities is presented in parallel fashion to encourage and facilitate intercomparison. In addition, summary sheets are given for each description, and a summary table precedes each section.

Detecting Silent Data Corruption for Extreme-Scale Applications through Data Mining

Energy Technology Data Exchange (ETDEWEB)

Bautista-Gomez, Leonardo [Argonne National Lab. (ANL), Argonne, IL (United States); Cappello, Franck [Argonne National Lab. (ANL), Argonne, IL (United States)

2014-01-16

Supercomputers allow scientists to study natural phenomena by means of computer simulations. Next-generation machines are expected to have more components and, at the same time, consume several times less energy per operation. These trends are pushing supercomputer construction to the limits of miniaturization and energy-saving strategies. Consequently, the number of soft errors is expected to increase dramatically in the coming years. While mechanisms are in place to correct or at least detect some soft errors, a significant percentage of those errors pass unnoticed by the hardware. Such silent errors are extremely damaging because they can make applications silently produce wrong results. In this work we propose a technique that leverages certain properties of high-performance computing applications in order to detect silent errors at the application level. Our technique detects corruption solely based on the behavior of the application datasets and is completely application-agnostic. We propose multiple corruption detectors, and we couple them to work together in a fashion transparent to the user. We demonstrate that this strategy can detect the majority of the corruptions, while incurring negligible overhead. We show that with the help of these detectors, applications can have up to 80% of coverage against data corruption.

Research center Juelich to install Germany's most powerful supercomputer new IBM System for science and research will achieve 5.8 trillion computations per second

CERN Multimedia

2002-01-01

"The Research Center Juelich, Germany, and IBM today announced that they have signed a contract for the delivery and installation of a new IBM supercomputer at the Central Institute for Applied Mathematics" (1/2 page).

Virtual Sensors in a Web 2.0 Digital Watershed

Science.gov (United States)

Liu, Y.; Hill, D. J.; Marini, L.; Kooper, R.; Rodriguez, A.; Myers, J. D.

2008-12-01

The lack of rainfall data in many watersheds is one of the major barriers for modeling and studying many environmental and hydrological processes and supporting decision making. There are just not enough rain gages on the ground. To overcome this data scarcity issue, a Web 2.0 digital watershed is developed at NCSA(National Center for Supercomputing Applications), where users can point-and-click on a web-based google map interface and create new precipitation virtual sensors at any location within the same coverage region as a NEXRAD station. A set of scientific workflows are implemented to perform spatial, temporal and thematic transformations to the near-real-time NEXRAD Level II data. Such workflows can be triggered by the users' actions and generate either rainfall rate or rainfall accumulation streaming data at a user-specified time interval. We will discuss some underlying components of this digital watershed, which consists of a semantic content management middleware, a semantically enhanced streaming data toolkit, virtual sensor management functionality, and RESTful (REpresentational State Transfer) web service that can trigger the workflow execution. Such loosely coupled architecture presents a generic framework for constructing a Web 2.0 style digital watershed. An implementation of this architecture at the Upper Illinois Rive Basin will be presented. We will also discuss the implications of the virtual sensor concept for the broad environmental observatory community and how such concept will help us move towards a participatory digital watershed.

Programmable lithography engine (ProLE) grid-type supercomputer and its applications

Science.gov (United States)

Petersen, John S.; Maslow, Mark J.; Gerold, David J.; Greenway, Robert T.

2003-06-01

There are many variables that can affect lithographic dependent device yield. Because of this, it is not enough to make optical proximity corrections (OPC) based on the mask type, wavelength, lens, illumination-type and coherence. Resist chemistry and physics along with substrate, exposure, and all post-exposure processing must be considered too. Only a holistic approach to finding imaging solutions will accelerate yield and maximize performance. Since experiments are too costly in both time and money, accomplishing this takes massive amounts of accurate simulation capability. Our solution is to create a workbench that has a set of advanced user applications that utilize best-in-class simulator engines for solving litho-related DFM problems using distributive computing. Our product, ProLE (Programmable Lithography Engine), is an integrated system that combines Petersen Advanced Lithography Inc."s (PAL"s) proprietary applications and cluster management software wrapped around commercial software engines, along with optional commercial hardware and software. It uses the most rigorous lithography simulation engines to solve deep sub-wavelength imaging problems accurately and at speeds that are several orders of magnitude faster than current methods. Specifically, ProLE uses full vector thin-mask aerial image models or when needed, full across source 3D electromagnetic field simulation to make accurate aerial image predictions along with calibrated resist models;. The ProLE workstation from Petersen Advanced Lithography, Inc., is the first commercial product that makes it possible to do these intensive calculations at a fraction of a time previously available thus significantly reducing time to market for advance technology devices. In this work, ProLE is introduced, through model comparison to show why vector imaging and rigorous resist models work better than other less rigorous models, then some applications of that use our distributive computing solution are shown

DOE's Institute for Advanced Architecture and Algorithms: An application-driven approach

International Nuclear Information System (INIS)

Murphy, Richard C

2009-01-01

This paper describes an application driven methodology for understanding the impact of future architecture decisions on the end of the MPP era. Fundamental transistor device limitations combined with application performance characteristics have created the switch to multicore/multithreaded architectures. Designing large-scale supercomputers to match application demands is particularly challenging since performance characteristics are highly counter-intuitive. In fact, data movement more than FLOPS dominates. This work discusses some basic performance analysis for a set of DOE applications, the limits of CMOS technology, and the impact of both on future architectures.

Car2x with software defined networks, network functions virtualization and supercomputers technical and scientific preparations for the Amsterdam Arena telecoms fieldlab

NARCIS (Netherlands)

Meijer R.J.; Cushing R.; De Laat C.; Jackson P.; Klous S.; Koning R.; Makkes M.X.; Meerwijk A.

2015-01-01

In the invited talk 'Car2x with SDN, NFV and supercomputers' we report about how our past work with SDN [1, 2] allows the design of a smart mobility fieldlab in the huge parking lot the Amsterdam Arena. We explain how we can engineer and test software that handle the complex conditions of the Car2X

EDF's experience with supercomputing and challenges ahead - towards multi-physics and multi-scale approaches

International Nuclear Information System (INIS)

Delbecq, J.M.; Banner, D.

2003-01-01

Nuclear power plants are a major asset of the EDF company. To remain so, in particular in a context of deregulation, competitiveness, safety and public acceptance are three conditions. These stakes apply both to existing plants and to future reactors. The purpose of the presentation is to explain how supercomputing can help EDF to satisfy these requirements. Three examples are described in detail: ensuring optimal use of nuclear fuel under wholly safe conditions, understanding and simulating the material deterioration mechanisms and moving forward with numerical simulation for the performance of EDF's activities. In conclusion, a broader vision of EDF long term R and D in the field of numerical simulation is given and especially of five challenges taken up by EDF together with its industrial and scientific partners. (author)

SOFTWARE FOR SUPERCOMPUTER SKIF “ProLit-lC” and “ProNRS-lC” FOR FOUNDRY AND METALLURGICAL PRODUCTIONS

Directory of Open Access Journals (Sweden)

A. N. Chichko

2008-01-01

Full Text Available The data of modeling on supercomputer system SKIF of technological process of  molds filling by means of computer system 'ProLIT-lc', and also data of modeling of the steel pouring process by means ofTroNRS-lc'are presented. The influence of number of  processors of  multinuclear computer system SKIF on acceleration and time of  modeling of technological processes, connected with production of castings and slugs, is shown.

Assessment techniques for a learning-centered curriculum: evaluation design for adventures in supercomputing

Energy Technology Data Exchange (ETDEWEB)

Helland, B. [Ames Lab., IA (United States); Summers, B.G. [Oak Ridge National Lab., TN (United States)

1996-09-01

As the classroom paradigm shifts from being teacher-centered to being learner-centered, student assessments are evolving from typical paper and pencil testing to other methods of evaluation. Students should be probed for understanding, reasoning, and critical thinking abilities rather than their ability to return memorized facts. The assessment of the Department of Energy`s pilot program, Adventures in Supercomputing (AiS), offers one example of assessment techniques developed for learner-centered curricula. This assessment has employed a variety of methods to collect student data. Methods of assessment used were traditional testing, performance testing, interviews, short questionnaires via email, and student presentations of projects. The data obtained from these sources have been analyzed by a professional assessment team at the Center for Children and Technology. The results have been used to improve the AiS curriculum and establish the quality of the overall AiS program. This paper will discuss the various methods of assessment used and the results.

Modeling radiative transport in ICF plasmas on an IBM SP2 supercomputer

International Nuclear Information System (INIS)

Johansen, J.A.; MacFarlane, J.J.; Moses, G.A.

1995-01-01

At the University of Wisconsin-Madison the authors have integrated a collisional-radiative-equilibrium model into their CONRAD radiation-hydrodynamics code. This integrated package allows them to accurately simulate the transport processes involved in ICF plasmas; including the important effects of self-absorption of line-radiation. However, as they increase the amount of atomic structure utilized in their transport models, the computational demands increase nonlinearly. In an attempt to meet this increased computational demand, they have recently embarked on a mission to parallelize the CONRAD program. The parallel CONRAD development is being performed on an IBM SP2 supercomputer. The parallelism is based on a message passing paradigm, and is being implemented using PVM. At the present time they have determined that approximately 70% of the sequential program can be executed in parallel. Accordingly, they expect that the parallel version will yield a speedup on the order of three times that of the sequential version. This translates into only 10 hours of execution time for the parallel version, whereas the sequential version required 30 hours

A List of Astronomical Meetings Available via Mosaic

Science.gov (United States)

Bryson, E.; Crabtree, D.

We have been making a list of astronomical and related meetings available electronically for a number of years. Recently, several meeting organizers have made information about their meetings available via anonymous ftp or even NCSA Mosaic. We have produced a new version of our electronic meeting list available via NCSA Mosaic which provides links to the information being provided electronically. Depending upon the amount of information being provided for an individual meeting, it may be possible for a user browsing the list of meetings to click on the meeting of interest, fill out a registration form, download maps, browse abstracts, etc. We hope the availability of this service will encourage other meeting organizers to make information about their meetings available electronically and to take advantage of new technology such as NCSA Mosaic. URL: http:// cadcwww.dao.nrc.calmeetings/meetings.html

Mechanism of Oxidation of (p-Substituted Phenylthioacetic Acids with N-Chlorosaccharin

Directory of Open Access Journals (Sweden)

N. M. I. Alhaj

2011-01-01

Full Text Available The kinetics of oxidation of (phenylthioacetic acid (PTAA with N-chlorosaccharin (NCSA have been studied potentiometrically in 80:20 (v/v acetonitrile-water medium at 298 K. The reaction is first-order each with respect to PTAA and NCSA and shows a negative dependence on [H+]. NCSA itself is shown to be the active oxidizing species. Effects of ionic strength variation, added saccharin, added acrylonitrile, added NaCl and solvent composition variation have been studied. Effect of substituents on the reaction rate has been analysed by employing various (p-sustituted phenylthioacetic acids. The electron-releasing substituent in the phenyl ring of PTAA accelerates the reaction rate while the electron-withdrawing substituent retards the rate. The excellently linear Hammett plot yields a large negative ρ value, supporting the involvement a chlorosulphonium ion intermediate in the rate-determining step.

Solving sparse linear least squares problems on some supercomputers by using large dense blocks

DEFF Research Database (Denmark)

Hansen, Per Christian; Ostromsky, T; Sameh, A

1997-01-01

technique is preferable to sparse matrix technique when the matrices are not large, because the high computational speed compensates fully the disadvantages of using more arithmetic operations and more storage. For very large matrices the computations must be organized as a sequence of tasks in each......Efficient subroutines for dense matrix computations have recently been developed and are available on many high-speed computers. On some computers the speed of many dense matrix operations is near to the peak-performance. For sparse matrices storage and operations can be saved by operating only...... and storing only nonzero elements. However, the price is a great degradation of the speed of computations on supercomputers (due to the use of indirect addresses, to the need to insert new nonzeros in the sparse storage scheme, to the lack of data locality, etc.). On many high-speed computers a dense matrix...

Accelerating Science Impact through Big Data Workflow Management and Supercomputing

Directory of Open Access Journals (Sweden)

De K.

2016-01-01

Full Text Available The Large Hadron Collider (LHC, operating at the international CERN Laboratory in Geneva, Switzerland, is leading Big Data driven scientific explorations. ATLAS, one of the largest collaborations ever assembled in the the history of science, is at the forefront of research at the LHC. To address an unprecedented multi-petabyte data processing challenge, the ATLAS experiment is relying on a heterogeneous distributed computational infrastructure. To manage the workflow for all data processing on hundreds of data centers the PanDA (Production and Distributed AnalysisWorkload Management System is used. An ambitious program to expand PanDA to all available computing resources, including opportunistic use of commercial and academic clouds and Leadership Computing Facilities (LCF, is realizing within BigPanDA and megaPanDA projects. These projects are now exploring how PanDA might be used for managing computing jobs that run on supercomputers including OLCF’s Titan and NRC-KI HPC2. The main idea is to reuse, as much as possible, existing components of the PanDA system that are already deployed on the LHC Grid for analysis of physics data. The next generation of PanDA will allow many data-intensive sciences employing a variety of computing platforms to benefit from ATLAS experience and proven tools in highly scalable processing.

Parallel science and engineering applications the Charm++ approach

CERN Document Server

Kale, Laxmikant V

2016-01-01

Developed in the context of science and engineering applications, with each abstraction motivated by and further honed by specific application needs, Charm++ is a production-quality system that runs on almost all parallel computers available. Parallel Science and Engineering Applications: The Charm++ Approach surveys a diverse and scalable collection of science and engineering applications, most of which are used regularly on supercomputers by scientists to further their research. After a brief introduction to Charm++, the book presents several parallel CSE codes written in the Charm++ model, along with their underlying scientific and numerical formulations, explaining their parallelization strategies and parallel performance. These chapters demonstrate the versatility of Charm++ and its utility for a wide variety of applications, including molecular dynamics, cosmology, quantum chemistry, fracture simulations, agent-based simulations, and weather modeling. The book is intended for a wide audience of people i...

EDF's experience with supercomputing and challenges ahead - towards multi-physics and multi-scale approaches

Energy Technology Data Exchange (ETDEWEB)

Delbecq, J.M.; Banner, D. [Electricite de France (EDF)- R and D Division, 92 - Clamart (France)

2003-07-01

Nuclear power plants are a major asset of the EDF company. To remain so, in particular in a context of deregulation, competitiveness, safety and public acceptance are three conditions. These stakes apply both to existing plants and to future reactors. The purpose of the presentation is to explain how supercomputing can help EDF to satisfy these requirements. Three examples are described in detail: ensuring optimal use of nuclear fuel under wholly safe conditions, understanding and simulating the material deterioration mechanisms and moving forward with numerical simulation for the performance of EDF's activities. In conclusion, a broader vision of EDF long term R and D in the field of numerical simulation is given and especially of five challenges taken up by EDF together with its industrial and scientific partners. (author)

Simplifying the Access to HPC Resources by Integrating them in the Application GUI

KAUST Repository

van Waveren, Matthijs

2016-06-22

The computing landscape of KAUST is increasing in complexity. Researchers have access to the 9th fastest supercomputer in the world (Shaheen II) and several other HPC clusters. They work on local Windows, Mac, or Linux workstations. In order to facilitate the access of the HPC systems, we have developed interfaces to several research applications that automate input data transfer, job submission and retrieval of results. The user now submits his jobs to the cluster from within the application GUI on his workstation, and does not have to physically go onto the cluster anymore.

High Performance Computing Software Applications for Space Situational Awareness

Science.gov (United States)

Giuliano, C.; Schumacher, P.; Matson, C.; Chun, F.; Duncan, B.; Borelli, K.; Desonia, R.; Gusciora, G.; Roe, K.

The High Performance Computing Software Applications Institute for Space Situational Awareness (HSAI-SSA) has completed its first full year of applications development. The emphasis of our work in this first year was in improving space surveillance sensor models and image enhancement software. These applications are the Space Surveillance Network Analysis Model (SSNAM), the Air Force Space Fence simulation (SimFence), and physically constrained iterative de-convolution (PCID) image enhancement software tool. Specifically, we have demonstrated order of magnitude speed-up in those codes running on the latest Cray XD-1 Linux supercomputer (Hoku) at the Maui High Performance Computing Center. The software applications improvements that HSAI-SSA has made, has had significant impact to the warfighter and has fundamentally changed the role of high performance computing in SSA.

New Mexico High School Supercomputing Challenge, 1990--1995: Five years of making a difference to students, teachers, schools, and communities. Progress report

Energy Technology Data Exchange (ETDEWEB)

Foster, M.; Kratzer, D.

1996-02-01

The New Mexico High School Supercomputing Challenge is an academic program dedicated to increasing interest in science and math among high school students by introducing them to high performance computing. This report provides a summary and evaluation of the first five years of the program, describes the program and shows the impact that it has had on high school students, their teachers, and their communities. Goals and objectives are reviewed and evaluated, growth and development of the program are analyzed, and future directions are discussed.

Parallel simulation of tsunami inundation on a large-scale supercomputer

Science.gov (United States)

Oishi, Y.; Imamura, F.; Sugawara, D.

2013-12-01

An accurate prediction of tsunami inundation is important for disaster mitigation purposes. One approach is to approximate the tsunami wave source through an instant inversion analysis using real-time observation data (e.g., Tsushima et al., 2009) and then use the resulting wave source data in an instant tsunami inundation simulation. However, a bottleneck of this approach is the large computational cost of the non-linear inundation simulation and the computational power of recent massively parallel supercomputers is helpful to enable faster than real-time execution of a tsunami inundation simulation. Parallel computers have become approximately 1000 times faster in 10 years (www.top500.org), and so it is expected that very fast parallel computers will be more and more prevalent in the near future. Therefore, it is important to investigate how to efficiently conduct a tsunami simulation on parallel computers. In this study, we are targeting very fast tsunami inundation simulations on the K computer, currently the fastest Japanese supercomputer, which has a theoretical peak performance of 11.2 PFLOPS. One computing node of the K computer consists of 1 CPU with 8 cores that share memory, and the nodes are connected through a high-performance torus-mesh network. The K computer is designed for distributed-memory parallel computation, so we have developed a parallel tsunami model. Our model is based on TUNAMI-N2 model of Tohoku University, which is based on a leap-frog finite difference method. A grid nesting scheme is employed to apply high-resolution grids only at the coastal regions. To balance the computation load of each CPU in the parallelization, CPUs are first allocated to each nested layer in proportion to the number of grid points of the nested layer. Using CPUs allocated to each layer, 1-D domain decomposition is performed on each layer. In the parallel computation, three types of communication are necessary: (1) communication to adjacent neighbours for the

Longitudinal relaxation of initially straight flexible and stiff polymers

Science.gov (United States)

Dimitrakopoulos, Panagiotis; Dissanayake, Inuka

2004-11-01

computations were performed on multiprocessor computers provided by the National Center for Supercomputing Applications (NCSA) in Illinois (grant DMR000003), and by an Academic Equipment Grant from Sun Microsystems Inc.

A criticality safety analysis code using a vectorized Monte Carlo method on the HITAC S-810 supercomputer

International Nuclear Information System (INIS)

Morimoto, Y.; Maruyama, H.

1987-01-01

A vectorized Monte Carlo criticality safety analysis code has been developed on the vector supercomputer HITAC S-810. In this code, a multi-particle tracking algorithm was adopted for effective utilization of the vector processor. A flight analysis with pseudo-scattering was developed to reduce the computational time needed for flight analysis, which represents the bulk of computational time. This new algorithm realized a speed-up of factor 1.5 over the conventional flight analysis. The code also adopted the multigroup cross section constants library of the Bodarenko type with 190 groups, with 132 groups being for fast and epithermal regions and 58 groups being for the thermal region. Evaluation work showed that this code reproduce the experimental results to an accuracy of about 1 % for the effective neutron multiplication factor. (author)

Benchmarking Further Single Board Computers for Building a Mini Supercomputer for Simulation of Telecommunication Systems

Directory of Open Access Journals (Sweden)

Gábor Lencse

2016-01-01

Full Text Available Parallel Discrete Event Simulation (PDES with the conservative synchronization method can be efficiently used for the performance analysis of telecommunication systems because of their good lookahead properties. For PDES, a cost effective execution platform may be built by using single board computers (SBCs, which offer relatively high computation capacity compared to their price or power consumption and especially to the space they take up. A benchmarking method is proposed and its operation is demonstrated by benchmarking ten different SBCs, namely Banana Pi, Beaglebone Black, Cubieboard2, Odroid-C1+, Odroid-U3+, Odroid-XU3 Lite, Orange Pi Plus, Radxa Rock Lite, Raspberry Pi Model B+, and Raspberry Pi 2 Model B+. Their benchmarking results are compared to find out which one should be used for building a mini supercomputer for parallel discrete-event simulation of telecommunication systems. The SBCs are also used to build a heterogeneous cluster and the performance of the cluster is tested, too.

NASA's Climate in a Box: Desktop Supercomputing for Open Scientific Model Development

Science.gov (United States)

Wojcik, G. S.; Seablom, M. S.; Lee, T. J.; McConaughy, G. R.; Syed, R.; Oloso, A.; Kemp, E. M.; Greenseid, J.; Smith, R.

2009-12-01

NASA's High Performance Computing Portfolio in cooperation with its Modeling, Analysis, and Prediction program intends to make its climate and earth science models more accessible to a larger community. A key goal of this effort is to open the model development and validation process to the scientific community at large such that a natural selection process is enabled and results in a more efficient scientific process. One obstacle to others using NASA models is the complexity of the models and the difficulty in learning how to use them. This situation applies not only to scientists who regularly use these models but also non-typical users who may want to use the models such as scientists from different domains, policy makers, and teachers. Another obstacle to the use of these models is that access to high performance computing (HPC) accounts, from which the models are implemented, can be restrictive with long wait times in job queues and delays caused by an arduous process of obtaining an account, especially for foreign nationals. This project explores the utility of using desktop supercomputers in providing a complete ready-to-use toolkit of climate research products to investigators and on demand access to an HPC system. One objective of this work is to pre-package NASA and NOAA models so that new users will not have to spend significant time porting the models. In addition, the prepackaged toolkit will include tools, such as workflow, visualization, social networking web sites, and analysis tools, to assist users in running the models and analyzing the data. The system architecture to be developed will allow for automatic code updates for each user and an effective means with which to deal with data that are generated. We plan to investigate several desktop systems, but our work to date has focused on a Cray CX1. Currently, we are investigating the potential capabilities of several non-traditional development environments. While most NASA and NOAA models are

New generation of docking programs: Supercomputer validation of force fields and quantum-chemical methods for docking.

Science.gov (United States)

Sulimov, Alexey V; Kutov, Danil C; Katkova, Ekaterina V; Ilin, Ivan S; Sulimov, Vladimir B

2017-11-01

Discovery of new inhibitors of the protein associated with a given disease is the initial and most important stage of the whole process of the rational development of new pharmaceutical substances. New inhibitors block the active site of the target protein and the disease is cured. Computer-aided molecular modeling can considerably increase effectiveness of new inhibitors development. Reliable predictions of the target protein inhibition by a small molecule, ligand, is defined by the accuracy of docking programs. Such programs position a ligand in the target protein and estimate the protein-ligand binding energy. Positioning accuracy of modern docking programs is satisfactory. However, the accuracy of binding energy calculations is too low to predict good inhibitors. For effective application of docking programs to new inhibitors development the accuracy of binding energy calculations should be higher than 1kcal/mol. Reasons of limited accuracy of modern docking programs are discussed. One of the most important aspects limiting this accuracy is imperfection of protein-ligand energy calculations. Results of supercomputer validation of several force fields and quantum-chemical methods for docking are presented. The validation was performed by quasi-docking as follows. First, the low energy minima spectra of 16 protein-ligand complexes were found by exhaustive minima search in the MMFF94 force field. Second, energies of the lowest 8192 minima are recalculated with CHARMM force field and PM6-D3H4X and PM7 quantum-chemical methods for each complex. The analysis of minima energies reveals the docking positioning accuracies of the PM7 and PM6-D3H4X quantum-chemical methods and the CHARMM force field are close to one another and they are better than the positioning accuracy of the MMFF94 force field. Copyright © 2017 Elsevier Inc. All rights reserved.

Status and future perspective of applications of high temperature superconductors

Science.gov (United States)

Tanaka, Shoji

The material research on the high temperature superconductivity for the past ten years gave us sufficient information on the new phenomena of these new materials. It seems that new applications in a very wide range of industries are increasing rapidly. In this report three main topics of the applications are given ; [a] progress of the superconducting bulk materials and their applications to the flywheel electricity storage system and others, [b] progress in the development of superconducting tapes and their applications to power cables, the high field superconducting magnet for the SMES and for the pulling system of large silicon single crystal, and [c] development of new superconducting electronic devices (SFQ) and the possiblity of the application to next generation supercomputers. These examples show the great capability of the superconductivity technology and it is expected that the real superconductivity industry will take off around the year of 2005.

Distributed interactive graphics applications in computational fluid dynamics

International Nuclear Information System (INIS)

Rogers, S.E.; Buning, P.G.; Merritt, F.J.

1987-01-01

Implementation of two distributed graphics programs used in computational fluid dynamics is discussed. Both programs are interactive in nature. They run on a CRAY-2 supercomputer and use a Silicon Graphics Iris workstation as the front-end machine. The hardware and supporting software are from the Numerical Aerodynamic Simulation project. The supercomputer does all numerically intensive work and the workstation, as the front-end machine, allows the user to perform real-time interactive transformations on the displayed data. The first program was written as a distributed program that computes particle traces for fluid flow solutions existing on the supercomputer. The second is an older post-processing and plotting program modified to run in a distributed mode. Both programs have realized a large increase in speed over that obtained using a single machine. By using these programs, one can learn quickly about complex features of a three-dimensional flow field. Some color results are presented

Benchmarking Data Analysis and Machine Learning Applications on the Intel KNL Many-Core Processor

OpenAIRE

Byun, Chansup; Kepner, Jeremy; Arcand, William; Bestor, David; Bergeron, Bill; Gadepally, Vijay; Houle, Michael; Hubbell, Matthew; Jones, Michael; Klein, Anna; Michaleas, Peter; Milechin, Lauren; Mullen, Julie; Prout, Andrew; Rosa, Antonio

2017-01-01

Knights Landing (KNL) is the code name for the second-generation Intel Xeon Phi product family. KNL has generated significant interest in the data analysis and machine learning communities because its new many-core architecture targets both of these workloads. The KNL many-core vector processor design enables it to exploit much higher levels of parallelism. At the Lincoln Laboratory Supercomputing Center (LLSC), the majority of users are running data analysis applications such as MATLAB and O...

Application of Raptor-M3G to reactor dosimetry problems on massively parallel architectures - 026

International Nuclear Information System (INIS)

Longoni, G.

2010-01-01

The solution of complex 3-D radiation transport problems requires significant resources both in terms of computation time and memory availability. Therefore, parallel algorithms and multi-processor architectures are required to solve efficiently large 3-D radiation transport problems. This paper presents the application of RAPTOR-M3G (Rapid Parallel Transport Of Radiation - Multiple 3D Geometries) to reactor dosimetry problems. RAPTOR-M3G is a newly developed parallel computer code designed to solve the discrete ordinates (SN) equations on multi-processor computer architectures. This paper presents the results for a reactor dosimetry problem using a 3-D model of a commercial 2-loop pressurized water reactor (PWR). The accuracy and performance of RAPTOR-M3G will be analyzed and the numerical results obtained from the calculation will be compared directly to measurements of the neutron field in the reactor cavity air gap. The parallel performance of RAPTOR-M3G on massively parallel architectures, where the number of computing nodes is in the order of hundreds, will be analyzed up to four hundred processors. The performance results will be presented based on two supercomputing architectures: the POPLE supercomputer operated by the Pittsburgh Supercomputing Center and the Westinghouse computer cluster. The Westinghouse computer cluster is equipped with a standard Ethernet network connection and an InfiniBand R interconnects capable of a bandwidth in excess of 20 GBit/sec. Therefore, the impact of the network architecture on RAPTOR-M3G performance will be analyzed as well. (authors)

Using the LANSCE irradiation facility to predict the number of fatal soft errors in one of the world's fastest supercomputers

International Nuclear Information System (INIS)

Michalak, S.E.; Harris, K.W.; Hengartner, N.W.; Takala, B.E.; Wender, S.A.

2005-01-01

Los Alamos National Laboratory (LANL) is home to the Los Alamos Neutron Science Center (LANSCE). LANSCE is a unique facility because its neutron spectrum closely mimics the neutron spectrum at terrestrial and aircraft altitudes, but is many times more intense. Thus, LANSCE provides an ideal setting for accelerated testing of semiconductor and other devices that are susceptible to cosmic ray induced neutrons. Many industrial companies use LANSCE to estimate device susceptibility to cosmic ray induced neutrons, and it has also been used to test parts from one of LANL's supercomputers, the ASC (Advanced Simulation and Computing Program) Q. This paper discusses our use of the LANSCE facility to study components in Q including a comparison with failure data from Q

The Dark Energy Survey Data Management System

International Nuclear Information System (INIS)

Mohr, Joseph J.; Darnell, J.Anthony; Beldica, Cristina; Barkhouse, Wayne; Bertin, Emmanuel; Dora Cai, Y.; Daues, Gregory E.; Gower, Michelle; Nicolaci da Costa, Luiz A.; Jarvis, Michael; Lin, Huan

2008-01-01

The Dark Energy Survey (DES) collaboration will study cosmic acceleration with a 5000 deg2 griZY survey in the southern sky over 525 nights from 2011-2016. The DES data management (DESDM) system will be used to process and archive these data and the resulting science ready data products. The DESDM system consists of an integrated archive, a processing framework, an ensemble of astronomy codes and a data access framework. We are developing the DESDM system for operation in the high performance computing (HPC) environments at the National Center for Supercomputing Applications (NCSA) and Fermilab. Operating the DESDM system in an HPC environment offers both speed and flexibility. We will employ it for our regular nightly processing needs, and for more compute-intensive tasks such as large scale image coaddition campaigns, extraction of weak lensing shear from the full survey dataset, and massive seasonal reprocessing of the DES data. Data products will be available to the Collaboration and later to the public through a virtual-observatory compatible web portal. Our approach leverages investments in publicly available HPC systems, greatly reducing hardware and maintenance costs to the project, which must deploy and maintain only the storage, database platforms and orchestration and web portal nodes that are specific to DESDM. In Fall 2007, we tested the current DESDM system on both simulated and real survey data. We used TeraGrid to process 10 simulated DES nights (3TB of raw data), ingesting and calibrating approximately 250 million objects into the DES Archive database. We also used DESDM to process and calibrate over 50 nights of survey data acquired with the Mosaic2 camera. Comparison to truth tables in the case of the simulated data and internal crosschecks in the case of the real data indicate that astrometric and photometric data quality is excellent

The Dark Energy Survey Data Management System

Energy Technology Data Exchange (ETDEWEB)

Mohr, Joseph J.; /Illinois U., Urbana, Astron. Dept. /Illinois U., Urbana; Barkhouse, Wayne; /North Dakota U.; Beldica, Cristina; /Illinois U., Urbana; Bertin, Emmanuel; /Paris, Inst. Astrophys.; Dora Cai, Y.; /NCSA, Urbana; Nicolaci da Costa, Luiz A.; /Rio de Janeiro Observ.; Darnell, J.Anthony; /Illinois U., Urbana, Astron. Dept.; Daues, Gregory E.; /NCSA, Urbana; Jarvis, Michael; /Pennsylvania U.; Gower, Michelle; /NCSA, Urbana; Lin, Huan; /Fermilab /Rio de Janeiro Observ.

2008-07-01

The Dark Energy Survey (DES) collaboration will study cosmic acceleration with a 5000 deg2 griZY survey in the southern sky over 525 nights from 2011-2016. The DES data management (DESDM) system will be used to process and archive these data and the resulting science ready data products. The DESDM system consists of an integrated archive, a processing framework, an ensemble of astronomy codes and a data access framework. We are developing the DESDM system for operation in the high performance computing (HPC) environments at the National Center for Supercomputing Applications (NCSA) and Fermilab. Operating the DESDM system in an HPC environment offers both speed and flexibility. We will employ it for our regular nightly processing needs, and for more compute-intensive tasks such as large scale image coaddition campaigns, extraction of weak lensing shear from the full survey dataset, and massive seasonal reprocessing of the DES data. Data products will be available to the Collaboration and later to the public through a virtual-observatory compatible web portal. Our approach leverages investments in publicly available HPC systems, greatly reducing hardware and maintenance costs to the project, which must deploy and maintain only the storage, database platforms and orchestration and web portal nodes that are specific to DESDM. In Fall 2007, we tested the current DESDM system on both simulated and real survey data. We used TeraGrid to process 10 simulated DES nights (3TB of raw data), ingesting and calibrating approximately 250 million objects into the DES Archive database. We also used DESDM to process and calibrate over 50 nights of survey data acquired with the Mosaic2 camera. Comparison to truth tables in the case of the simulated data and internal crosschecks in the case of the real data indicate that astrometric and photometric data quality is excellent.

Knowledge based systems for nuclear applications in Germany

International Nuclear Information System (INIS)

Schmidt, F.

1987-01-01

Several national and international research programs which are dealing with artificial intelligence and other innovative computer applications are in progress in Germany. However in contrast to the development of computer applications in the past, the new research programs are not very much determined from needs of the nuclear industry. Thus, applications of AI techniques in German nuclear industry are not very innovative in the sense of artificial intelligence. They may be divided into two categories: 1. projects which are aimed to explore the new technologies, 2. projects which are aimed to open new areas of work. This situation changes due to the fact that supercomputers with large memory, workstations with cheap disc devices and fast networks are becoming available. These hardware devices allow the connection of locally available knowledge and data bases with powerful central computer capacity. Using such hardware tools new applications can be developed in nuclear engineering using even existing software tools. These new applications may be characterized as integrated systems. The Integral Planning Simulation System IPSS which is under development at the University of Stuttgart is such a system

Fault Tolerance Assistant (FTA): An Exception Handling Programming Model for MPI Applications

Energy Technology Data Exchange (ETDEWEB)

Fang, Aiman [Univ. of Chicago, IL (United States). Dept. of Computer Science; Laguna, Ignacio [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States); Sato, Kento [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States); Islam, Tanzima [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States); Mohror, Kathryn [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States)

2016-05-23

Future high-performance computing systems may face frequent failures with their rapid increase in scale and complexity. Resilience to faults has become a major challenge for large-scale applications running on supercomputers, which demands fault tolerance support for prevalent MPI applications. Among failure scenarios, process failures are one of the most severe issues as they usually lead to termination of applications. However, the widely used MPI implementations do not provide mechanisms for fault tolerance. We propose FTA-MPI (Fault Tolerance Assistant MPI), a programming model that provides support for failure detection, failure notification and recovery. Specifically, FTA-MPI exploits a try/catch model that enables failure localization and transparent recovery of process failures in MPI applications. We demonstrate FTA-MPI with synthetic applications and a molecular dynamics code CoMD, and show that FTA-MPI provides high programmability for users and enables convenient and flexible recovery of process failures.

Performance Analysis, Modeling and Scaling of HPC Applications and Tools

Energy Technology Data Exchange (ETDEWEB)

Bhatele, Abhinav [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States)

2016-01-13

E cient use of supercomputers at DOE centers is vital for maximizing system throughput, mini- mizing energy costs and enabling science breakthroughs faster. This requires complementary e orts along several directions to optimize the performance of scienti c simulation codes and the under- lying runtimes and software stacks. This in turn requires providing scalable performance analysis tools and modeling techniques that can provide feedback to physicists and computer scientists developing the simulation codes and runtimes respectively. The PAMS project is using time allocations on supercomputers at ALCF, NERSC and OLCF to further the goals described above by performing research along the following fronts: 1. Scaling Study of HPC applications; 2. Evaluation of Programming Models; 3. Hardening of Performance Tools; 4. Performance Modeling of Irregular Codes; and 5. Statistical Analysis of Historical Performance Data. We are a team of computer and computational scientists funded by both DOE/NNSA and DOE/ ASCR programs such as ECRP, XStack (Traleika Glacier, PIPER), ExaOSR (ARGO), SDMAV II (MONA) and PSAAP II (XPACC). This allocation will enable us to study big data issues when analyzing performance on leadership computing class systems and to assist the HPC community in making the most e ective use of these resources.

Experimental investigation and exergy analysis of the performance of a counter flow Ranque-Hilsch vortex tube with regard to nozzle cross-section areas

Energy Technology Data Exchange (ETDEWEB)

Dincer, K.; Avci, A.; Berber, A. [Dept. of Mechanical Eng., Fac. of Eng. and Architecture, Selcuk Univ., Selcuklu, Konya (Turkey); Baskaya, S. [Dept. of Mechanical Eng., Fac. of Eng. and Architecture, Gazi Univ., Maltepe, Ankara (Turkey)

2010-08-15

Exergy analysis and performance of a Ranque-Hilsch Vortex Tube (RHVT) with various nozzle cross-section areas (NCSA = 3 x 3, 4 x 4, 5 x 5 mm{sup 2}) were determined under inlet pressures (P{sub i}) of 260, 300 kPa (absolute) pressurized air. The maximum difference in the temperatures of hot output and cold output streams was obtained for NCSA = 3 x 3 mm{sup 2}. The total inlet exergy (sum E{sub i}), total outlet exergy (sum E{sub O}), total lost exergy (sum E{sub Lost}) and exergy efficiency ({eta}, %) were calculated. It was determined that the exergy efficiency of the system, varied between 1% and 39%, and the highest exergy efficiency was obtained for NCSA = 3 x 3 mm{sup 2}. The exergy efficiency strongly depends on the level of P{sub i}, {xi} and v{sub cold}. Variation of the exergy efficiency decreased with decreasing P{sub i}, {xi}, v{sub cold} and the highest and lowest exergy efficiencies were found when the values of P{sub i}, {xi}, v{sub cold} reached maximum and minimum levels, respectively. (author)

The design and implementation of cost-effective algorithms for direct solution of banded linear systems on the vector processor system 32 supercomputer

Science.gov (United States)

Samba, A. S.

1985-01-01

The problem of solving banded linear systems by direct (non-iterative) techniques on the Vector Processor System (VPS) 32 supercomputer is considered. Two efficient direct methods for solving banded linear systems on the VPS 32 are described. The vector cyclic reduction (VCR) algorithm is discussed in detail. The performance of the VCR on a three parameter model problem is also illustrated. The VCR is an adaptation of the conventional point cyclic reduction algorithm. The second direct method is the Customized Reduction of Augmented Triangles' (CRAT). CRAT has the dominant characteristics of an efficient VPS 32 algorithm. CRAT is tailored to the pipeline architecture of the VPS 32 and as a consequence the algorithm is implicitly vectorizable.

Sandia`s network for Supercomputing `94: Linking the Los Alamos, Lawrence Livermore, and Sandia National Laboratories using switched multimegabit data service

Energy Technology Data Exchange (ETDEWEB)

Vahle, M.O.; Gossage, S.A.; Brenkosh, J.P. [Sandia National Labs., Albuquerque, NM (United States). Advanced Networking Integration Dept.

1995-01-01

Supercomputing `94, a high-performance computing and communications conference, was held November 14th through 18th, 1994 in Washington DC. For the past four years, Sandia National Laboratories has used this conference to showcase and focus its communications and networking endeavors. At the 1994 conference, Sandia built a Switched Multimegabit Data Service (SMDS) network running at 44.736 megabits per second linking its private SMDS network between its facilities in Albuquerque, New Mexico and Livermore, California to the convention center in Washington, D.C. For the show, the network was also extended from Sandia, New Mexico to Los Alamos National Laboratory and from Sandia, California to Lawrence Livermore National Laboratory. This paper documents and describes this network and how it was used at the conference.

Leveraging HPC resources for High Energy Physics

International Nuclear Information System (INIS)

O'Brien, B; Washbrook, A; Walker, R

2014-01-01

High Performance Computing (HPC) supercomputers provide unprecedented computing power for a diverse range of scientific applications. The most powerful supercomputers now deliver petaflop peak performance with the expectation of 'exascale' technologies available in the next five years. More recent HPC facilities use x86-based architectures managed by Linux-based operating systems which could potentially allow unmodified HEP software to be run on supercomputers. There is now a renewed interest from both the LHC experiments and the HPC community to accommodate data analysis and event simulation production on HPC facilities. This study provides an outline of the challenges faced when incorporating HPC resources for HEP software by using the HECToR supercomputer as a demonstrator.

High Performance Computing in Science and Engineering '02 : Transactions of the High Performance Computing Center

CERN Document Server

Jäger, Willi

2003-01-01

This book presents the state-of-the-art in modeling and simulation on supercomputers. Leading German research groups present their results achieved on high-end systems of the High Performance Computing Center Stuttgart (HLRS) for the year 2002. Reports cover all fields of supercomputing simulation ranging from computational fluid dynamics to computer science. Special emphasis is given to industrially relevant applications. Moreover, by presenting results for both vector sytems and micro-processor based systems the book allows to compare performance levels and usability of a variety of supercomputer architectures. It therefore becomes an indispensable guidebook to assess the impact of the Japanese Earth Simulator project on supercomputing in the years to come.

2nd International Workshop on Eigenvalue Problems : Algorithms, Software and Applications in Petascale Computing

CERN Document Server

Zhang, Shao-Liang; Imamura, Toshiyuki; Yamamoto, Yusaku; Kuramashi, Yoshinobu; Hoshi, Takeo

2017-01-01

This book provides state-of-the-art and interdisciplinary topics on solving matrix eigenvalue problems, particularly by using recent petascale and upcoming post-petascale supercomputers. It gathers selected topics presented at the International Workshops on Eigenvalue Problems: Algorithms; Software and Applications, in Petascale Computing (EPASA2014 and EPASA2015), which brought together leading researchers working on the numerical solution of matrix eigenvalue problems to discuss and exchange ideas – and in so doing helped to create a community for researchers in eigenvalue problems. The topics presented in the book, including novel numerical algorithms, high-performance implementation techniques, software developments and sample applications, will contribute to various fields that involve solving large-scale eigenvalue problems.

Ubiquitous Green Computing Techniques for High Demand Applications in Smart Environments

Directory of Open Access Journals (Sweden)

Jose M. Moya

2012-08-01

Full Text Available Ubiquitous sensor network deployments, such as the ones found in Smart cities and Ambient intelligence applications, require constantly increasing high computational demands in order to process data and offer services to users. The nature of these applications imply the usage of data centers. Research has paid much attention to the energy consumption of the sensor nodes in WSNs infrastructures. However, supercomputing facilities are the ones presenting a higher economic and environmental impact due to their very high power consumption. The latter problem, however, has been disregarded in the field of smart environment services. This paper proposes an energy-minimization workload assignment technique, based on heterogeneity and application-awareness, that redistributes low-demand computational tasks from high-performance facilities to idle nodes with low and medium resources in the WSN infrastructure. These non-optimal allocation policies reduce the energy consumed by the whole infrastructure and the total execution time.

Ubiquitous green computing techniques for high demand applications in Smart environments.

Science.gov (United States)

Zapater, Marina; Sanchez, Cesar; Ayala, Jose L; Moya, Jose M; Risco-Martín, José L

2012-01-01

Ubiquitous sensor network deployments, such as the ones found in Smart cities and Ambient intelligence applications, require constantly increasing high computational demands in order to process data and offer services to users. The nature of these applications imply the usage of data centers. Research has paid much attention to the energy consumption of the sensor nodes in WSNs infrastructures. However, supercomputing facilities are the ones presenting a higher economic and environmental impact due to their very high power consumption. The latter problem, however, has been disregarded in the field of smart environment services. This paper proposes an energy-minimization workload assignment technique, based on heterogeneity and application-awareness, that redistributes low-demand computational tasks from high-performance facilities to idle nodes with low and medium resources in the WSN infrastructure. These non-optimal allocation policies reduce the energy consumed by the whole infrastructure and the total execution time.

An overview of the activities of the OECD/NEA Task Force on adapting computer codes in nuclear applications to parallel architectures

Energy Technology Data Exchange (ETDEWEB)

Kirk, B.L. [Oak Ridge National Lab., TN (United States); Sartori, E. [OCDE/OECD NEA Data Bank, Issy-les-Moulineaux (France); Viedma, L.G. de [Consejo de Seguridad Nuclear, Madrid (Spain)

1997-06-01

Subsequent to the introduction of High Performance Computing in the developed countries, the Organization for Economic Cooperation and Development/Nuclear Energy Agency (OECD/NEA) created the Task Force on Adapting Computer Codes in Nuclear Applications to Parallel Architectures (under the guidance of the Nuclear Science Committee`s Working Party on Advanced Computing) to study the growth area in supercomputing and its applicability to the nuclear community`s computer codes. The result has been four years of investigation for the Task Force in different subject fields - deterministic and Monte Carlo radiation transport, computational mechanics and fluid dynamics, nuclear safety, atmospheric models and waste management.

An overview of the activities of the OECD/NEA Task Force on adapting computer codes in nuclear applications to parallel architectures

International Nuclear Information System (INIS)

Kirk, B.L.; Sartori, E.; Viedma, L.G. de

1997-01-01

Subsequent to the introduction of High Performance Computing in the developed countries, the Organization for Economic Cooperation and Development/Nuclear Energy Agency (OECD/NEA) created the Task Force on Adapting Computer Codes in Nuclear Applications to Parallel Architectures (under the guidance of the Nuclear Science Committee's Working Party on Advanced Computing) to study the growth area in supercomputing and its applicability to the nuclear community's computer codes. The result has been four years of investigation for the Task Force in different subject fields - deterministic and Monte Carlo radiation transport, computational mechanics and fluid dynamics, nuclear safety, atmospheric models and waste management

High Performance Simulation of Large-Scale Red Sea Ocean Bottom Seismic Data on the Supercomputer Shaheen II

KAUST Repository

Tonellot, Thierry

2017-02-27

A combination of both shallow and deepwater, plus islands and coral reefs, are some of the main features contributing to the complexity of subsalt seismic exploration in the Red Sea transition zone. These features often result in degrading effects on seismic images. State-of-the-art ocean bottom acquisition technologies are therefore required to record seismic data with optimal fold and offset, as well as advanced processing and imaging techniques. Numerical simulations of such complex seismic data can help improve acquisition design and also help in customizing, validating and benchmarking the processing and imaging workflows that will be applied on the field data. Subsequently, realistic simulation of wave propagation is a computationally intensive process requiring a realistic model and an efficient 3D wave equation solver. Large-scale computing resources are also required to meet turnaround time compatible with a production time frame. In this work, we present the numerical simulation of an ocean bottom seismic survey to be acquired in the Red Sea transition zone starting in summer 2016. The survey\\'s acquisition geometry comprises nearly 300,000 unique shot locations and 21,000 unique receiver locations, covering about 760 km2. Using well log measurements and legacy 2D seismic lines in this area, a 3D P-wave velocity model was built, with a maximum depth of 7 km. The model was sampled at 10 m in each direction, resulting in more than 5 billion cells. Wave propagation in this model was performed using a 3D finite difference solver in the time domain based on a staggered grid velocity-pressure formulation of acoustodynamics. To ensure that the resulting data could be generated sufficiently fast, the King Abdullah University of Science and Technology (KAUST) supercomputer Shaheen II Cray XC40 was used. A total of 21,000 three-component (pressure and vertical and horizontal velocity) common receiver gathers with a 50 Hz maximum frequency were computed in less

High Performance Simulation of Large-Scale Red Sea Ocean Bottom Seismic Data on the Supercomputer Shaheen II

KAUST Repository

Tonellot, Thierry; Etienne, Vincent; Gashawbeza, Ewenet; Curiel, Emesto Sandoval; Khan, Azizur; Feki, Saber; Kortas, Samuel

2017-01-01

A combination of both shallow and deepwater, plus islands and coral reefs, are some of the main features contributing to the complexity of subsalt seismic exploration in the Red Sea transition zone. These features often result in degrading effects on seismic images. State-of-the-art ocean bottom acquisition technologies are therefore required to record seismic data with optimal fold and offset, as well as advanced processing and imaging techniques. Numerical simulations of such complex seismic data can help improve acquisition design and also help in customizing, validating and benchmarking the processing and imaging workflows that will be applied on the field data. Subsequently, realistic simulation of wave propagation is a computationally intensive process requiring a realistic model and an efficient 3D wave equation solver. Large-scale computing resources are also required to meet turnaround time compatible with a production time frame. In this work, we present the numerical simulation of an ocean bottom seismic survey to be acquired in the Red Sea transition zone starting in summer 2016. The survey's acquisition geometry comprises nearly 300,000 unique shot locations and 21,000 unique receiver locations, covering about 760 km2. Using well log measurements and legacy 2D seismic lines in this area, a 3D P-wave velocity model was built, with a maximum depth of 7 km. The model was sampled at 10 m in each direction, resulting in more than 5 billion cells. Wave propagation in this model was performed using a 3D finite difference solver in the time domain based on a staggered grid velocity-pressure formulation of acoustodynamics. To ensure that the resulting data could be generated sufficiently fast, the King Abdullah University of Science and Technology (KAUST) supercomputer Shaheen II Cray XC40 was used. A total of 21,000 three-component (pressure and vertical and horizontal velocity) common receiver gathers with a 50 Hz maximum frequency were computed in less than

Predictive Performance Tuning of OpenACC Accelerated Applications

KAUST Repository

Siddiqui, Shahzeb

2014-05-04

Graphics Processing Units (GPUs) are gradually becoming mainstream in supercomputing as their capabilities to significantly accelerate a large spectrum of scientific applications have been clearly identified and proven. Moreover, with the introduction of high level programming models such as OpenACC [1] and OpenMP 4.0 [2], these devices are becoming more accessible and practical to use by a larger scientific community. However, performance optimization of OpenACC accelerated applications usually requires an in-depth knowledge of the hardware and software specifications. We suggest a prediction-based performance tuning mechanism [3] to quickly tune OpenACC parameters for a given application to dynamically adapt to the execution environment on a given system. This approach is applied to a finite difference kernel to tune the OpenACC gang and vector clauses for mapping the compute kernels into the underlying accelerator architecture. Our experiments show a significant performance improvement against the default compiler parameters and a faster tuning by an order of magnitude compared to the brute force search tuning.

In vitro and in vivo evaluation of SN-38 nanocrystals with different particle sizes

Directory of Open Access Journals (Sweden)

Chen M

2017-08-01

Full Text Available Min Chen,1,2 Wanqing Li,3 Xun Zhang,1 Ye Dong,1 Yabing Hua,1 Hui Zhang,1 Jing Gao,1 Liang Zhao,2 Ying Li,1 Aiping Zheng1 1State Key Laboratory of Toxicology and Medical Countermeasures, Beijing Institute of Pharmacology and Toxicology, 2School of Pharmacy, Jinzhou Medical University, Jinzhou, 3School of Preclinical Medicine, Beijing University of Chinese Medicine, Beijing, People’s Republic of China Abstract: 7-Ethyl-10-hydroxycamptothecin (SN-38 is a potent broad-spectrum antitumor drug derived from irinotecan hydrochloride (CPT-11. Due to its poor solubility and instability of the active lactone ring, its clinical use is significantly limited. As one of the most promising formulations for poorly water-soluble drugs, nanocrystals have attracted increasing attention. In order to solve these problems and evaluate the antitumor effect of SN-38 in vitro and in vivo, two nanocrystals with markedly different particle sizes were prepared. Dynamic light scattering and transmission electron microscopy were used to investigate the two nanocrystals. The particle sizes of SN-38 nanocrystals A (SN-38/NCs-A and SN-38 nanocrystals B (SN-38/NCs-B were 229.5±1.99 and 799.2±14.44 nm, respectively. X-ray powder diffraction analysis showed that the crystalline state of SN-38 did not change in the size reduction process. An accelerated dissolution velocity of SN-38 was achieved by nanocrystals, and release rate of SN-38/NCs-A was significantly faster than that of SN-38/NCs-B. Cellular uptake, cellular cytotoxicity, pharmacokinetics, animal antitumor efficacy, and tissue distribution were subsequently examined. As a result, enhanced intracellular accumulation in HT1080 cells and cytotoxicity on different tumor cells were observed for SN-38/NCs-A compared to that for SN-38/NCs-B and solution. Besides, compared to the SN-38 solution, SN-38/NCs-A had a higher bioavailability after intravenous injection; while the bioavailability of SN-38/NCs-B was even lower than

The GF11 supercomputer

International Nuclear Information System (INIS)

Beetem, J.; Weingarten, D.

1986-01-01

GF11 is a parallel computer currently under construction at the IBM Yorktown Research Center. The machine incorporates 576 floating-point processors arrangedin a modified SIMD architecture. Each has space for 2 Mbytes of memory and is capable of 20 Mflops, giving the total machine a peak of 1.125 Gbytes of memory and 11.52 Gflops. The floating-point processors are interconnected by a dynamically reconfigurable non-blocking switching network. At each machine cycle any of 1024 pre-selected permutations of data can be realized among the processors. The main intended application of GF11 is a class of calculations arising from quantum chromodynamics

The GF11 supercomputer

International Nuclear Information System (INIS)

Beetem, J.; Denneau, M.; Weingarten, D.

1985-01-01

GF11 is a parallel computer currently under construction at the IBM Yorktown Research Center. The machine incorporates 576 floating- point processors arranged in a modified SIMD architecture. Each has space for 2 Mbytes of memory and is capable of 20 Mflops, giving the total machine a peak of 1.125 Gbytes of memory and 11.52 Gflops. The floating-point processors are interconnected by a dynamically reconfigurable nonblocking switching network. At each machine cycle any of 1024 pre-selected permutations of data can be realized among the processors. The main intended application of GF11 is a class of calculations arising from quantum chromodynamics

Productive Parallel Programming: The PCN Approach

Directory of Open Access Journals (Sweden)

Ian Foster

1992-01-01

Full Text Available We describe the PCN programming system, focusing on those features designed to improve the productivity of scientists and engineers using parallel supercomputers. These features include a simple notation for the concise specification of concurrent algorithms, the ability to incorporate existing Fortran and C code into parallel applications, facilities for reusing parallel program components, a portable toolkit that allows applications to be developed on a workstation or small parallel computer and run unchanged on supercomputers, and integrated debugging and performance analysis tools. We survey representative scientific applications and identify problem classes for which PCN has proved particularly useful.

The GF11 supercomputer

International Nuclear Information System (INIS)

Beetem, J.; Denneau, M.; Weingarten, D.

1985-01-01

GF11 is a parallel computer currently under construction at the Yorktown Research Center. The machine incorporates 576 floating-point processors arranged in a modified SIMD architecture. Each processor has space for 2 Mbytes of memory and is capable of 20 MFLOPS, giving the total machine a peak of 1.125 Gbytes of memory and 11.52 GFLOPS. The floating-point processors are interconnected by a dynamically reconfigurable non-blocking switching network. At each machine cycle any of 1024 pre-selected permutations of data can be realized among the processors. The main intended application of GF11 is a class of calculations arising from quantum chromodynamics, a proposed theory of the elementary particles which participate in nuclear interactions

Exploiting Redundancy and Application Scalability for Cost-Effective, Time-Constrained Execution of HPC Applications on Amazon EC2

International Nuclear Information System (INIS)

Marathe, Aniruddha P.; Harris, Rachel A.; Lowenthal, David K.; Supinski, Bronis R. de; Rountree, Barry L.; Schulz, Martin

2015-01-01

The use of clouds to execute high-performance computing (HPC) applications has greatly increased recently. Clouds provide several potential advantages over traditional supercomputers and in-house clusters. The most popular cloud is currently Amazon EC2, which provides fixed-cost and variable-cost, auction-based options. The auction market trades lower cost for potential interruptions that necessitate checkpointing; if the market price exceeds the bid price, a node is taken away from the user without warning. We explore techniques to maximize performance per dollar given a time constraint within which an application must complete. Specifically, we design and implement multiple techniques to reduce expected cost by exploiting redundancy in the EC2 auction market. We then design an adaptive algorithm that selects a scheduling algorithm and determines the bid price. We show that our adaptive algorithm executes programs up to seven times cheaper than using the on-demand market and up to 44 percent cheaper than the best non-redundant, auction-market algorithm. We extend our adaptive algorithm to incorporate application scalability characteristics for further cost savings. In conclusion, we show that the adaptive algorithm informed with scalability characteristics of applications achieves up to 56 percent cost savings compared to the expected cost for the base adaptive algorithm run at a fixed, user-defined scale.

A portable grid-enabled computing system for a nuclear material study

International Nuclear Information System (INIS)

Tsujita, Yuichi; Arima, Tatsumi; Takekawa, Takayuki; Suzuki, Yoshio

2010-01-01

We have built a portable grid-enabled computing system specialized for our molecular dynamics (MD) simulation program to study Pu material easily. Experimental approach to reveal properties of Pu materials is often accompanied by some difficulties such as radiotoxicity of actinides. Since a computational approach reveals new aspects to researchers without such radioactive facilities, we address an MD computation. In order to have more realistic results about e.g., melting point or thermal conductivity, we need a large scale of parallel computations. Most of application users who don't have supercomputers in their institutes should use a remote supercomputer. For such users, we have developed the portable and secured grid-enabled computing system to utilize a grid computing infrastructure provided by Information Technology Based Laboratory (ITBL). This system enables us to access remote supercomputers in the ITBL system seamlessly from a client PC through its graphical user interface (GUI). Typically it enables seamless file accesses on the GUI. Furthermore monitoring of standard output or standard error is available to see progress of an executed program. Since the system provides fruitful functionalities which are useful for parallel computing on a remote supercomputer, application users can concentrate on their researches. (author)

Application of supercomputers to 3-D mantle convection

International Nuclear Information System (INIS)

Baumgardner, J.R.

1986-01-01

Current generation vector machines are providing for the first time the computing power needed to treat planetary mantle convection in a fully three-dimensional fashion. A numerical technique known as multigrid has been implemented in spherical geometry using a hierarchy of meshes constructed from the regular icosahedron to yield a highly efficient three-dimensional compressible Eulerian finite element hydrodynamics formulation. The paper describes the numerical method and presents convection solutions for the mantles of both the earth and the Moon. In the case of the Earth, the convection pattern is characterized by upwelling in narrow circular plumes originating at the core-mantle boundary and by downwelling in sheets or slabs derived from the cold upper boundary layer. The preferred number of plumes appears to be on the order of six or seven. For the Moon, the numerical results indicate that development of a predominately L = 2 pattern in later lunar history is a plausible explanation for the present large second-degree non-hydrostatic component in the lunar figure

State-of-the-art of applications of neural networks in the nuclear industry

International Nuclear Information System (INIS)

Zwingelstein, G.; Masson, M.H.

1990-01-01

Artificial neural net models have been extensively studied for many years in various laboratories to try to simulate with computer programs the human brain performances. The first applications were developed in the fields of speech and image recognition. The aims of these studies were mainly to classify rapidly patterns corrupted by noises or partly missing. Neural networks with the development of new net topologies and algorithms and parallel computing hardwares and softwares are to-day very promising for applications in many industries. In the introduction, this paper presents the anticipated benefits of the uses of neural networks for industrial applications. Then a brief overview of the main neural networks is provided. Finally a short review of neural networks applications in the nuclear industry is given. It covers domains such as: predictive maintenance for vibratory surveillance of rotating machinery, signal processing, operator guidance and eddy current inspection. In conclusion recommendations are made to use with efficiency neural networks for practical applications. In particular the need for supercomputing will be pinpointed. (author)

Supercomputer debugging workshop `92

Energy Technology Data Exchange (ETDEWEB)

Brown, J.S.

1993-02-01

This report contains papers or viewgraphs on the following topics: The ABCs of Debugging in the 1990s; Cray Computer Corporation; Thinking Machines Corporation; Cray Research, Incorporated; Sun Microsystems, Inc; Kendall Square Research; The Effects of Register Allocation and Instruction Scheduling on Symbolic Debugging; Debugging Optimized Code: Currency Determination with Data Flow; A Debugging Tool for Parallel and Distributed Programs; Analyzing Traces of Parallel Programs Containing Semaphore Synchronization; Compile-time Support for Efficient Data Race Detection in Shared-Memory Parallel Programs; Direct Manipulation Techniques for Parallel Debuggers; Transparent Observation of XENOOPS Objects; A Parallel Software Monitor for Debugging and Performance Tools on Distributed Memory Multicomputers; Profiling Performance of Inter-Processor Communications in an iWarp Torus; The Application of Code Instrumentation Technology in the Los Alamos Debugger; and CXdb: The Road to Remote Debugging.

Load Balancing Scientific Applications

Energy Technology Data Exchange (ETDEWEB)

Pearce, Olga Tkachyshyn [Texas A & M Univ., College Station, TX (United States)

2014-12-01

The largest supercomputers have millions of independent processors, and concurrency levels are rapidly increasing. For ideal efficiency, developers of the simulations that run on these machines must ensure that computational work is evenly balanced among processors. Assigning work evenly is challenging because many large modern parallel codes simulate behavior of physical systems that evolve over time, and their workloads change over time. Furthermore, the cost of imbalanced load increases with scale because most large-scale scientific simulations today use a Single Program Multiple Data (SPMD) parallel programming model, and an increasing number of processors will wait for the slowest one at the synchronization points. To address load imbalance, many large-scale parallel applications use dynamic load balance algorithms to redistribute work evenly. The research objective of this dissertation is to develop methods to decide when and how to load balance the application, and to balance it effectively and affordably. We measure and evaluate the computational load of the application, and develop strategies to decide when and how to correct the imbalance. Depending on the simulation, a fast, local load balance algorithm may be suitable, or a more sophisticated and expensive algorithm may be required. We developed a model for comparison of load balance algorithms for a specific state of the simulation that enables the selection of a balancing algorithm that will minimize overall runtime.

Kinetics of phosphotungstic acid catalyzed oxidation of propan-1,3-diol and butan-1,4-diol by N-chlorosaccharin

Directory of Open Access Journals (Sweden)

Sanjay Kumar Singh

2011-09-01

Full Text Available The kinetic studies of N-chlorosaccharin (NCSA oxidation of propan-1,3-diol and butan-1,4-diol have been reported in presence of phophotungstic acid and in aqueous acetic acid medium. The reactions follow first-order in NCSA and one to zero order with respect to substrate and phosphotungstic acid. Increase in the concentration of added perchloric acid increases the rate of oxidation. A negative effect on the oxidation rate is observed for solvent whereas the ionic strength does not influence the rate of reaction. Addition of the reaction product, saccharin, exhibited retarding effect. Various activation parameters have been evaluated. The products of the reactions were identified as the corresponding aldehydes. A suitable scheme of mechanism consistent with the experimental results has been proposed.

Kinetics of Oxidation of Some Amino Acids by N-Chlorosaccharin in Aqueous Acetic Acid Medium

Directory of Open Access Journals (Sweden)

N. A. Mohamed Farook

2004-01-01

Full Text Available The kinetics of oxidation of some amino acids namely, glycine, alanine, aspartic acid, arginine, and histidine, (AA by N-chlorosaccharin (NCSA in aqueous acetic acid medium in the presence of perchloric acid have been investigated. The observed rate of oxidation is first order in [AA], [NCSA] and of inverse fractional order in [H+]. The main product of the oxidation is the corresponding aldehyde. The ionic strength on the reaction rate has no significant effect. The effect of changing the dielectric constant of the medium on the rate indicates the reaction to be of dipole-dipole type. Hypochlorous acid has been postulated as the reactive oxidizing species. The reaction constants involved in the mechanism are derived. The activation parameters are computed with respect to slow step of the mechanism.

Use of QUADRICS supercomputer as embedded simulator in emergency management systems; Utilizzo del calcolatore QUADRICS come simulatore in linea in un sistema di gestione delle emergenze

Energy Technology Data Exchange (ETDEWEB)

Bove, R.; Di Costanzo, G.; Ziparo, A. [ENEA, Centro Ricerche Casaccia, Rome (Italy). Dip. Energia

1996-07-01

The experience related to the implementation of a MRBT, atmospheric spreading model with a short duration releasing, are reported. This model was implemented on a QUADRICS-Q1 supercomputer. First is reported a description of the MRBT model. It is an analytical model to study the speadings of light gases realised in the atmosphere cause incidental releasing. The solution of diffusion equation is Gaussian like. It yield the concentration of pollutant substance released. The concentration is function of space and time. Thus the QUADRICS architecture is introduced. And the implementation of the model is described. At the end it will be consider the integration of the QUADRICS-based model as simulator in a emergency management system.

Pre-installation customer satisfaction survey

Science.gov (United States)

1996-10-01

The National Center for Statistics and Analysis (NCSA) Information Services Branch (ISB) required a more effective method of receiving, tracking, and completing requests for data, statistics, and information. To enhance ISBs services, a new cus...

Mantle Convection on Modern Supercomputers

Science.gov (United States)

Weismüller, J.; Gmeiner, B.; Huber, M.; John, L.; Mohr, M.; Rüde, U.; Wohlmuth, B.; Bunge, H. P.

2015-12-01

Mantle convection is the cause for plate tectonics, the formation of mountains and oceans, and the main driving mechanism behind earthquakes. The convection process is modeled by a system of partial differential equations describing the conservation of mass, momentum and energy. Characteristic to mantle flow is the vast disparity of length scales from global to microscopic, turning mantle convection simulations into a challenging application for high-performance computing. As system size and technical complexity of the simulations continue to increase, design and implementation of simulation models for next generation large-scale architectures is handled successfully only in an interdisciplinary context. A new priority program - named SPPEXA - by the German Research Foundation (DFG) addresses this issue, and brings together computer scientists, mathematicians and application scientists around grand challenges in HPC. Here we report from the TERRA-NEO project, which is part of the high visibility SPPEXA program, and a joint effort of four research groups. TERRA-NEO develops algorithms for future HPC infrastructures, focusing on high computational efficiency and resilience in next generation mantle convection models. We present software that can resolve the Earth's mantle with up to 1012 grid points and scales efficiently to massively parallel hardware with more than 50,000 processors. We use our simulations to explore the dynamic regime of mantle convection and assess the impact of small scale processes on global mantle flow.

Summaries of research and development activities by using supercomputer system of JAEA in FY2015. April 1, 2015 - March 31, 2016

International Nuclear Information System (INIS)

2017-01-01

Japan Atomic Energy Agency (JAEA) conducts research and development (R and D) in various fields related to nuclear power as a comprehensive institution of nuclear energy R and Ds, and utilizes computational science and technology in many activities. As shown in the fact that about 20 percent of papers published by JAEA are concerned with R and D using computational science, the supercomputer system of JAEA has become an important infrastructure to support computational science and technology. In FY2015, the system was used for R and D aiming to restore Fukushima (nuclear plant decommissioning and environmental restoration) as a priority issue, as well as for JAEA's major projects such as Fast Reactor Cycle System, Fusion R and D and Quantum Beam Science. This report presents a great number of R and D results accomplished by using the system in FY2015, as well as user support, operational records and overviews of the system, and so on. (author)

Summaries of research and development activities by using supercomputer system of JAEA in FY2014. April 1, 2014 - March 31, 2015

International Nuclear Information System (INIS)

2016-02-01

Japan Atomic Energy Agency (JAEA) conducts research and development (R and D) in various fields related to nuclear power as a comprehensive institution of nuclear energy R and Ds, and utilizes computational science and technology in many activities. As shown in the fact that about 20 percent of papers published by JAEA are concerned with R and D using computational science, the supercomputer system of JAEA has become an important infrastructure to support computational science and technology. In FY2014, the system was used for R and D aiming to restore Fukushima (nuclear plant decommissioning and environmental restoration) as a priority issue, as well as for JAEA's major projects such as Fast Reactor Cycle System, Fusion R and D and Quantum Beam Science. This report presents a great number of R and D results accomplished by using the system in FY2014, as well as user support, operational records and overviews of the system, and so on. (author)

Summaries of research and development activities by using supercomputer system of JAEA in FY2013. April 1, 2013 - March 31, 2014

International Nuclear Information System (INIS)

2015-02-01

Japan Atomic Energy Agency (JAEA) conducts research and development (R and D) in various fields related to nuclear power as a comprehensive institution of nuclear energy R and Ds, and utilizes computational science and technology in many activities. About 20 percent of papers published by JAEA are concerned with R and D using computational science, the supercomputer system of JAEA has become an important infrastructure to support computational science and technology utilization. In FY2013, the system was used not only for JAEA's major projects such as Fast Reactor Cycle System, Fusion R and D and Quantum Beam Science, but also for R and D aiming to restore Fukushima (nuclear plant decommissioning and environmental restoration) as a priority issue. This report presents a great amount of R and D results accomplished by using the system in FY2013, as well as user support, operational records and overviews of the system, and so on. (author)

Summaries of research and development activities by using supercomputer system of JAEA in FY2012. April 1, 2012 - March 31, 2013

International Nuclear Information System (INIS)

2014-01-01

Japan Atomic Energy Agency (JAEA) conducts research and development (R and D) in various fields related to nuclear power as a comprehensive institution of nuclear energy R and Ds, and utilizes computational science and technology in many activities. As more than 20 percent of papers published by JAEA are concerned with R and D using computational science, the supercomputer system of JAEA has become an important infrastructure to support computational science and technology utilization. In FY2012, the system was used not only for JAEA's major projects such as Fast Reactor Cycle System, Fusion R and D and Quantum Beam Science, but also for R and D aiming to restore Fukushima (nuclear plant decommissioning and environmental restoration) as apriority issue. This report presents a great amount of R and D results accomplished by using the system in FY2012, as well as user support, operational records and overviews of the system, and so on. (author)

Summaries of research and development activities by using supercomputer system of JAEA in FY2011. April 1, 2011 - March 31, 2012

International Nuclear Information System (INIS)

2013-01-01

Japan Atomic Energy Agency (JAEA) conducts research and development (R and D) in various fields related to nuclear power as a comprehensive institution of nuclear energy R and Ds, and utilizes computational science and technology in many activities. As more than 20 percent of papers published by JAEA are concerned with R and D using computational science, the supercomputer system of JAEA has become an important infrastructure to support computational science and technology utilization. In FY2011, the system was used for analyses of the accident at the Fukushima Daiichi Nuclear Power Station and establishment of radioactive decontamination plan, as well as the JAEA's major projects such as Fast Reactor Cycle System, Fusion R and D and Quantum Beam Science. This report presents a great amount of R and D results accomplished by using the system in FY2011, as well as user support structure, operational records and overviews of the system, and so on. (author)

Outline of computer application in PNC

International Nuclear Information System (INIS)

Aoki, Minoru

1990-01-01

Computer application systems are an important resource for the R and D (research and development) in PNC. Various types of computer systems are widely used on the R and D of experiment, evaluation and analysis, plant operation and other jobs in PNC. Currently, the computer centers in PNC have been established in Oarai engineering Center and Tokai Works. The former uses a large scale digital computer and supercomputer systems. The latter uses only a large scale digital computer system. These computer systems have joined in the PNC Information Network that connects between Head Office and Branches, Oarai, Tokai, Ningyotoge and Fugen, by means of super digital circuit. In the near future, the computer centers will be brought together in order to raise up efficiency of operation of the computer systems. New computer center called 'Information Center' is under construction in Oarai Engineering Center. (author)

Playing with the internet through world wide web

International Nuclear Information System (INIS)

Kim, Seon Tae; Jang, Jin Seok

1995-07-01

This book describes how to use the internet with world wide web. It is divided into six chapters, which are Let's go to the internet ocean, the internet in information superhighway are, connecting the world with a telephone wire such as link with the internet cable and telephone modem, internet service providers, text mode connection, Domain and IP address, the principle and use of world wide web ; business, music, fashion, movie and photo, internet news and e-mail, making internet map with web language, and from installation to application of base program such as TCP/IP, SLIP/PPP 3270 Emulator, Finger and NCSA Mosaic.

Advances in petascale kinetic plasma simulation with VPIC and Roadrunner

Energy Technology Data Exchange (ETDEWEB)

Bowers, Kevin J [Los Alamos National Laboratory; Albright, Brian J [Los Alamos National Laboratory; Yin, Lin [Los Alamos National Laboratory; Daughton, William S [Los Alamos National Laboratory; Roytershteyn, Vadim [Los Alamos National Laboratory; Kwan, Thomas J T [Los Alamos National Laboratory

2009-01-01

VPIC, a first-principles 3d electromagnetic charge-conserving relativistic kinetic particle-in-cell (PIC) code, was recently adapted to run on Los Alamos's Roadrunner, the first supercomputer to break a petaflop (10{sup 15} floating point operations per second) in the TOP500 supercomputer performance rankings. They give a brief overview of the modeling capabilities and optimization techniques used in VPIC and the computational characteristics of petascale supercomputers like Roadrunner. They then discuss three applications enabled by VPIC's unprecedented performance on Roadrunner: modeling laser plasma interaction in upcoming inertial confinement fusion experiments at the National Ignition Facility (NIF), modeling short pulse laser GeV ion acceleration and modeling reconnection in magnetic confinement fusion experiments.

An Application-Based Performance Evaluation of NASAs Nebula Cloud Computing Platform

Science.gov (United States)

Saini, Subhash; Heistand, Steve; Jin, Haoqiang; Chang, Johnny; Hood, Robert T.; Mehrotra, Piyush; Biswas, Rupak

2012-01-01

The high performance computing (HPC) community has shown tremendous interest in exploring cloud computing as it promises high potential. In this paper, we examine the feasibility, performance, and scalability of production quality scientific and engineering applications of interest to NASA on NASA's cloud computing platform, called Nebula, hosted at Ames Research Center. This work represents the comprehensive evaluation of Nebula using NUTTCP, HPCC, NPB, I/O, and MPI function benchmarks as well as four applications representative of the NASA HPC workload. Specifically, we compare Nebula performance on some of these benchmarks and applications to that of NASA s Pleiades supercomputer, a traditional HPC system. We also investigate the impact of virtIO and jumbo frames on interconnect performance. Overall results indicate that on Nebula (i) virtIO and jumbo frames improve network bandwidth by a factor of 5x, (ii) there is a significant virtualization layer overhead of about 10% to 25%, (iii) write performance is lower by a factor of 25x, (iv) latency for short MPI messages is very high, and (v) overall performance is 15% to 48% lower than that on Pleiades for NASA HPC applications. We also comment on the usability of the cloud platform.

Building the Teraflops/Petabytes Production Computing Center

International Nuclear Information System (INIS)

Kramer, William T.C.; Lucas, Don; Simon, Horst D.

1999-01-01

In just one decade, the 1990s, supercomputer centers have undergone two fundamental transitions which require rethinking their operation and their role in high performance computing. The first transition in the early to mid-1990s resulted from a technology change in high performance computing architecture. Highly parallel distributed memory machines built from commodity parts increased the operational complexity of the supercomputer center, and required the introduction of intellectual services as equally important components of the center. The second transition is happening in the late 1990s as centers are introducing loosely coupled clusters of SMPs as their premier high performance computing platforms, while dealing with an ever-increasing volume of data. In addition, increasing network bandwidth enables new modes of use of a supercomputer center, in particular, computational grid applications. In this paper we describe what steps NERSC is taking to address these issues and stay at the leading edge of supercomputing centers.; N

Exascale Data Analysis

CERN Multimedia

CERN. Geneva; Fitch, Blake

2011-01-01

Traditionaly, the primary role of supercomputers was to create data, primarily for simulation applications. Due to usage and technology trends, supercomputers are increasingly also used for data analysis. Some of this data is from simulations, but there is also a rapidly increasingly amount of real-world science and business data to be analyzed. We briefly overview Blue Gene and other current supercomputer architectures. We outline future architectures, up to the Exascale supercomputers expected in the 2020 time frame. We focus on the data analysis challenges and opportunites, especially those concerning Flash and other up-and-coming storage class memory. About the speakers Blake G. Fitch has been with IBM Research, Yorktown Heights, NY since 1987, mainly pursuing interests in parallel systems. He joined the Scalable Parallel Systems Group in 1990, contributing to research and development that culminated in the IBM scalable parallel system (SP*) product. His research interests have focused on applicatio...

High End Computing Technologies for Earth Science Applications: Trends, Challenges, and Innovations

Science.gov (United States)

Parks, John (Technical Monitor); Biswas, Rupak; Yan, Jerry C.; Brooks, Walter F.; Sterling, Thomas L.

2003-01-01

Earth science applications of the future will stress the capabilities of even the highest performance supercomputers in the areas of raw compute power, mass storage management, and software environments. These NASA mission critical problems demand usable multi-petaflops and exabyte-scale systems to fully realize their science goals. With an exciting vision of the technologies needed, NASA has established a comprehensive program of advanced research in computer architecture, software tools, and device technology to ensure that, in partnership with US industry, it can meet these demanding requirements with reliable, cost effective, and usable ultra-scale systems. NASA will exploit, explore, and influence emerging high end computing architectures and technologies to accelerate the next generation of engineering, operations, and discovery processes for NASA Enterprises. This article captures this vision and describes the concepts, accomplishments, and the potential payoff of the key thrusts that will help meet the computational challenges in Earth science applications.

Accelerating Communication-Intensive Applications via Novel Data Compression Techniques, Phase I

Data.gov (United States)

National Aeronautics and Space Administration — Processor speed has traditionally grown at a rate faster than that of communication speed in computer and supercomputer networks, and it is expected that this trend...

Drug- not carrier-dependent haematological and biochemical changes in a repeated dose study of cyclosporine encapsulated polyester nano- and micro-particles: Size does not matter

International Nuclear Information System (INIS)

Venkatpurwar, V.P.; Rhodes, S.; Oien, K.A.; Elliott, M.A.; Tekwe, C.D.; Jørgensen, H.G.; Kumar, M.N.V. Ravi

2015-01-01

Highlights: • The particulate delivery allows an increase in dose range without accrual of toxicities. • The altered haematological and biochemical changes are drug, but not particle dependent. • PLGA nano/microparticles are safe on subacute peroral dosing over 28 days. • Nano-toxicology, drug needs to be considered. - Abstract: Biodegradable nanoparticles are being considered more often as drug carriers to address pharmacokinetic/pharmacodynamic issues, yet nano-product safety has not been systematically proven. In this study, haematological, biochemical and histological parameters were examined on 28 day daily dosing of rats with nano- or micro-particle encapsulated cyclosporine (CsA) to confirm if any changes observed were drug or carrier dependent. CsA encapsulated poly(lactide-co-glycolide) [PLGA] nano- (nCsA) and micro-particles (mCsA) were prepared by emulsion techniques. CsA (15, 30, 45 mg/kg) were administered by oral gavage to Sprague Dawley (SD) rats over 28 days. Haematological and biochemical metrics were followed with tissue histology performed on sacrifice. Whether presented as nCsA or mCsA, 45 mg/kg dose caused significant loss of body weight and lowered food consumption compared to untreated control. Across the doses, both nCsA and mCsA produce significant decreases in lymphocyte numbers compared to controls, commensurate with the proprietary product, Neoral ® 15. Dosing with nCsA showed higher serum drug levels than mCsA presumably owing to the smaller particle size facilitating absorption. The treatment had no noticeable effects on inflammatory/oxidative stress markers or antioxidant enzyme levels, except an increase in ceruloplasmin (CP) levels for high dose nCsA/mCsA group. Further, only subtle, sub-lethal changes were observed in histology of nCsA/mCsA treated rat organs. Blank (drug-free) particles did not induce changes in the parameters studied. Therefore, it is extremely important that the encapsulated drug in the nano-products is

[Teacher enhancement at Supercomputing `96

Energy Technology Data Exchange (ETDEWEB)

NONE

1998-02-13

The SC`96 Education Program provided a three-day professional development experience for middle and high school science, mathematics, and computer technology teachers. The program theme was Computers at Work in the Classroom, and a majority of the sessions were presented by classroom teachers who have had several years experience in using these technologies with their students. The teachers who attended the program were introduced to classroom applications of computing and networking technologies and were provided to the greatest extent possible with lesson plans, sample problems, and other resources that could immediately be used in their own classrooms. The attached At a Glance Schedule and Session Abstracts describes in detail the three-day SC`96 Education Program. Also included is the SC`96 Education Program evaluation report and the financial report.

Supercomputer debugging workshop '92

Energy Technology Data Exchange (ETDEWEB)

Brown, J.S.

1993-01-01

This report contains papers or viewgraphs on the following topics: The ABCs of Debugging in the 1990s; Cray Computer Corporation; Thinking Machines Corporation; Cray Research, Incorporated; Sun Microsystems, Inc; Kendall Square Research; The Effects of Register Allocation and Instruction Scheduling on Symbolic Debugging; Debugging Optimized Code: Currency Determination with Data Flow; A Debugging Tool for Parallel and Distributed Programs; Analyzing Traces of Parallel Programs Containing Semaphore Synchronization; Compile-time Support for Efficient Data Race Detection in Shared-Memory Parallel Programs; Direct Manipulation Techniques for Parallel Debuggers; Transparent Observation of XENOOPS Objects; A Parallel Software Monitor for Debugging and Performance Tools on Distributed Memory Multicomputers; Profiling Performance of Inter-Processor Communications in an iWarp Torus; The Application of Code Instrumentation Technology in the Los Alamos Debugger; and CXdb: The Road to Remote Debugging.

Scalability of DL_POLY on High Performance Computing Platform

CSIR Research Space (South Africa)

Mabakane, Mabule S

2017-12-01

Full Text Available stream_source_info Mabakanea_19979_2017.pdf.txt stream_content_type text/plain stream_size 33716 Content-Encoding UTF-8 stream_name Mabakanea_19979_2017.pdf.txt Content-Type text/plain; charset=UTF-8 SACJ 29(3) December... when using many processors within the compute nodes of the supercomputer. The type of the processors of compute nodes and their memory also play an important role in the overall performance of the parallel application running on a supercomputer. DL...

Speeding up predictive electromagnetic simulations for ITER application

International Nuclear Information System (INIS)

Alekseev, A.B.; Amoskov, V.M.; Bazarov, A.M.; Belov, A.V.; Belyakov, V.A.; Gapionok, E.I.; Gornikel, I.V.; Gribov, Yu. V.; Kukhtin, V.P.; Lamzin, E.A.; Sytchevsky, S.E.

2017-01-01

Highlights: • A general concept of engineering EM simulator for tokamak application is proposed. • An algorithm is based on influence functions and superposition principle. • The software works with extensive databases and offers parallel processing. • The simulator allows us to obtain the solution hundreds times faster. - Abstract: The paper presents an attempt to proceed to a general concept of software environment for fast and consistent multi-task simulation of EM transients (engineering simulator for tokamak applications). As an example, the ITER tokamak is taken to introduce a computational technique. The strategy exploits parallel processing with optimized simulation algorithms based on using of influence functions and superposition principle to take full advantage of parallelism. The software has been tested on a multi-core supercomputer. The results were compared with data obtained in TYPHOON computations. A discrepancy was found to be below 0.4%. The computation cost for the simulator is proportional to the number of observation points. An average computation time with the simulator is found to be by hundreds times less than the time required to solve numerically a relevant system of differential equations for known software tools.

Speeding up predictive electromagnetic simulations for ITER application

Energy Technology Data Exchange (ETDEWEB)

Alekseev, A.B. [ITER Organization, Route de Vinon sur Verdon, 13067 St. Paul Lez Durance Cedex (France); Amoskov, V.M. [JSC “NIIEFA”, Doroga na Metallostroy 3, St. Petersburg, 196641 (Russian Federation); Bazarov, A.M., E-mail: alexander.bazarov@gmail.com [JSC “NIIEFA”, Doroga na Metallostroy 3, St. Petersburg, 196641 (Russian Federation); Belov, A.V. [JSC “NIIEFA”, Doroga na Metallostroy 3, St. Petersburg, 196641 (Russian Federation); Belyakov, V.A. [JSC “NIIEFA”, Doroga na Metallostroy 3, St. Petersburg, 196641 (Russian Federation); St. Petersburg State University, 7/9 Universitetskaya Embankment, St. Petersburg, 199034 (Russian Federation); Gapionok, E.I. [JSC “NIIEFA”, Doroga na Metallostroy 3, St. Petersburg, 196641 (Russian Federation); Gornikel, I.V. [Alphysica GmbH, Unterreut, 6, D-76135, Karlsruhe (Germany); Gribov, Yu. V. [ITER Organization, Route de Vinon sur Verdon, 13067 St. Paul Lez Durance Cedex (France); Kukhtin, V.P.; Lamzin, E.A. [JSC “NIIEFA”, Doroga na Metallostroy 3, St. Petersburg, 196641 (Russian Federation); Sytchevsky, S.E. [JSC “NIIEFA”, Doroga na Metallostroy 3, St. Petersburg, 196641 (Russian Federation); St. Petersburg State University, 7/9 Universitetskaya Embankment, St. Petersburg, 199034 (Russian Federation)

2017-05-15

Highlights: • A general concept of engineering EM simulator for tokamak application is proposed. • An algorithm is based on influence functions and superposition principle. • The software works with extensive databases and offers parallel processing. • The simulator allows us to obtain the solution hundreds times faster. - Abstract: The paper presents an attempt to proceed to a general concept of software environment for fast and consistent multi-task simulation of EM transients (engineering simulator for tokamak applications). As an example, the ITER tokamak is taken to introduce a computational technique. The strategy exploits parallel processing with optimized simulation algorithms based on using of influence functions and superposition principle to take full advantage of parallelism. The software has been tested on a multi-core supercomputer. The results were compared with data obtained in TYPHOON computations. A discrepancy was found to be below 0.4%. The computation cost for the simulator is proportional to the number of observation points. An average computation time with the simulator is found to be by hundreds times less than the time required to solve numerically a relevant system of differential equations for known software tools.

C Versus Fortran-77 for Scientific Programming

Directory of Open Access Journals (Sweden)

Tom MacDonald

1992-01-01

Full Text Available The predominant programming language for numeric and scientific applications is Fortran-77 and supercomputers are primarily used to run large-scale numeric and scientific applications. Standard C* is not widely used for numerical and scientific programming, yet Standard C provides many desirable linguistic features not present in Fortran-77. Furthermore, the existence of a standard library and preprocessor eliminates the worst portability problems. A comparison of Standard C and Fortran-77 shows several key deficiencies in C that reduce its ability to adequately solve some numerical problems. Some of these problems have already been addressed by the C standard but others remain. Standard C with a few extensions and modifications could be suitable for all numerical applications and could become more popular in supercomputing environments.

Integrating Visualization Applications, such as ParaView, into HEP Software Frameworks for In-situ Event Displays

Science.gov (United States)

Lyon, A. L.; Kowalkowski, J. B.; Jones, C. D.

2017-10-01

ParaView is a high performance visualization application not widely used in High Energy Physics (HEP). It is a long standing open source project led by Kitware and involves several Department of Energy (DOE) and Department of Defense (DOD) laboratories. Futhermore, it has been adopted by many DOE supercomputing centers and other sites. ParaView is unique in speed and efficiency by using state-of-the-art techniques developed by the academic visualization community that are often not found in applications written by the HEP community. In-situ visualization of events, where event details are visualized during processing/analysis, is a common task for experiment software frameworks. Kitware supplies Catalyst, a library that enables scientific software to serve visualization objects to client ParaView viewers yielding a real-time event display. Connecting ParaView to the Fermilab art framework will be described and the capabilities it brings discussed.

Integrating Visualization Applications, such as ParaView, into HEP Software Frameworks for In-situ Event Displays

Energy Technology Data Exchange (ETDEWEB)

Lyon, A. L. [Fermilab; Kowalkowski, J. B. [Fermilab; Jones, C. D. [Fermilab

2017-11-22

ParaView is a high performance visualization application not widely used in High Energy Physics (HEP). It is a long standing open source project led by Kitware and involves several Department of Energy (DOE) and Department of Defense (DOD) laboratories. Futhermore, it has been adopted by many DOE supercomputing centers and other sites. ParaView is unique in speed and efficiency by using state-of-the-art techniques developed by the academic visualization community that are often not found in applications written by the HEP community. In-situ visualization of events, where event details are visualized during processing/analysis, is a common task for experiment software frameworks. Kitware supplies Catalyst, a library that enables scientific software to serve visualization objects to client ParaView viewers yielding a real-time event display. Connecting ParaView to the Fermilab art framework will be described and the capabilities it brings discussed.

Validation of the GPU-Accelerated CFD Solver ELBE for Free Surface Flow Problems in Civil and Environmental Engineering

Directory of Open Access Journals (Sweden)

Christian F. Janßen

2015-07-01

Full Text Available This contribution is dedicated to demonstrating the high potential and manifold applications of state-of-the-art computational fluid dynamics (CFD tools for free-surface flows in civil and environmental engineering. All simulations were performed with the academic research code ELBE (efficient lattice boltzmann environment, http://www.tuhh.de/elbe. The ELBE code follows the supercomputing-on-the-desktop paradigm and is especially designed for local supercomputing, without tedious accesses to supercomputers. ELBE uses graphics processing units (GPU to accelerate the computations and can be used in a single GPU-equipped workstation of, e.g., a design engineer. The code has been successfully validated in very different fields, mostly related to naval architecture and mechanical engineering. In this contribution, we give an overview of past and present applications with practical relevance for civil engineers. The presented applications are grouped into three major categories: (i tsunami simulations, considering wave propagation, wave runup, inundation and debris flows; (ii dam break simulations; and (iii numerical wave tanks for the calculation of hydrodynamic loads on fixed and moving bodies. This broad range of applications in combination with accurate numerical results and very competitive times to solution demonstrates that modern CFD tools in general, and the ELBE code in particular, can be a helpful design tool for civil and environmental engineers.

Predicting multiprocessing efficiency on the Cray multiprocessors in a (CTSS) time-sharing environment/application to a 3-D magnetohydrodynamics code

International Nuclear Information System (INIS)

Mirin, A.A.

1988-01-01

A formula is derived for predicting multiprocessing efficiency on Cray supercomputers equipped with the Cray Time-Sharing System (CTSS). The model is applicable to an intensive time-sharing environment. The actual efficiency estimate depends on three factors: the code size, task length, and job mix. The implementation of multitasking in a three-dimensional plasma magnetohydrodynamics (MHD) code, TEMCO, is discussed. TEMCO solves the primitive one-fluid compressible MHD equations and includes resistive and Hall effects in Ohm's law. Virtually all segments of the main time-integration loop are multitasked. The multiprocessing efficiency model is applied to TEMCO. Excellent agreement is obtained between the actual multiprocessing efficiency and the theoretical prediction

Power and thermal efficient numerical processing

DEFF Research Database (Denmark)

Liu, Wei; Nannarelli, Alberto

2015-01-01

Numerical processing is at the core of applications in many areas ranging from scientific and engineering calculations to financial computing. These applications are usually executed on large servers or supercomputers to exploit their high speed, high level of parallelism and high bandwidth...

The ASCI Network for SC '99: A Step on the Path to a 100 Gigabit Per Second Supercomputing Network

Energy Technology Data Exchange (ETDEWEB)

PRATT,THOMAS J.; TARMAN,THOMAS D.; MARTINEZ,LUIS M.; MILLER,MARC M.; ADAMS,ROGER L.; CHEN,HELEN Y.; BRANDT,JAMES M.; WYCKOFF,PETER S.

2000-07-24

This document highlights the Discom{sup 2}'s Distance computing and communication team activities at the 1999 Supercomputing conference in Portland, Oregon. This conference is sponsored by the IEEE and ACM. Sandia, Lawrence Livermore and Los Alamos National laboratories have participated in this conference for eleven years. For the last four years the three laboratories have come together at the conference under the DOE's ASCI, Accelerated Strategic Computing Initiatives rubric. Communication support for the ASCI exhibit is provided by the ASCI DISCOM{sup 2} project. The DISCOM{sup 2} communication team uses this forum to demonstrate and focus communication and networking developments within the community. At SC 99, DISCOM built a prototype of the next generation ASCI network demonstrated remote clustering techniques, demonstrated the capabilities of the emerging Terabit Routers products, demonstrated the latest technologies for delivering visualization data to the scientific users, and demonstrated the latest in encryption methods including IP VPN technologies and ATM encryption research. The authors also coordinated the other production networking activities within the booth and between their demonstration partners on the exhibit floor. This paper documents those accomplishments, discusses the details of their implementation, and describes how these demonstrations support Sandia's overall strategies in ASCI networking.

Framework Application for Core Edge Transport Simulation (FACETS)

Energy Technology Data Exchange (ETDEWEB)

Malony, Allen D; Shende, Sameer S; Huck, Kevin A; Mr. Alan Morris, and Mr. Wyatt Spear

2012-03-14

The goal of the FACETS project (Framework Application for Core-Edge Transport Simulations) was to provide a multiphysics, parallel framework application (FACETS) that will enable whole-device modeling for the U.S. fusion program, to provide the modeling infrastructure needed for ITER, the next step fusion confinement device. Through use of modern computational methods, including component technology and object oriented design, FACETS is able to switch from one model to another for a given aspect of the physics in a flexible manner. This enables use of simplified models for rapid turnaround or high-fidelity models that can take advantage of the largest supercomputer hardware. FACETS does so in a heterogeneous parallel context, where different parts of the application execute in parallel by utilizing task farming, domain decomposition, and/or pipelining as needed and applicable. ParaTools, Inc. was tasked with supporting the performance analysis and tuning of the FACETS components and framework in order to achieve the parallel scaling goals of the project. The TAU Performance System® was used for instrumentation, measurement, archiving, and profile / tracing analysis. ParaTools, Inc. also assisted in FACETS performance engineering efforts. Through the use of the TAU Performance System, ParaTools provided instrumentation, measurement, analysis and archival support for the FACETS project. Performance optimization of key components has yielded significant performance speedups. TAU was integrated into the FACETS build for both the full coupled application and the UEDGE component. The performance database provided archival storage of the performance regression testing data generated by the project, and helped to track improvements in the software development.

A Scheduling-Based Framework for Efficient Massively Parallel Execution, Phase I

Data.gov (United States)

National Aeronautics and Space Administration — The barrier to entry creating efficient, scalable applications for heterogeneous supercomputing environments is too high. EM Photonics has found that the majority of...

Numerical simulation of breakup and detachment of an axially ...

Indian Academy of Sciences (India)

Kishore Singh Patel

printing and lubrication for industrial application, colouring of fibres, wall coating for ...... Technology (DSTO 1329) and Supercomputing Education and Research ... mented technique for 3d moving boundary computations. J. Comput. Phys.

Algorithm comparison and benchmarking using a parallel spectra transform shallow water model

Energy Technology Data Exchange (ETDEWEB)

Worley, P.H. [Oak Ridge National Lab., TN (United States); Foster, I.T.; Toonen, B. [Argonne National Lab., IL (United States)

1995-04-01

In recent years, a number of computer vendors have produced supercomputers based on a massively parallel processing (MPP) architecture. These computers have been shown to be competitive in performance with conventional vector supercomputers for some applications. As spectral weather and climate models are heavy users of vector supercomputers, it is interesting to determine how these models perform on MPPS, and which MPPs are best suited to the execution of spectral models. The benchmarking of MPPs is complicated by the fact that different algorithms may be more efficient on different architectures. Hence, a comprehensive benchmarking effort must answer two related questions: which algorithm is most efficient on each computer and how do the most efficient algorithms compare on different computers. In general, these are difficult questions to answer because of the high cost associated with implementing and evaluating a range of different parallel algorithms on each MPP platform.

76 FR 20243 - Retired and Senior Volunteer Program Amendments

Science.gov (United States)

2011-04-12

... Service (Corporation) by amending the National and Community Service Act of 1990 (NCSA) and the Domestic Volunteer Service Act of 1973 (DVSA). The Serve America Act amended the DVSA by requiring the Corporation to... Flexibility Act As required by the Regulatory Flexibility Act of 1980, 5 U.S.C. 605 (b), the Corporation...

77 FR 60922 - Criminal History Check Requirements for AmeriCorps State/National, Senior Companions, Foster...

Science.gov (United States)

2012-10-05

... prohibited individuals convicted of murder from serving in covered positions. The SAA also required that... Positions (Sec. 2522.200) The SAA amended the NCSA to prohibit an individual convicted of murder, as defined... individuals convicted of murder, as defined under 18 U.S.C. 1111, from serving in a covered position. Congress...

Web interface for plasma analysis codes

Energy Technology Data Exchange (ETDEWEB)

Emoto, M. [National Institute for Fusion Science, 322-6 Oroshi, Toki, Gifu 509-5292 (Japan)], E-mail: emo@nifs.ac.jp; Murakami, S. [Kyoto University, Yoshida-Honmachi, Sakyo-ku, Kyoto 606-8501 (Japan); Yoshida, M.; Funaba, H.; Nagayama, Y. [National Institute for Fusion Science, 322-6 Oroshi, Toki, Gifu 509-5292 (Japan)

2008-04-15

There are many analysis codes that analyze various aspects of plasma physics. However, most of them are FORTRAN programs that are written to be run in supercomputers. On the other hand, many scientists use GUI (graphical user interface)-based operating systems. For those who are not familiar with supercomputers, it is a difficult task to run analysis codes in supercomputers, and they often hesitate to use these programs to substantiate their ideas. Furthermore, these analysis codes are written for personal use, and the programmers do not expect these programs to be run by other users. In order to make these programs to be widely used by many users, the authors developed user-friendly interfaces using a Web interface. Since the Web browser is one of the most common applications, it is useful for both the users and developers. In order to realize interactive Web interface, AJAX technique is widely used, and the authors also adopted AJAX. To build such an AJAX based Web system, Ruby on Rails plays an important role in this system. Since this application framework, which is written in Ruby, abstracts the Web interfaces necessary to implement AJAX and database functions, it enables the programmers to efficiently develop the Web-based application. In this paper, the authors will introduce the system and demonstrate the usefulness of this approach.

Web interface for plasma analysis codes

International Nuclear Information System (INIS)

Emoto, M.; Murakami, S.; Yoshida, M.; Funaba, H.; Nagayama, Y.

2008-01-01

There are many analysis codes that analyze various aspects of plasma physics. However, most of them are FORTRAN programs that are written to be run in supercomputers. On the other hand, many scientists use GUI (graphical user interface)-based operating systems. For those who are not familiar with supercomputers, it is a difficult task to run analysis codes in supercomputers, and they often hesitate to use these programs to substantiate their ideas. Furthermore, these analysis codes are written for personal use, and the programmers do not expect these programs to be run by other users. In order to make these programs to be widely used by many users, the authors developed user-friendly interfaces using a Web interface. Since the Web browser is one of the most common applications, it is useful for both the users and developers. In order to realize interactive Web interface, AJAX technique is widely used, and the authors also adopted AJAX. To build such an AJAX based Web system, Ruby on Rails plays an important role in this system. Since this application framework, which is written in Ruby, abstracts the Web interfaces necessary to implement AJAX and database functions, it enables the programmers to efficiently develop the Web-based application. In this paper, the authors will introduce the system and demonstrate the usefulness of this approach

Grid Computing

Indian Academy of Sciences (India)

IAS Admin

emergence of supercomputers led to the use of computer simula- tion as an .... Scientific and engineering applications (e.g., Tera grid secure gate way). Collaborative ... Encryption, privacy, protection from malicious software. Physical Layer.

A visualization environment for supercomputing-based applications in computational mechanics

Energy Technology Data Exchange (ETDEWEB)

Pavlakos, C.J.; Schoof, L.A.; Mareda, J.F.

1993-06-01

In this paper, we characterize a visualization environment that has been designed and prototyped for a large community of scientists and engineers, with an emphasis in superconducting-based computational mechanics. The proposed environment makes use of a visualization server concept to provide effective, interactive visualization to the user`s desktop. Benefits of using the visualization server approach are discussed. Some thoughts regarding desirable features for visualization server hardware architectures are also addressed. A brief discussion of the software environment is included. The paper concludes by summarizing certain observations which we have made regarding the implementation of such visualization environments.

The Terra Data Fusion Project: An Update

Science.gov (United States)

Di Girolamo, L.; Bansal, S.; Butler, M.; Fu, D.; Gao, Y.; Lee, H. J.; Liu, Y.; Lo, Y. L.; Raila, D.; Turner, K.; Towns, J.; Wang, S. W.; Yang, K.; Zhao, G.

2017-12-01

Terra is the flagship of NASA's Earth Observing System. Launched in 1999, Terra's five instruments continue to gather data that enable scientists to address fundamental Earth science questions. By design, the strength of the Terra mission has always been rooted in its five instruments and the ability to fuse the instrument data together for obtaining greater quality of information for Earth Science compared to individual instruments alone. As the data volume grows and the central Earth Science questions move towards problems requiring decadal-scale data records, the need for data fusion and the ability for scientists to perform large-scale analytics with long records have never been greater. The challenge is particularly acute for Terra, given its growing volume of data (> 1 petabyte), the storage of different instrument data at different archive centers, the different file formats and projection systems employed for different instrument data, and the inadequate cyberinfrastructure for scientists to access and process whole-mission fusion data (including Level 1 data). Sharing newly derived Terra products with the rest of the world also poses challenges. As such, the Terra Data Fusion Project aims to resolve two long-standing problems: 1) How do we efficiently generate and deliver Terra data fusion products? 2) How do we facilitate the use of Terra data fusion products by the community in generating new products and knowledge through national computing facilities, and disseminate these new products and knowledge through national data sharing services? Here, we will provide an update on significant progress made in addressing these problems by working with NASA and leveraging national facilities managed by the National Center for Supercomputing Applications (NCSA). The problems that we faced in deriving and delivering Terra L1B2 basic, reprojected and cloud-element fusion products, such as data transfer, data fusion, processing on different computer architectures

ExM:System Support for Extreme-Scale, Many-Task Applications

Energy Technology Data Exchange (ETDEWEB)

Katz, Daniel S

2011-05-31

The ever-increasing power of supercomputer systems is both driving and enabling the emergence of new problem-solving methods that require the effi cient execution of many concurrent and interacting tasks. Methodologies such as rational design (e.g., in materials science), uncertainty quanti fication (e.g., in engineering), parameter estimation (e.g., for chemical and nuclear potential functions, and in economic energy systems modeling), massive dynamic graph pruning (e.g., in phylogenetic searches), Monte-Carlo- based iterative fi xing (e.g., in protein structure prediction), and inverse modeling (e.g., in reservoir simulation) all have these requirements. These many-task applications frequently have aggregate computing needs that demand the fastest computers. For example, proposed next-generation climate model ensemble studies will involve 1,000 or more runs, each requiring 10,000 cores for a week, to characterize model sensitivity to initial condition and parameter uncertainty. The goal of the ExM project is to achieve the technical advances required to execute such many-task applications efficiently, reliably, and easily on petascale and exascale computers. In this way, we will open up extreme-scale computing to new problem solving methods and application classes. In this document, we report on combined technical progress of the collaborative ExM project, and the institutional financial status of the portion of the project at University of Chicago, over the rst 8 months (through April 30, 2011)

Visualization of numerically simulated aerodynamic flow fields

International Nuclear Information System (INIS)

Hian, Q.L.; Damodaran, M.

1991-01-01

The focus of this paper is to describe the development and the application of an interactive integrated software to visualize numerically simulated aerodynamic flow fields so as to enable the practitioner of computational fluid dynamics to diagnose the numerical simulation and to elucidate essential flow physics from the simulation. The input to the software is the numerical database crunched by a supercomputer and typically consists of flow variables and computational grid geometry. This flow visualization system (FVS), written in C language is targetted at the Personal IRIS Workstations. In order to demonstrate the various visualization modules, the paper also describes the application of this software to visualize two- and three-dimensional flow fields past aerodynamic configurations which have been numerically simulated on the NEC-SXIA Supercomputer. 6 refs

Automatic Energy Schemes for High Performance Applications

Energy Technology Data Exchange (ETDEWEB)

Sundriyal, Vaibhav [Iowa State Univ., Ames, IA (United States)

2013-01-01

Although high-performance computing traditionally focuses on the efficient execution of large-scale applications, both energy and power have become critical concerns when approaching exascale. Drastic increases in the power consumption of supercomputers affect significantly their operating costs and failure rates. In modern microprocessor architectures, equipped with dynamic voltage and frequency scaling (DVFS) and CPU clock modulation (throttling), the power consumption may be controlled in software. Additionally, network interconnect, such as Infiniband, may be exploited to maximize energy savings while the application performance loss and frequency switching overheads must be carefully balanced. This work first studies two important collective communication operations, all-to-all and allgather and proposes energy saving strategies on the per-call basis. Next, it targets point-to-point communications to group them into phases and apply frequency scaling to them to save energy by exploiting the architectural and communication stalls. Finally, it proposes an automatic runtime system which combines both collective and point-to-point communications into phases, and applies throttling to them apart from DVFS to maximize energy savings. The experimental results are presented for NAS parallel benchmark problems as well as for the realistic parallel electronic structure calculations performed by the widely used quantum chemistry package GAMESS. Close to the maximum energy savings were obtained with a substantially low performance loss on the given platform.

Mapping PetaSHA Applications to TeraGrid Architectures

Science.gov (United States)

Cui, Y.; Moore, R.; Olsen, K.; Zhu, J.; Dalguer, L. A.; Day, S.; Cruz-Atienza, V.; Maechling, P.; Jordan, T.

2007-12-01

The Southern California Earthquake Center (SCEC) has a science program in developing an integrated cyberfacility - PetaSHA - for executing physics-based seismic hazard analysis (SHA) computations. The NSF has awarded PetaSHA 15 million allocation service units this year on the fastest supercomputers available within the NSF TeraGrid. However, one size does not fit all, a range of systems are needed to support this effort at different stages of the simulations. Enabling PetaSHA simulations on those TeraGrid architectures to solve both dynamic rupture and seismic wave propagation have been a challenge from both hardware and software levels. This is an adaptation procedure to meet specific requirements of each architecture. It is important to determine how fundamental system attributes affect application performance. We present an adaptive approach in our PetaSHA application that enables the simultaneous optimization of both computation and communication at run-time using flexible settings. These techniques optimize initialization, source/media partition and MPI-IO output in different ways to achieve optimal performance on the target machines. The resulting code is a factor of four faster than the orignial version. New MPI-I/O capabilities have been added for the accurate Staggered-Grid Split-Node (SGSN) method for dynamic rupture propagation in the velocity-stress staggered-grid finite difference scheme (Dalguer and Day, JGR, 2007), We use execution workflow across TeraGrid sites for managing the resulting data volumes. Our lessons learned indicate that minimizing time to solution is most critical, in particular when scheduling large scale simulations across supercomputer sites. The TeraShake platform has been ported to multiple architectures including TACC Dell lonestar and Abe, Cray XT3 Bigben and Blue Gene/L. Parallel efficiency of 96% with the PetaSHA application Olsen-AWM has been demonstrated on 40,960 Blue Gene/L processors at IBM TJ Watson Center. Notable

Data Service: Distributed Data Capture and Replication

Science.gov (United States)

Warner, P. B.; Pietrowicz, S. R.

2007-10-01

Data Service is a critical component of the NOAO Data Management and Science Support (DMaSS) Solutions Platform, which is based on a service-oriented architecture, and is to replace the current NOAO Data Transport System. Its responsibilities include capturing data from NOAO and partner telescopes and instruments and replicating the data across multiple (currently six) storage sites. Java 5 was chosen as the implementation language, and Java EE as the underlying enterprise framework. Application metadata persistence is performed using EJB and Hibernate on the JBoss Application Server, with PostgreSQL as the persistence back-end. Although potentially any underlying mass storage system may be used as the Data Service file persistence technology, DTS deployments and Data Service test deployments currently use the Storage Resource Broker from SDSC. This paper presents an overview and high-level design of the Data Service, including aspects of deployment, e.g., for the LSST Data Challenge at the NCSA computing facilities.

3rd International Conference on Numerical Analysis and Optimization : Theory, Methods, Applications and Technology Transfer

CERN Document Server

Grandinetti, Lucio; Purnama, Anton

2015-01-01

Presenting the latest findings in the field of numerical analysis and optimization, this volume balances pure research with practical applications of the subject. Accompanied by detailed tables, figures, and examinations of useful software tools, this volume will equip the reader to perform detailed and layered analysis of complex datasets. Many real-world complex problems can be formulated as optimization tasks. Such problems can be characterized as large scale, unconstrained, constrained, non-convex, non-differentiable, and discontinuous, and therefore require adequate computational methods, algorithms, and software tools. These same tools are often employed by researchers working in current IT hot topics such as big data, optimization and other complex numerical algorithms on the cloud, devising special techniques for supercomputing systems. The list of topics covered include, but are not limited to: numerical analysis, numerical optimization, numerical linear algebra, numerical differential equations, opt...

Supercomputer modeling of volcanic eruption dynamics

Energy Technology Data Exchange (ETDEWEB)

Kieffer, S.W. [Arizona State Univ., Tempe, AZ (United States); Valentine, G.A. [Los Alamos National Lab., NM (United States); Woo, Mahn-Ling [Arizona State Univ., Tempe, AZ (United States)

1995-06-01

Our specific goals are to: (1) provide a set of models based on well-defined assumptions about initial and boundary conditions to constrain interpretations of observations of active volcanic eruptions--including movies of flow front velocities, satellite observations of temperature in plumes vs. time, and still photographs of the dimensions of erupting plumes and flows on Earth and other planets; (2) to examine the influence of subsurface conditions on exit plane conditions and plume characteristics, and to compare the models of subsurface fluid flow with seismic constraints where possible; (3) to relate equations-of-state for magma-gas mixtures to flow dynamics; (4) to examine, in some detail, the interaction of the flowing fluid with the conduit walls and ground topography through boundary layer theory so that field observations of erosion and deposition can be related to fluid processes; and (5) to test the applicability of existing two-phase flow codes for problems related to the generation of volcanic long-period seismic signals; (6) to extend our understanding and simulation capability to problems associated with emplacement of fragmental ejecta from large meteorite impacts.

Applications of wavelet-based compression to multidimensional earth science data

Energy Technology Data Exchange (ETDEWEB)

Bradley, J.N.; Brislawn, C.M.

1993-01-01

A data compression algorithm involving vector quantization (VQ) and the discrete wavelet transform (DWT) is applied to two different types of multidimensional digital earth-science data. The algorithm (WVQ) is optimized for each particular application through an optimization procedure that assigns VQ parameters to the wavelet transform subbands subject to constraints on compression ratio and encoding complexity. Preliminary results of compressing global ocean model data generated on a Thinking Machines CM-200 supercomputer are presented. The WVQ scheme is used in both a predictive and nonpredictive mode. Parameters generated by the optimization algorithm axe reported, as are signal-to-noise ratio (SNR) measurements of actual quantized data. The problem of extrapolating hydrodynamic variables across the continental landmasses in order to compute the DWT on a rectangular grid is discussed. Results are also presented for compressing Landsat TM 7-band data using the WVQ scheme.The formulation of the optimization problem is presented along with SNR measurements of actual quantized data. Postprocessing applications are considered in which the seven spectral bands are clustered into 256 clusters using a k-means algorithm and analyzed using the Los Alamos multispectral data analysis program, SPECTRUM, both before and after being compressed using the WVQ program.

Applications of wavelet-based compression to multidimensional earth science data

Energy Technology Data Exchange (ETDEWEB)

Bradley, J.N.; Brislawn, C.M.

1993-02-01

A data compression algorithm involving vector quantization (VQ) and the discrete wavelet transform (DWT) is applied to two different types of multidimensional digital earth-science data. The algorithm (WVQ) is optimized for each particular application through an optimization procedure that assigns VQ parameters to the wavelet transform subbands subject to constraints on compression ratio and encoding complexity. Preliminary results of compressing global ocean model data generated on a Thinking Machines CM-200 supercomputer are presented. The WVQ scheme is used in both a predictive and nonpredictive mode. Parameters generated by the optimization algorithm axe reported, as are signal-to-noise ratio (SNR) measurements of actual quantized data. The problem of extrapolating hydrodynamic variables across the continental landmasses in order to compute the DWT on a rectangular grid is discussed. Results are also presented for compressing Landsat TM 7-band data using the WVQ scheme.The formulation of the optimization problem is presented along with SNR measurements of actual quantized data. Postprocessing applications are considered in which the seven spectral bands are clustered into 256 clusters using a k-means algorithm and analyzed using the Los Alamos multispectral data analysis program, SPECTRUM, both before and after being compressed using the WVQ program.

CERN LHC events simulated using NCSA, TeraGrid systems

CERN Multimedia

2006-01-01

"A team of physicists at the California Institute of Technology and the university of California, San Diego, is on the hunt for the Higgs boson, the subatomic particle thought to be responsible for mass."(1/2 page)

Summary of multi-core hardware and programming model investigations

Energy Technology Data Exchange (ETDEWEB)

Kelly, Suzanne Marie; Pedretti, Kevin Thomas Tauke; Levenhagen, Michael J.

2008-05-01

This report summarizes our investigations into multi-core processors and programming models for parallel scientific applications. The motivation for this study was to better understand the landscape of multi-core hardware, future trends, and the implications on system software for capability supercomputers. The results of this study are being used as input into the design of a new open-source light-weight kernel operating system being targeted at future capability supercomputers made up of multi-core processors. A goal of this effort is to create an agile system that is able to adapt to and efficiently support whatever multi-core hardware and programming models gain acceptance by the community.

How General-Purpose can a GPU be?

Directory of Open Access Journals (Sweden)

Philip Machanick

2015-12-01

Full Text Available The use of graphics processing units (GPUs in general-purpose computation (GPGPU is a growing field. GPU instruction sets, while implementing a graphics pipeline, draw from a range of single instruction multiple datastream (SIMD architectures characteristic of the heyday of supercomputers. Yet only one of these SIMD instruction sets has been of application on a wide enough range of problems to survive the era when the full range of supercomputer design variants was being explored: vector instructions. This paper proposes a reconceptualization of the GPU as a multicore design with minimal exotic modes of parallelism so as to make GPGPU truly general.

Parallel Computing and Model Evaluation for Environmental Systems: An Overview of the Supermuse and Frames Software Technologies

Science.gov (United States)

ERD’s Supercomputer for Model Uncertainty and Sensitivity Evaluation (SuperMUSE) is a key to enhancing quality assurance in environmental models and applications. Uncertainty analysis and sensitivity analysis remain critical, though often overlooked steps in the development and e...

A platform independent communication library for distributed computing

NARCIS (Netherlands)

Groen, D.; Rieder, S.; Grosso, P.; de Laat, C.; Portegies Zwart, S.

2010-01-01

We present MPWide, a platform independent communication library for performing message passing between supercomputers. Our library couples several local MPI applications through a long distance network using, for example, optical links. The implementation is deliberately kept light-weight, platform

Performance analysis of multidimensional wavefront algorithms with application to deterministic particle transport

International Nuclear Information System (INIS)

Hoisie, A.; Lubeck, O.; Wasserman, H.

1998-01-01

The authors develop a model for the parallel performance of algorithms that consist of concurrent, two-dimensional wavefronts implemented in a message passing environment. The model, based on a LogGP machine parameterization, combines the separate contributions of computation and communication wavefronts. They validate the model on three important supercomputer systems, on up to 500 processors. They use data from a deterministic particle transport application taken from the ASCI workload, although the model is general to any wavefront algorithm implemented on a 2-D processor domain. They also use the validated model to make estimates of performance and scalability of wavefront algorithms on 100-TFLOPS computer systems expected to be in existence within the next decade as part of the ASCI program and elsewhere. In this context, the authors analyze two problem sizes. Their model shows that on the largest such problem (1 billion cells), inter-processor communication performance is not the bottleneck. Single-node efficiency is the dominant factor

Survey and research on applications of parallel compiler; Heiretsu compiler tekiyorei ni kansuru chosa kenkyu hokokusho

Energy Technology Data Exchange (ETDEWEB)

NONE

2001-03-31

An urgent proposition is made that an advanced computing software program development and maintenance system be set up, and activities are conducted in search of strategies and guidelines for the establishment of such a system. Out of recognition that it is important to develop software programs such as operation systems for supercomputers, a survey is conducted of software technology development strategies especially involving application software programs. It is proposed that efforts be positively exerted to develop strategic software developing programs for advanced computing for concentratedly enhancing the development now under way of strategic software programs. In concrete terms, named as strategic software programs to be developed are a next-generation semiconductor TCAD (technology computer-aided design) system, protein structure/function analysis system, fatigue simulation system, next-generation fluid analysis system, chemical reaction simulator, grid computing, and a nanodevice surface analysis system. (NEDO)

Neighborhood communication paradigm to increase scalability in large-scale dynamic scientific applications

KAUST Repository

Ovcharenko, Aleksandr

2012-03-01

This paper introduces a general-purpose communication package built on top of MPI which is aimed at improving inter-processor communications independently of the supercomputer architecture being considered. The package is developed to support parallel applications that rely on computation characterized by large number of messages of various sizes, often small, that are focused within processor neighborhoods. In some cases, such as solvers having static mesh partitions, the number and size of messages are known a priori. However, in other cases such as mesh adaptation, the messages evolve and vary in number and size and include the dynamic movement of partition objects. The current package provides a utility for dynamic applications based on two key attributes that are: (i) explicit consideration of the neighborhood communication pattern to avoid many-to-many calls and also to reduce the number of collective calls to a minimum, and (ii) use of non-blocking MPI functions along with message packing to manage message flow control and reduce the number and time of communication calls. The test application demonstrated is parallel unstructured mesh adaptation. Results on IBM Blue Gene/P and Cray XE6 computers show that the use of neighborhood-based communication control leads to scalable results when executing generally imbalanced mesh adaptation runs. © 2011 Elsevier B.V. All rights reserved.

Scalable geocomputation: evolving an environmental model building platform from single-core to supercomputers

Science.gov (United States)

Schmitz, Oliver; de Jong, Kor; Karssenberg, Derek

2017-04-01

There is an increasing demand to run environmental models on a big scale: simulations over large areas at high resolution. The heterogeneity of available computing hardware such as multi-core CPUs, GPUs or supercomputer potentially provides significant computing power to fulfil this demand. However, this requires detailed knowledge of the underlying hardware, parallel algorithm design and the implementation thereof in an efficient system programming language. Domain scientists such as hydrologists or ecologists often lack this specific software engineering knowledge, their emphasis is (and should be) on exploratory building and analysis of simulation models. As a result, models constructed by domain specialists mostly do not take full advantage of the available hardware. A promising solution is to separate the model building activity from software engineering by offering domain specialists a model building framework with pre-programmed building blocks that they combine to construct a model. The model building framework, consequently, needs to have built-in capabilities to make full usage of the available hardware. Developing such a framework providing understandable code for domain scientists and being runtime efficient at the same time poses several challenges on developers of such a framework. For example, optimisations can be performed on individual operations or the whole model, or tasks need to be generated for a well-balanced execution without explicitly knowing the complexity of the domain problem provided by the modeller. Ideally, a modelling framework supports the optimal use of available hardware whichsoever combination of model building blocks scientists use. We demonstrate our ongoing work on developing parallel algorithms for spatio-temporal modelling and demonstrate 1) PCRaster, an environmental software framework (http://www.pcraster.eu) providing spatio-temporal model building blocks and 2) parallelisation of about 50 of these building blocks using

Web Technology Conferences Exhibition LEPFest 2000

CERN Multimedia

2000-01-01

1994 CERN,Geneva - First, VRML1994 NCSA,Chicago - Browsers, Mosaic1995 Fraunhofer Gesellschaft,Darmstadt - Java 1995 MIT,Boston - Security1996 INRIA Paris - SMEs;European Union1997 SLAC/Stanford University,California - Acces 1998 Southern Cross University, Australia - Internationalisation1999 University of Toronto,Toronto - XML, e-commerce2000 CWI,Amsterdam - Multimedia,SMIL2001 Universities of Hong Kong,Hong Kong2002 University of Hawaii,Hawaii

First fruits of LAA

International Nuclear Information System (INIS)

Anon.

1988-01-01

The LAA programme is divided into nine specialized areas - high precision tracking, calorimetry, large area devices, leading particle detection, special applications of integrated circuits, data acquisition and analysis, supercomputers and simulation studies, high magnetic fields, and high temperature superconductivity. (orig./HSI).

Wafer-level micro-optics: trends in manufacturing, testing, packaging, and applications

Science.gov (United States)

Voelkel, Reinhard; Gong, Li; Rieck, Juergen; Zheng, Alan

2012-11-01

Micro-optics is an indispensable key enabling technology (KET) for many products and applications today. Probably the most prestigious examples are the diffractive light shaping elements used in high-end DUV lithography steppers. Highly efficient refractive and diffractive micro-optical elements are used for precise beam and pupil shaping. Micro-optics had a major impact on the reduction of aberrations and diffraction effects in projection lithography, allowing a resolution enhancement from 250 nm to 45 nm within the last decade. Micro-optics also plays a decisive role in medical devices (endoscopes, ophthalmology), in all laser-based devices and fiber communication networks (supercomputer, ROADM), bringing high-speed internet to our homes (FTTH). Even our modern smart phones contain a variety of micro-optical elements. For example, LED flashlight shaping elements, the secondary camera, and ambient light and proximity sensors. Wherever light is involved, micro-optics offers the chance to further miniaturize a device, to improve its performance, or to reduce manufacturing and packaging costs. Wafer-scale micro-optics fabrication is based on technology established by semiconductor industry. Thousands of components are fabricated in parallel on a wafer. We report on the state of the art in wafer-based manufacturing, testing, packaging and present examples and applications for micro-optical components and systems.

Performance and scalability analysis of teraflop-scale parallel architectures using multidimensional wavefront applications

International Nuclear Information System (INIS)

Hoisie, A.; Lubeck, O.; Wasserman, H.

1998-01-01

The authors develop a model for the parallel performance of algorithms that consist of concurrent, two-dimensional wavefronts implemented in a message passing environment. The model, based on a LogGP machine parameterization, combines the separate contributions of computation and communication wavefronts. They validate the model on three important supercomputer systems, on up to 500 processors. They use data from a deterministic particle transport application taken from the ASCI workload, although the model is general to any wavefront algorithm implemented on a 2-D processor domain. They also use the validated model to make estimates of performance and scalability of wavefront algorithms on 100-TFLOPS computer systems expected to be in existence within the next decade as part of the ASCI program and elsewhere. In this context, they analyze two problem sizes. The model shows that on the largest such problem (1 billion cells), inter-processor communication performance is not the bottleneck. Single-node efficiency is the dominant factor

Monte Carlo simulations of quantum systems on massively parallel supercomputers

International Nuclear Information System (INIS)

Ding, H.Q.

1993-01-01

A large class of quantum physics applications uses operator representations that are discrete integers by nature. This class includes magnetic properties of solids, interacting bosons modeling superfluids and Cooper pairs in superconductors, and Hubbard models for strongly correlated electrons systems. This kind of application typically uses integer data representations and the resulting algorithms are dominated entirely by integer operations. The authors implemented an efficient algorithm for one such application on the Intel Touchstone Delta and iPSC/860. The algorithm uses a multispin coding technique which allows significant data compactification and efficient vectorization of Monte Carlo updates. The algorithm regularly switches between two data decompositions, corresponding naturally to different Monte Carlo updating processes and observable measurements such that only nearest-neighbor communications are needed within a given decomposition. On 128 nodes of Intel Delta, this algorithm updates 183 million spins per second (compared to 21 million on CM-2 and 6.2 million on a Cray Y-MP). A systematic performance analysis shows a better than 90% efficiency in the parallel implementation

Challenges in scaling NLO generators to leadership computers

Science.gov (United States)

Benjamin, D.; Childers, JT; Hoeche, S.; LeCompte, T.; Uram, T.

2017-10-01

Exascale computing resources are roughly a decade away and will be capable of 100 times more computing than current supercomputers. In the last year, Energy Frontier experiments crossed a milestone of 100 million core-hours used at the Argonne Leadership Computing Facility, Oak Ridge Leadership Computing Facility, and NERSC. The Fortran-based leading-order parton generator called Alpgen was successfully scaled to millions of threads to achieve this level of usage on Mira. Sherpa and MadGraph are next-to-leading order generators used heavily by LHC experiments for simulation. Integration times for high-multiplicity or rare processes can take a week or more on standard Grid machines, even using all 16-cores. We will describe our ongoing work to scale the Sherpa generator to thousands of threads on leadership-class machines and reduce run-times to less than a day. This work allows the experiments to leverage large-scale parallel supercomputers for event generation today, freeing tens of millions of grid hours for other work, and paving the way for future applications (simulation, reconstruction) on these and future supercomputers.

1984 CERN school of computing

International Nuclear Information System (INIS)

1985-01-01

The eighth CERN School of Computing covered subjects mainly related to computing for elementary-particle physics. These proceedings contain written versions of most of the lectures delivered at the School. Notes on the following topics are included: trigger and data-acquisition plans for the LEP experiments; unfolding methods in high-energy physics experiments; Monte Carlo techniques; relational data bases; data networks and open systems; the Newcastle connection; portable operating systems; expert systems; microprocessors - from basic chips to complete systems; algorithms for parallel computers; trends in supercomputers and computational physics; supercomputing and related national projects in Japan; application of VLSI in high-energy physics, and single-user systems. See hints under the relevant topics. (orig./HSI)

Dynamic photonic lightpaths in the StarPlane network

NARCIS (Netherlands)

Grosso, P.; Marchal, D.; Maassen, J.; Bernier, E.; Xu, L.; de Laat, C.

2009-01-01

The StarPlane project enables users to dynamically control network photonic paths. Applications running on the Distributed ASCI Supercomputer (DAS-3) can manipulate wavelengths in the Dutch research and education network SURFnet6. The goal is to achieve fast switching times so that when the

Grassroots Supercomputing

CERN Multimedia

Buchanan, Mark

2005-01-01

What started out as a way for SETI to plow through its piles or radio-signal data from deep space has turned into a powerful research tool as computer users acrosse the globe donate their screen-saver time to projects as diverse as climate-change prediction, gravitational-wave searches, and protein folding (4 pages)

Are Cloud Environments Ready for Scientific Applications?

Science.gov (United States)

Mehrotra, P.; Shackleford, K.

2011-12-01

Cloud computing environments are becoming widely available both in the commercial and government sectors. They provide flexibility to rapidly provision resources in order to meet dynamic and changing computational needs without the customers incurring capital expenses and/or requiring technical expertise. Clouds also provide reliable access to resources even though the end-user may not have in-house expertise for acquiring or operating such resources. Consolidation and pooling in a cloud environment allow organizations to achieve economies of scale in provisioning or procuring computing resources and services. Because of these and other benefits, many businesses and organizations are migrating their business applications (e.g., websites, social media, and business processes) to cloud environments-evidenced by the commercial success of offerings such as the Amazon EC2. In this paper, we focus on the feasibility of utilizing cloud environments for scientific workloads and workflows particularly of interest to NASA scientists and engineers. There is a wide spectrum of such technical computations. These applications range from small workstation-level computations to mid-range computing requiring small clusters to high-performance simulations requiring supercomputing systems with high bandwidth/low latency interconnects. Data-centric applications manage and manipulate large data sets such as satellite observational data and/or data previously produced by high-fidelity modeling and simulation computations. Most of the applications are run in batch mode with static resource requirements. However, there do exist situations that have dynamic demands, particularly ones with public-facing interfaces providing information to the general public, collaborators and partners, as well as to internal NASA users. In the last few months we have been studying the suitability of cloud environments for NASA's technical and scientific workloads. We have ported several applications to

DEISA2: supporting and developing a European high-performance computing ecosystem

International Nuclear Information System (INIS)

Lederer, H

2008-01-01

The DEISA Consortium has deployed and operated the Distributed European Infrastructure for Supercomputing Applications. Through the EU FP7 DEISA2 project (funded for three years as of May 2008), the consortium is continuing to support and enhance the distributed high-performance computing infrastructure and its activities and services relevant for applications enabling, operation, and technologies, as these are indispensable for the effective support of computational sciences for high-performance computing (HPC). The service-provisioning model will be extended from one that supports single projects to one supporting virtual European communities. Collaborative activities will also be carried out with new European and other international initiatives. Of strategic importance is cooperation with the PRACE project, which is preparing for the installation of a limited number of leadership-class Tier-0 supercomputers in Europe. The key role and aim of DEISA will be to deliver a turnkey operational solution for a persistent European HPC ecosystem that will integrate national Tier-1 centers and the new Tier-0 centers

Towards a Scalable and Adaptive Application Support Platform for Large-Scale Distributed E-Sciences in High-Performance Network Environments

Energy Technology Data Exchange (ETDEWEB)

Wu, Chase Qishi [New Jersey Inst. of Technology, Newark, NJ (United States); Univ. of Memphis, TN (United States); Zhu, Michelle Mengxia [Southern Illinois Univ., Carbondale, IL (United States)

2016-06-06

The advent of large-scale collaborative scientific applications has demonstrated the potential for broad scientific communities to pool globally distributed resources to produce unprecedented data acquisition, movement, and analysis. System resources including supercomputers, data repositories, computing facilities, network infrastructures, storage systems, and display devices have been increasingly deployed at national laboratories and academic institutes. These resources are typically shared by large communities of users over Internet or dedicated networks and hence exhibit an inherent dynamic nature in their availability, accessibility, capacity, and stability. Scientific applications using either experimental facilities or computation-based simulations with various physical, chemical, climatic, and biological models feature diverse scientific workflows as simple as linear pipelines or as complex as a directed acyclic graphs, which must be executed and supported over wide-area networks with massively distributed resources. Application users oftentimes need to manually configure their computing tasks over networks in an ad hoc manner, hence significantly limiting the productivity of scientists and constraining the utilization of resources. The success of these large-scale distributed applications requires a highly adaptive and massively scalable workflow platform that provides automated and optimized computing and networking services. This project is to design and develop a generic Scientific Workflow Automation and Management Platform (SWAMP), which contains a web-based user interface specially tailored for a target application, a set of user libraries, and several easy-to-use computing and networking toolkits for application scientists to conveniently assemble, execute, monitor, and control complex computing workflows in heterogeneous high-performance network environments. SWAMP will enable the automation and management of the entire process of scientific

Supercomputer methods for the solution of fundamental problems of particle physics

International Nuclear Information System (INIS)

Moriarty, K.J.M.; Rebbi, C.

1990-01-01

The authors present motivation and methods for computer investigations in particle theory. They illustrate the computational formulation of quantum chromodynamics and selected application to the calculation of hadronic properties. They discuss possible extensions of the methods developed for particle theory to different areas of applications, such as cosmology and solid-state physics, that share common methods. Because of the commonality of methodology, advances in one area stimulate advances in other ares. They also outline future plans of research

I/O Performance Characterization of Lustre and NASA Applications on Pleiades

Science.gov (United States)

Saini, Subhash; Rappleye, Jason; Chang, Johnny; Barker, David Peter; Biswas, Rupak; Mehrotra, Piyush

2012-01-01

In this paper we study the performance of the Lustre file system using five scientific and engineering applications representative of NASA workload on large-scale supercomputing systems such as NASA s Pleiades. In order to facilitate the collection of Lustre performance metrics, we have developed a software tool that exports a wide variety of client and server-side metrics using SGI's Performance Co-Pilot (PCP), and generates a human readable report on key metrics at the end of a batch job. These performance metrics are (a) amount of data read and written, (b) number of files opened and closed, and (c) remote procedure call (RPC) size distribution (4 KB to 1024 KB, in powers of 2) for I/O operations. RPC size distribution measures the efficiency of the Lustre client and can pinpoint problems such as small write sizes, disk fragmentation, etc. These extracted statistics are useful in determining the I/O pattern of the application and can assist in identifying possible improvements for users applications. Information on the number of file operations enables a scientist to optimize the I/O performance of their applications. Amount of I/O data helps users choose the optimal stripe size and stripe count to enhance I/O performance. In this paper, we demonstrate the usefulness of this tool on Pleiades for five production quality NASA scientific and engineering applications. We compare the latency of read and write operations under Lustre to that with NFS by tracing system calls and signals. We also investigate the read and write policies and study the effect of page cache size on I/O operations. We examine the performance impact of Lustre stripe size and stripe count along with performance evaluation of file per process and single shared file accessed by all the processes for NASA workload using parameterized IOR benchmark.

Use of World Wide Web and NCSA Mcsaic at Langley

Science.gov (United States)

Nelson, Michael

1994-01-01

A brief history of the use of the World Wide Web at Langley Research Center is presented along with architecture of the Langley Web. Benefits derived from the Web and some Langley projects that have employed the World Wide Web are discussed.

In Search of the Null: The NCSA 2003 Presidential Address

Directory of Open Access Journals (Sweden)

Beth Davison

2003-10-01

Full Text Available Sociologists usually publish articles where the results show statistically significant differences between two groups of people. Results which show the opposite are generally called 'negative findings,' and are not considered publishable. Davison argues that we really ought to be looking for and encouraging the null finding, especially when social inequality and poverty are the issue. In addition, society as a whole should be working to eliminate poverty and inequality

Application of FEM flow analysis to environmental engineering. FEM ryutai kaiseki no kankyo gijutsu eno tekiyo

Energy Technology Data Exchange (ETDEWEB)

Higuchi, M; Ando, K; Shimada, S; Umetani, H [Toyota Motor Corp., Aichi (Japan)

1990-04-25

In order to apply FEM (finite element method) flow analysis to environmental engineering, the two-dimensional analysis system was developed, and applied to the design of plant ventilation and improvement of an enviromental control equipment. Furthermore, the three-dimensional analysis system was developed to extend its application. Since in a large scale model, no enhancement of a processing capacity was expected even by a supercomputer because of longer I/O times between internal and external memories caused by a small internal memory space, the parallel processing system with multiple external memories was introduced to analyze such models. To achieve more efficient processing, multiple series of renumbering codes were also prepared to optimize the processing order of solvers, elements and nodes. As examples, the improvement of a thermal oxidizer and the ventilation design for a forging plant, and as an example of a three-dimensional large scale model, the flow analysis around a plant were presented. 8 refs., 17 figs., 1 tab.

SiGN-SSM: open source parallel software for estimating gene networks with state space models.

Science.gov (United States)

Tamada, Yoshinori; Yamaguchi, Rui; Imoto, Seiya; Hirose, Osamu; Yoshida, Ryo; Nagasaki, Masao; Miyano, Satoru

2011-04-15

SiGN-SSM is an open-source gene network estimation software able to run in parallel on PCs and massively parallel supercomputers. The software estimates a state space model (SSM), that is a statistical dynamic model suitable for analyzing short time and/or replicated time series gene expression profiles. SiGN-SSM implements a novel parameter constraint effective to stabilize the estimated models. Also, by using a supercomputer, it is able to determine the gene network structure by a statistical permutation test in a practical time. SiGN-SSM is applicable not only to analyzing temporal regulatory dependencies between genes, but also to extracting the differentially regulated genes from time series expression profiles. SiGN-SSM is distributed under GNU Affero General Public Licence (GNU AGPL) version 3 and can be downloaded at http://sign.hgc.jp/signssm/. The pre-compiled binaries for some architectures are available in addition to the source code. The pre-installed binaries are also available on the Human Genome Center supercomputer system. The online manual and the supplementary information of SiGN-SSM is available on our web site. tamada@ims.u-tokyo.ac.jp.

Communication Requirements and Interconnect Optimization forHigh-End Scientific Applications

Energy Technology Data Exchange (ETDEWEB)

Kamil, Shoaib; Oliker, Leonid; Pinar, Ali; Shalf, John

2007-11-12

The path towards realizing peta-scale computing isincreasingly dependent on building supercomputers with unprecedentednumbers of processors. To prevent the interconnect from dominating theoverall cost of these ultra-scale systems, there is a critical need forhigh-performance network solutions whose costs scale linearly with systemsize. This work makes several unique contributions towards attaining thatgoal. First, we conduct one of the broadest studies to date of high-endapplication communication requirements, whose computational methodsinclude: finite-difference, lattice-bolzmann, particle in cell, sparselinear algebra, particle mesh ewald, and FFT-based solvers. Toefficiently collect this data, we use the IPM (Integrated PerformanceMonitoring) profiling layer to gather detailed messaging statistics withminimal impact to code performance. Using the derived communicationcharacterizations, we next present fit-trees interconnects, a novelapproach for designing network infrastructure at a fraction of thecomponent cost of traditional fat-tree solutions. Finally, we propose theHybrid Flexibly Assignable Switch Topology (HFAST) infrastructure, whichuses both passive (circuit) and active (packet) commodity switchcomponents to dynamically reconfigure interconnects to suit thetopological requirements of scientific applications. Overall ourexploration leads to a promising directions for practically addressingthe interconnect requirements of future peta-scale systems.

MaMiCo: Transient multi-instance molecular-continuum flow simulation on supercomputers

Science.gov (United States)

Neumann, Philipp; Bian, Xin

2017-11-01

We present extensions of the macro-micro-coupling tool MaMiCo, which was designed to couple continuum fluid dynamics solvers with discrete particle dynamics. To enable local extraction of smooth flow field quantities especially on rather short time scales, sampling over an ensemble of molecular dynamics simulations is introduced. We provide details on these extensions including the transient coupling algorithm, open boundary forcing, and multi-instance sampling. Furthermore, we validate the coupling in Couette flow using different particle simulation software packages and particle models, i.e. molecular dynamics and dissipative particle dynamics. Finally, we demonstrate the parallel scalability of the molecular-continuum simulations by using up to 65 536 compute cores of the supercomputer Shaheen II located at KAUST. Program Files doi:http://dx.doi.org/10.17632/w7rgdrhb85.1 Licensing provisions: BSD 3-clause Programming language: C, C++ External routines/libraries: For compiling: SCons, MPI (optional) Subprograms used: ESPResSo, LAMMPS, ls1 mardyn, waLBerla For installation procedures of the MaMiCo interfaces, see the README files in the respective code directories located in coupling/interface/impl. Journal reference of previous version: P. Neumann, H. Flohr, R. Arora, P. Jarmatz, N. Tchipev, H.-J. Bungartz. MaMiCo: Software design for parallel molecular-continuum flow simulations, Computer Physics Communications 200: 324-335, 2016 Does the new version supersede the previous version?: Yes. The functionality of the previous version is completely retained in the new version. Nature of problem: Coupled molecular-continuum simulation for multi-resolution fluid dynamics: parts of the domain are resolved by molecular dynamics or another particle-based solver whereas large parts are covered by a mesh-based CFD solver, e.g. a lattice Boltzmann automaton. Solution method: We couple existing MD and CFD solvers via MaMiCo (macro-micro coupling tool). Data exchange and

BDML Metadata: 34 [SSBD[Archive

Lifescience Database Archive (English)

Full Text Available NC-SA 0.150 fc067d15-dced-4b2b-8f66-730af4781702 0.105 x 0.105 x 0.5 (micrometer), 40 (second) http://ssbd.q...2.pdpml0.05.xml http://ssbd.qbic.riken.jp/search/fc067d15-dced-4b2b-8f66-730af4781702/ http://ssbd.qbic.riken.jp/omero/webclient/?show=dataset-17 ...

Efficient Use of Distributed Systems for Scientific Applications

Science.gov (United States)

Taylor, Valerie; Chen, Jian; Canfield, Thomas; Richard, Jacques

2000-01-01

Distributed computing has been regarded as the future of high performance computing. Nationwide high speed networks such as vBNS are becoming widely available to interconnect high-speed computers, virtual environments, scientific instruments and large data sets. One of the major issues to be addressed with distributed systems is the development of computational tools that facilitate the efficient execution of parallel applications on such systems. These tools must exploit the heterogeneous resources (networks and compute nodes) in distributed systems. This paper presents a tool, called PART, which addresses this issue for mesh partitioning. PART takes advantage of the following heterogeneous system features: (1) processor speed; (2) number of processors; (3) local network performance; and (4) wide area network performance. Further, different finite element applications under consideration may have different computational complexities, different communication patterns, and different element types, which also must be taken into consideration when partitioning. PART uses parallel simulated annealing to partition the domain, taking into consideration network and processor heterogeneity. The results of using PART for an explicit finite element application executing on two IBM SPs (located at Argonne National Laboratory and the San Diego Supercomputer Center) indicate an increase in efficiency by up to 36% as compared to METIS, a widely used mesh partitioning tool. The input to METIS was modified to take into consideration heterogeneous processor performance; METIS does not take into consideration heterogeneous networks. The execution times for these applications were reduced by up to 30% as compared to METIS. These results are given in Figure 1 for four irregular meshes with number of elements ranging from 30,269 elements for the Barth5 mesh to 11,451 elements for the Barth4 mesh. Future work with PART entails using the tool with an integrated application requiring

VR system CompleXcope programming guide

International Nuclear Information System (INIS)

Kageyama, Akira; Sato, Tetsuya

1998-09-01

A CAVE virtual reality system CompleXcope is installed in Theory and Computer Center, National Institute for Fusion Science, for the purpose of the interactive analysis/visualization of 3-dimensional complex data of supercomputer simulations. This guide explains how to make a CompleXcope application with Open GL and CAVE library. (author)

Industrial applications of high-performance computing best global practices

CERN Document Server

Osseyran, Anwar

2015-01-01

""This book gives a comprehensive and up-to-date overview of the rapidly expanding field of the industrial use of supercomputers. It is just a pleasure reading through informative country reports and in-depth case studies contributed by leading researchers in the field.""-Jysoo Lee, Principal Researcher, Korea Institute of Science and Technology Information""From telescopes to microscopes, from vacuums to hyperbaric chambers, from sonar waves to laser beams, scientists have perpetually strived to apply technology and invention to new frontiers of scientific advancement. Along the way, they hav

High Performance Molecular Visualization: In-Situ and Parallel Rendering with EGL

Science.gov (United States)

Stone, John E.; Messmer, Peter; Sisneros, Robert; Schulten, Klaus

2016-01-01

Large scale molecular dynamics simulations produce terabytes of data that is impractical to transfer to remote facilities. It is therefore necessary to perform visualization tasks in-situ as the data are generated, or by running interactive remote visualization sessions and batch analyses co-located with direct access to high performance storage systems. A significant challenge for deploying visualization software within clouds, clusters, and supercomputers involves the operating system software required to initialize and manage graphics acceleration hardware. Recently, it has become possible for applications to use the Embedded-system Graphics Library (EGL) to eliminate the requirement for windowing system software on compute nodes, thereby eliminating a significant obstacle to broader use of high performance visualization applications. We outline the potential benefits of this approach in the context of visualization applications used in the cloud, on commodity clusters, and supercomputers. We discuss the implementation of EGL support in VMD, a widely used molecular visualization application, and we outline benefits of the approach for molecular visualization tasks on petascale computers, clouds, and remote visualization servers. We then provide a brief evaluation of the use of EGL in VMD, with tests using developmental graphics drivers on conventional workstations and on Amazon EC2 G2 GPU-accelerated cloud instance types. We expect that the techniques described here will be of broad benefit to many other visualization applications. PMID:27747137

Vector and parallel processors in computational science

International Nuclear Information System (INIS)

Duff, I.S.; Reid, J.K.

1985-01-01

This book presents the papers given at a conference which reviewed the new developments in parallel and vector processing. Topics considered at the conference included hardware (array processors, supercomputers), programming languages, software aids, numerical methods (e.g., Monte Carlo algorithms, iterative methods, finite elements, optimization), and applications (e.g., neutron transport theory, meteorology, image processing)

Computational Approaches to Simulation and Optimization of Global Aircraft Trajectories

Science.gov (United States)

Ng, Hok Kwan; Sridhar, Banavar

2016-01-01

This study examines three possible approaches to improving the speed in generating wind-optimal routes for air traffic at the national or global level. They are: (a) using the resources of a supercomputer, (b) running the computations on multiple commercially available computers and (c) implementing those same algorithms into NASAs Future ATM Concepts Evaluation Tool (FACET) and compares those to a standard implementation run on a single CPU. Wind-optimal aircraft trajectories are computed using global air traffic schedules. The run time and wait time on the supercomputer for trajectory optimization using various numbers of CPUs ranging from 80 to 10,240 units are compared with the total computational time for running the same computation on a single desktop computer and on multiple commercially available computers for potential computational enhancement through parallel processing on the computer clusters. This study also re-implements the trajectory optimization algorithm for further reduction of computational time through algorithm modifications and integrates that with FACET to facilitate the use of the new features which calculate time-optimal routes between worldwide airport pairs in a wind field for use with existing FACET applications. The implementations of trajectory optimization algorithms use MATLAB, Python, and Java programming languages. The performance evaluations are done by comparing their computational efficiencies and based on the potential application of optimized trajectories. The paper shows that in the absence of special privileges on a supercomputer, a cluster of commercially available computers provides a feasible approach for national and global air traffic system studies.

Multi-threaded ATLAS simulation on Intel Knights Landing processors

CERN Document Server

AUTHOR|(INSPIRE)INSPIRE-00014247; The ATLAS collaboration; Calafiura, Paolo; Leggett, Charles; Tsulaia, Vakhtang; Dotti, Andrea

2017-01-01

The Knights Landing (KNL) release of the Intel Many Integrated Core (MIC) Xeon Phi line of processors is a potential game changer for HEP computing. With 72 cores and deep vector registers, the KNL cards promise significant performance benefits for highly-parallel, compute-heavy applications. Cori, the newest supercomputer at the National Energy Research Scientific Computing Center (NERSC), was delivered to its users in two phases with the first phase online at the end of 2015 and the second phase now online at the end of 2016. Cori Phase 2 is based on the KNL architecture and contains over 9000 compute nodes with 96GB DDR4 memory. ATLAS simulation with the multithreaded Athena Framework (AthenaMT) is a good potential use-case for the KNL architecture and supercomputers like Cori. ATLAS simulation jobs have a high ratio of CPU computation to disk I/O and have been shown to scale well in multi-threading and across many nodes. In this paper we will give an overview of the ATLAS simulation application with detai...

Multi-threaded ATLAS Simulation on Intel Knights Landing Processors

CERN Document Server

Farrell, Steven; The ATLAS collaboration; Calafiura, Paolo; Leggett, Charles

2016-01-01

The Knights Landing (KNL) release of the Intel Many Integrated Core (MIC) Xeon Phi line of processors is a potential game changer for HEP computing. With 72 cores and deep vector registers, the KNL cards promise significant performance benefits for highly-parallel, compute-heavy applications. Cori, the newest supercomputer at the National Energy Research Scientific Computing Center (NERSC), will be delivered to its users in two phases with the first phase online now and the second phase expected in mid-2016. Cori Phase 2 will be based on the KNL architecture and will contain over 9000 compute nodes with 96GB DDR4 memory. ATLAS simulation with the multithreaded Athena Framework (AthenaMT) is a great use-case for the KNL architecture and supercomputers like Cori. Simulation jobs have a high ratio of CPU computation to disk I/O and have been shown to scale well in multi-threading and across many nodes. In this presentation we will give an overview of the ATLAS simulation application with details on its multi-thr...

The NEST Dry-Run Mode: Efficient Dynamic Analysis of Neuronal Network Simulation Code

Directory of Open Access Journals (Sweden)

Susanne Kunkel

2017-06-01

Full Text Available NEST is a simulator for spiking neuronal networks that commits to a general purpose approach: It allows for high flexibility in the design of network models, and its applications range from small-scale simulations on laptops to brain-scale simulations on supercomputers. Hence, developers need to test their code for various use cases and ensure that changes to code do not impair scalability. However, running a full set of benchmarks on a supercomputer takes up precious compute-time resources and can entail long queuing times. Here, we present the NEST dry-run mode, which enables comprehensive dynamic code analysis without requiring access to high-performance computing facilities. A dry-run simulation is carried out by a single process, which performs all simulation steps except communication as if it was part of a parallel environment with many processes. We show that measurements of memory usage and runtime of neuronal network simulations closely match the corresponding dry-run data. Furthermore, we demonstrate the successful application of the dry-run mode in the areas of profiling and performance modeling.

Performance evaluation of scientific programs on advanced architecture computers

International Nuclear Information System (INIS)

Walker, D.W.; Messina, P.; Baille, C.F.

1988-01-01

Recently a number of advanced architecture machines have become commercially available. These new machines promise better cost-performance then traditional computers, and some of them have the potential of competing with current supercomputers, such as the Cray X/MP, in terms of maximum performance. This paper describes an on-going project to evaluate a broad range of advanced architecture computers using a number of complete scientific application programs. The computers to be evaluated include distributed- memory machines such as the NCUBE, INTEL and Caltech/JPL hypercubes, and the MEIKO computing surface, shared-memory, bus architecture machines such as the Sequent Balance and the Alliant, very long instruction word machines such as the Multiflow Trace 7/200 computer, traditional supercomputers such as the Cray X.MP and Cray-2, and SIMD machines such as the Connection Machine. Currently 11 application codes from a number of scientific disciplines have been selected, although it is not intended to run all codes on all machines. Results are presented for two of the codes (QCD and missile tracking), and future work is proposed

High performance parallel computing of flows in complex geometries: II. Applications

International Nuclear Information System (INIS)

Gourdain, N; Gicquel, L; Staffelbach, G; Vermorel, O; Duchaine, F; Boussuge, J-F; Poinsot, T

2009-01-01

Present regulations in terms of pollutant emissions, noise and economical constraints, require new approaches and designs in the fields of energy supply and transportation. It is now well established that the next breakthrough will come from a better understanding of unsteady flow effects and by considering the entire system and not only isolated components. However, these aspects are still not well taken into account by the numerical approaches or understood whatever the design stage considered. The main challenge is essentially due to the computational requirements inferred by such complex systems if it is to be simulated by use of supercomputers. This paper shows how new challenges can be addressed by using parallel computing platforms for distinct elements of a more complex systems as encountered in aeronautical applications. Based on numerical simulations performed with modern aerodynamic and reactive flow solvers, this work underlines the interest of high-performance computing for solving flow in complex industrial configurations such as aircrafts, combustion chambers and turbomachines. Performance indicators related to parallel computing efficiency are presented, showing that establishing fair criterions is a difficult task for complex industrial applications. Examples of numerical simulations performed in industrial systems are also described with a particular interest for the computational time and the potential design improvements obtained with high-fidelity and multi-physics computing methods. These simulations use either unsteady Reynolds-averaged Navier-Stokes methods or large eddy simulation and deal with turbulent unsteady flows, such as coupled flow phenomena (thermo-acoustic instabilities, buffet, etc). Some examples of the difficulties with grid generation and data analysis are also presented when dealing with these complex industrial applications.

High definition graphics application in fluid flow simulations

International Nuclear Information System (INIS)

Bancroft, G.; Merritt, F.; Buning, P.; Watson, V.

1987-01-01

NASA Ames is using high spatial/color-resolution computer graphics to interactively visualize flow fields generated by supercomputer solutions for the flow about such vehicles as the Space Shuttle. The scientist's viewing position in three-dimensional space can be interactively changed while the fluid flow is either frozen or moving in time. Animated sequences can then be made for workstation viewing with the aid of specialized software that allows easy editing and automatic tweening of the sequences. Attention is presently given to the software generating the three-dimensional flow field displays, as well as that for creating the animation sequences

BDML Metadata: 189 [SSBD[Archive

Lifescience Database Archive (English)

Full Text Available NC-SA 0.180 ed496a82-2baf-4cc3-8fc5-56db2bab7aec 0.105 x 0.105 x 0.5 (micrometer), 40 (second) http://ssbd.q...P002.pdpml0.06.xml http://ssbd.qbic.riken.jp/search/ed496a82-2baf-4cc3-8fc5-56db2bab7aec/ http://ssbd.qbic.riken.jp/omero/webclient/?show=dataset-95 ...

B-Carotene-a long road to commercial implementation

CSIR Research Space (South Africa)

Gardiner, NS

2006-09-01

Full Text Available ) • Animal feed supplements • Food supplements – colorant, Vitamin A supplement • OTC pharmaceuticals (health supplements) – anti-oxidant, Vitamin A supplement © CSIR 2006 www.csir.co.zaSlide 4 Production • Chemical synthesis... • BASF, DSM (formerly Roche) • Algal production (Dunaliella salina) • Betatene (Cognis), Koor Foods, NCSA • Extraction from natural sources (carrots, palm oil) • DSM (formerly Roche), Hanson and Darius • Fungal production (Blakeslea trispora) • DSM...

Durango: Scalable Synthetic Workload Generation for Extreme-Scale Application Performance Modeling and Simulation

Energy Technology Data Exchange (ETDEWEB)

Carothers, Christopher D. [Rensselaer Polytechnic Institute (RPI); Meredith, Jeremy S. [ORNL; Blanco, Marc [Rensselaer Polytechnic Institute (RPI); Vetter, Jeffrey S. [ORNL; Mubarak, Misbah [Argonne National Laboratory; LaPre, Justin [Rensselaer Polytechnic Institute (RPI); Moore, Shirley V. [ORNL

2017-05-01

Performance modeling of extreme-scale applications on accurate representations of potential architectures is critical for designing next generation supercomputing systems because it is impractical to construct prototype systems at scale with new network hardware in order to explore designs and policies. However, these simulations often rely on static application traces that can be difficult to work with because of their size and lack of flexibility to extend or scale up without rerunning the original application. To address this problem, we have created a new technique for generating scalable, flexible workloads from real applications, we have implemented a prototype, called Durango, that combines a proven analytical performance modeling language, Aspen, with the massively parallel HPC network modeling capabilities of the CODES framework.Our models are compact, parameterized and representative of real applications with computation events. They are not resource intensive to create and are portable across simulator environments. We demonstrate the utility of Durango by simulating the LULESH application in the CODES simulation environment on several topologies and show that Durango is practical to use for simulation without loss of fidelity, as quantified by simulation metrics. During our validation of Durango's generated communication model of LULESH, we found that the original LULESH miniapp code had a latent bug where the MPI_Waitall operation was used incorrectly. This finding underscores the potential need for a tool such as Durango, beyond its benefits for flexible workload generation and modeling.Additionally, we demonstrate the efficacy of Durango's direct integration approach, which links Aspen into CODES as part of the running network simulation model. Here, Aspen generates the application-level computation timing events, which in turn drive the start of a network communication phase. Results show that Durango's performance scales well when

Proceedings of the 2. international conference on simulation methods in nuclear engineering

International Nuclear Information System (INIS)

Brais, A.

1986-10-01

The fifty papers presented at this conference cover the field of computerized simulation and mathematical modelling of processes in PWR and CANDU type reactors. Topics include thermalhydraulics of system transients, complex geometries, multi-fluid systems, and general situations; reactor physics simulations; reactor simulators; fuel and fuel channel behaviour; and applications of supercomputers, parallel processing, and microcomputers

Three-dimensional kinetic simulations of whistler turbulence in solar wind on parallel supercomputers

Science.gov (United States)

Chang, Ouliang

The objective of this dissertation is to study the physics of whistler turbulence evolution and its role in energy transport and dissipation in the solar wind plasmas through computational and theoretical investigations. This dissertation presents the first fully three-dimensional (3D) particle-in-cell (PIC) simulations of whistler turbulence forward cascade in a homogeneous, collisionless plasma with a uniform background magnetic field B o, and the first 3D PIC simulation of whistler turbulence with both forward and inverse cascades. Such computationally demanding research is made possible through the use of massively parallel, high performance electromagnetic PIC simulations on state-of-the-art supercomputers. Simulations are carried out to study characteristic properties of whistler turbulence under variable solar wind fluctuation amplitude (epsilon e) and electron beta (betae), relative contributions to energy dissipation and electron heating in whistler turbulence from the quasilinear scenario and the intermittency scenario, and whistler turbulence preferential cascading direction and wavevector anisotropy. The 3D simulations of whistler turbulence exhibit a forward cascade of fluctuations into broadband, anisotropic, turbulent spectrum at shorter wavelengths with wavevectors preferentially quasi-perpendicular to B o. The overall electron heating yields T ∥ > T⊥ for all epsilone and betae values, indicating the primary linear wave-particle interaction is Landau damping. But linear wave-particle interactions play a minor role in shaping the wavevector spectrum, whereas nonlinear wave-wave interactions are overall stronger and faster processes, and ultimately determine the wavevector anisotropy. Simulated magnetic energy spectra as function of wavenumber show a spectral break to steeper slopes, which scales as k⊥lambda e ≃ 1 independent of betae values, where lambdae is electron inertial length, qualitatively similar to solar wind observations. Specific

Accessing NASA Technology with the World Wide Web

Science.gov (United States)

Nelson, Michael L.; Bianco, David J.

1995-01-01

NASA Langley Research Center (LaRC) began using the World Wide Web (WWW) in the summer of 1993, becoming the first NASA installation to provide a Center-wide home page. This coincided with a reorganization of LaRC to provide a more concentrated focus on technology transfer to both aerospace and non-aerospace industry. Use of WWW and NCSA Mosaic not only provides automated information dissemination, but also allows for the implementation, evolution and integration of many technology transfer and technology awareness applications. This paper describes several of these innovative applications, including the on-line presentation of the entire Technology OPportunities Showcase (TOPS), an industrial partnering showcase that exists on the Web long after the actual 3-day event ended. The NASA Technical Report Server (NTRS) provides uniform access to many logically similar, yet physically distributed NASA report servers. WWW is also the foundation of the Langley Software Server (LSS), an experimental software distribution system which will distribute LaRC-developed software. In addition to the more formal technology distribution projects, WWW has been successful in connecting people with technologies and people with other people.

PET with three-dimensional data sampling and its clinical applications

International Nuclear Information System (INIS)

Itoh, M.; Tashiro, M.; Ishii, K.; Kubota, K.; Fujimoto, T.

2000-01-01

3D-PET (Positron Emission Tomography with tree-dimensional data acquisition capacity) is a powerful tool for whole-body imaging of metabolism in human in vivo. Thanks its high sensitivity, high-quality images are obtained with reduced radiation exposure to patients. In order to facilitate the use of 3D-PET in clinical practice, our PET system is connected to a super-computer (SX4, NEC, Japan) for data processing and image-reconstruction using 3D-reprojection-backprojection algorithm. The impact of this imaging system emerged immediately in ontological applications. Localization and assessment of spread of malignant tumors can be made by injection of appropriate radiotracers, 18 F-fluoro-deoxy-glucose usually, and scanning whole body with sequential patient coach movement. We have extended this technique to the analysis of brain of patients having cancer, because psychological and psychiatrical abnormalities have been reported frequent in these patients. The results clearly showed abnormality in brain glucose metabolism in cancer patients, the metabolic reduction was noted in lower medial frontal cortex, hippocampus, amygdaloid cortex, and cingulate cortex. The reductions were significantly correlated with scores of depressiveness. 3D PET is a currently ideal tool to evacuate metabolic abnormalities such as cancer in the whole-body. (author)

Using a Cray Y-MP as an array processor for a RISC Workstation

Science.gov (United States)

Lamaster, Hugh; Rogallo, Sarah J.

1992-01-01

As microprocessors increase in power, the economics of centralized computing has changed dramatically. At the beginning of the 1980's, mainframes and super computers were often considered to be cost-effective machines for scalar computing. Today, microprocessor-based RISC (reduced-instruction-set computer) systems have displaced many uses of mainframes and supercomputers. Supercomputers are still cost competitive when processing jobs that require both large memory size and high memory bandwidth. One such application is array processing. Certain numerical operations are appropriate to use in a Remote Procedure Call (RPC)-based environment. Matrix multiplication is an example of an operation that can have a sufficient number of arithmetic operations to amortize the cost of an RPC call. An experiment which demonstrates that matrix multiplication can be executed remotely on a large system to speed the execution over that experienced on a workstation is described.

Algorithms for supercomputers

International Nuclear Information System (INIS)

Alder, B.J.

1986-01-01

Better numerical procedures, improved computational power and additional physical insights have contributed significantly to progress in dealing with classical and quantum statistical mechanics problems. Past developments are discussed and future possibilities outlined

Super-computer architecture

CERN Document Server

Hockney, R W

1977-01-01

This paper examines the design of the top-of-the-range, scientific, number-crunching computers. The market for such computers is not as large as that for smaller machines, but on the other hand it is by no means negligible. The present work-horse machines in this category are the CDC 7600 and IBM 360/195, and over fifty of the former machines have been sold. The types of installation that form the market for such machines are not only the major scientific research laboratories in the major countries-such as Los Alamos, CERN, Rutherford laboratory-but also major universities or university networks. It is also true that, as with sports cars, innovations made to satisfy the top of the market today often become the standard for the medium-scale computer of tomorrow. Hence there is considerable interest in examining present developments in this area. (0 refs).

Algorithms for supercomputers

International Nuclear Information System (INIS)

Alder, B.J.

1985-12-01

Better numerical procedures, improved computational power and additional physical insights have contributed significantly to progress in dealing with classical and quantum statistical mechanics problems. Past developments are discussed and future possibilities outlined

Industry approach to BE applications - Past and future

International Nuclear Information System (INIS)

Martin, R.P.

2004-01-01

With each passing year the nuclear industry, like all private industry, becomes more reliant on computer-based analysis tools. While this is primarily driven by competition and the natural advancement of computing power, computer analysis tools are also an excellent way to capture engineering know-how. As the average age of nuclear industry personnel approaches 50 years, this becomes increasingly important. The engineers that are retiring today have witnessed a remarkable evolution of computational tools during their tenure. For some, it is the difference between a pencil-and slide- rule and a desktop supercomputer. A curious aspect of this evolution is the question How has industry capitalized on all this advancement? Of course, the answer depends on who is being asked. Part of the answer must come from a historical review. This paper takes an engineer's approach to assessing history. In contrast, a mathematician's approach might be to look at where we have started and where we are today and fit a plausible story to the data. Engineers, on the other hand, have to consider other motivations. Webster Dictionary defines engineering as the application of scientific and mathematical principles to practical ends such as the design, manufacture, and operation of efficient and economical structures, machines, processes, and systems. Clearly, the engineers approach to any problem begins with science and math. The key difference to how an engineer approaches a problem is that 'practical', 'efficient', and 'economical' are on equal footing with 'scientific and mathematical principles'. Basically, engineers go through the same 'curve fitting' approach to every problem, but include more unknowns. Hence, the standard engineers' model is y = C 1 (science) + C 2 (math) + C 3 (practicality) + C 4 (efficiency) C 5 (economics). Computer codes used in the nuclear industry represent a broad spectrum of engineering applications including computer-aided design, structural and mechanical

Implementation and qualification of MCNP 5 through the intercomparison with the benchmark for the calculation of critical systems Godiva and Jezebel

International Nuclear Information System (INIS)

Lara, Rafael G.; Maiorino, Jose R.

2013-01-01

This work aimed at the implementation and qualification of MCNP code in a supercomputer of the Universidade Federal do ABC, so that may be available a next-generation simulation tool for precise calculations of nuclear reactors and systems subject to radiation. The implementation of this tool will have multidisciplinary applications, covering various areas of engineering (nuclear, aerospace, biomedical), radiation physics and others

Implementation and qualification of MCNP 5 through the intercomparison with the benchmark for the calculation of critical systems Godiva and Jezebel; Implementacao e qualificacao do MCNP5 atraves da intercomparacao com o benchmark para o calculo dos sistemas criticos Godiva e Jezebel

Energy Technology Data Exchange (ETDEWEB)

Lara, Rafael G.; Maiorino, Jose R., E-mail: rafael.lara@aluno.ufabc.edu.br, E-mail: joserubens.maiorino@ufabc.edu.br [Universidade Federal do ABC (UFABC), Santo Andre, SP (Brazil). Centro de Engenharia, Modelagem e Ciencias Sociais Aplicadas

2013-07-01

This work aimed at the implementation and qualification of MCNP code in a supercomputer of the Universidade Federal do ABC, so that may be available a next-generation simulation tool for precise calculations of nuclear reactors and systems subject to radiation. The implementation of this tool will have multidisciplinary applications, covering various areas of engineering (nuclear, aerospace, biomedical), radiation physics and others.

The Centre of High-Performance Scientific Computing, Geoverbund, ABC/J - Geosciences enabled by HPSC

Science.gov (United States)

Kollet, Stefan; Görgen, Klaus; Vereecken, Harry; Gasper, Fabian; Hendricks-Franssen, Harrie-Jan; Keune, Jessica; Kulkarni, Ketan; Kurtz, Wolfgang; Sharples, Wendy; Shrestha, Prabhakar; Simmer, Clemens; Sulis, Mauro; Vanderborght, Jan

2016-04-01

The Centre of High-Performance Scientific Computing (HPSC TerrSys) was founded 2011 to establish a centre of competence in high-performance scientific computing in terrestrial systems and the geosciences enabling fundamental and applied geoscientific research in the Geoverbund ABC/J (geoscientfic research alliance of the Universities of Aachen, Cologne, Bonn and the Research Centre Jülich, Germany). The specific goals of HPSC TerrSys are to achieve relevance at the national and international level in (i) the development and application of HPSC technologies in the geoscientific community; (ii) student education; (iii) HPSC services and support also to the wider geoscientific community; and in (iv) the industry and public sectors via e.g., useful applications and data products. A key feature of HPSC TerrSys is the Simulation Laboratory Terrestrial Systems, which is located at the Jülich Supercomputing Centre (JSC) and provides extensive capabilities with respect to porting, profiling, tuning and performance monitoring of geoscientific software in JSC's supercomputing environment. We will present a summary of success stories of HPSC applications including integrated terrestrial model development, parallel profiling and its application from watersheds to the continent; massively parallel data assimilation using physics-based models and ensemble methods; quasi-operational terrestrial water and energy monitoring; and convection permitting climate simulations over Europe. The success stories stress the need for a formalized education of students in the application of HPSC technologies in future.

Hierarchical approach to optimization of parallel matrix multiplication on large-scale platforms

KAUST Repository

Hasanov, Khalid

2014-03-04

© 2014, Springer Science+Business Media New York. Many state-of-the-art parallel algorithms, which are widely used in scientific applications executed on high-end computing systems, were designed in the twentieth century with relatively small-scale parallelism in mind. Indeed, while in 1990s a system with few hundred cores was considered a powerful supercomputer, modern top supercomputers have millions of cores. In this paper, we present a hierarchical approach to optimization of message-passing parallel algorithms for execution on large-scale distributed-memory systems. The idea is to reduce the communication cost by introducing hierarchy and hence more parallelism in the communication scheme. We apply this approach to SUMMA, the state-of-the-art parallel algorithm for matrix–matrix multiplication, and demonstrate both theoretically and experimentally that the modified Hierarchical SUMMA significantly improves the communication cost and the overall performance on large-scale platforms.

QDP-JIT/PTX: A QDP++ Implementation for CUDA-Enabled GPUs

Energy Technology Data Exchange (ETDEWEB)

Winter, Frank T. [JLAB; Edwards, Robert G. [JLAB

2014-11-01

These proceedings describe briefly the QDP-JIT/PTX framework for lattice field theory calcula- tions on the CUDA architecture. The framework generates compute kernels in the PTX assembler language which can be compiled to efficient GPU machine code by the NVIDIA JIT compiler. A comprehensive memory management was added to the framework so that applications, e.g. Chroma, can run unaltered on GPU clusters and supercomputers.

Addendum to the health and safety plan for Waste Area Grouping 6 at Oak Ridge National Laboratory, Oak Ridge, Tennessee. Environmental Restoration Program

International Nuclear Information System (INIS)

Clark, C. Jr.; Burman, S.N.; Wilson, K.A.

1995-08-01

There are three purposes for this addendum to the health and safety plan for Waste Area Grouping 6. The first purpose is to provide record of a corrective action response concerning an occurrence on WAG 6 in October 1994 (ORO-MMES-ENVRES-1994-0016.) This occurrence involved a precautionary evacuation of subcontractor field crews due to malfunctioning monitor alarms for organic vapors. The corrective action is to revise the WAG 6 Site health and safety plan to improve communications during emergency events. The second purpose is to incorporate any outstanding health and safety issues not addressed in the original health and safety plan for WAG 6 document (ORNL/ER-183). The only variance of note is tritium air monitoring in the Tumulus building. The tritium air monitor is added in this addendum as monitoring equipment for WAG 6 with description of action level and calibration. The third purpose of this addendum is to satisfy a condition of approval for the pending Nuclear Criticality Safety Assessment (NCSA) pertaining to KEMA fuel storage at WAG 6. This approval condition requires the following: ''The location of the KEMA burial shall be recorded and maintained in a controlled document that identifies the quantity and the general physical conditions at the time of the entombment with an admonishment to obtain nuclear criticality safety guidance before altering the burial condition.'' In order to satisfy the approval, this document must be controlled. The predecessor to the pending NCSA is NSR No. 0002WM22001

A high level language for a high performance computer

Science.gov (United States)

Perrott, R. H.

1978-01-01

The proposed computational aerodynamic facility will join the ranks of the supercomputers due to its architecture and increased execution speed. At present, the languages used to program these supercomputers have been modifications of programming languages which were designed many years ago for sequential machines. A new programming language should be developed based on the techniques which have proved valuable for sequential programming languages and incorporating the algorithmic techniques required for these supercomputers. The design objectives for such a language are outlined.

Federated data storage system prototype for LHC experiments and data intensive science

Science.gov (United States)

Kiryanov, A.; Klimentov, A.; Krasnopevtsev, D.; Ryabinkin, E.; Zarochentsev, A.

2017-10-01

Rapid increase of data volume from the experiments running at the Large Hadron Collider (LHC) prompted physics computing community to evaluate new data handling and processing solutions. Russian grid sites and universities’ clusters scattered over a large area aim at the task of uniting their resources for future productive work, at the same time giving an opportunity to support large physics collaborations. In our project we address the fundamental problem of designing a computing architecture to integrate distributed storage resources for LHC experiments and other data-intensive science applications and to provide access to data from heterogeneous computing facilities. Studies include development and implementation of federated data storage prototype for Worldwide LHC Computing Grid (WLCG) centres of different levels and University clusters within one National Cloud. The prototype is based on computing resources located in Moscow, Dubna, Saint Petersburg, Gatchina and Geneva. This project intends to implement a federated distributed storage for all kind of operations such as read/write/transfer and access via WAN from Grid centres, university clusters, supercomputers, academic and commercial clouds. The efficiency and performance of the system are demonstrated using synthetic and experiment-specific tests including real data processing and analysis workflows from ATLAS and ALICE experiments, as well as compute-intensive bioinformatics applications (PALEOMIX) running on supercomputers. We present topology and architecture of the designed system, report performance and statistics for different access patterns and show how federated data storage can be used efficiently by physicists and biologists. We also describe how sharing data on a widely distributed storage system can lead to a new computing model and reformations of computing style, for instance how bioinformatics program running on supercomputers can read/write data from the federated storage.

Multi-threaded ATLAS simulation on Intel Knights Landing processors

Science.gov (United States)

Farrell, Steven; Calafiura, Paolo; Leggett, Charles; Tsulaia, Vakhtang; Dotti, Andrea; ATLAS Collaboration

2017-10-01

The Knights Landing (KNL) release of the Intel Many Integrated Core (MIC) Xeon Phi line of processors is a potential game changer for HEP computing. With 72 cores and deep vector registers, the KNL cards promise significant performance benefits for highly-parallel, compute-heavy applications. Cori, the newest supercomputer at the National Energy Research Scientific Computing Center (NERSC), was delivered to its users in two phases with the first phase online at the end of 2015 and the second phase now online at the end of 2016. Cori Phase 2 is based on the KNL architecture and contains over 9000 compute nodes with 96GB DDR4 memory. ATLAS simulation with the multithreaded Athena Framework (AthenaMT) is a good potential use-case for the KNL architecture and supercomputers like Cori. ATLAS simulation jobs have a high ratio of CPU computation to disk I/O and have been shown to scale well in multi-threading and across many nodes. In this paper we will give an overview of the ATLAS simulation application with details on its multi-threaded design. Then, we will present a performance analysis of the application on KNL devices and compare it to a traditional x86 platform to demonstrate the capabilities of the architecture and evaluate the benefits of utilizing KNL platforms like Cori for ATLAS production.

Real science at the petascale.

Science.gov (United States)

Saksena, Radhika S; Boghosian, Bruce; Fazendeiro, Luis; Kenway, Owain A; Manos, Steven; Mazzeo, Marco D; Sadiq, S Kashif; Suter, James L; Wright, David; Coveney, Peter V

2009-06-28

We describe computational science research that uses petascale resources to achieve scientific results at unprecedented scales and resolution. The applications span a wide range of domains, from investigation of fundamental problems in turbulence through computational materials science research to biomedical applications at the forefront of HIV/AIDS research and cerebrovascular haemodynamics. This work was mainly performed on the US TeraGrid 'petascale' resource, Ranger, at Texas Advanced Computing Center, in the first half of 2008 when it was the largest computing system in the world available for open scientific research. We have sought to use this petascale supercomputer optimally across application domains and scales, exploiting the excellent parallel scaling performance found on up to at least 32 768 cores for certain of our codes in the so-called 'capability computing' category as well as high-throughput intermediate-scale jobs for ensemble simulations in the 32-512 core range. Furthermore, this activity provides evidence that conventional parallel programming with MPI should be successful at the petascale in the short to medium term. We also report on the parallel performance of some of our codes on up to 65 636 cores on the IBM Blue Gene/P system at the Argonne Leadership Computing Facility, which has recently been named the fastest supercomputer in the world for open science.

Supercomputing for molecular dynamics simulations handling multi-trillion particles in nanofluidics

CERN Document Server

Heinecke, Alexander; Horsch, Martin; Bungartz, Hans-Joachim

2015-01-01

This work presents modern implementations of relevant molecular dynamics algorithms using ls1 mardyn, a simulation program for engineering applications. The text focuses strictly on HPC-related aspects, covering implementation on HPC architectures, taking Intel Xeon and Intel Xeon Phi clusters as representatives of current platforms. The work describes distributed and shared-memory parallelization on these platforms, including load balancing, with a particular focus on the efficient implementation of the compute kernels. The text also discusses the software-architecture of the resulting code.

Science & Technology Review June 2012

Energy Technology Data Exchange (ETDEWEB)

Poyneer, L A

2012-04-20

This month's issue has the following articles: (1) A New Era in Climate System Analysis - Commentary by William H. Goldstein; (2) Seeking Clues to Climate Change - By comparing past climate records with results from computer simulations, Livermore scientists can better understand why Earth's climate has changed and how it might change in the future; (3) Finding and Fixing a Supercomputer's Faults - Livermore experts have developed innovative methods to detect hardware faults in supercomputers and help applications recover from errors that do occur; (4) Targeting Ignition - Enhancements to the cryogenic targets for National Ignition Facility experiments are furthering work to achieve fusion ignition with energy gain; (5) Neural Implants Come of Age - A new generation of fully implantable, biocompatible neural prosthetics offers hope to patients with neurological impairment; and (6) Incubator Busy Growing Energy Technologies - Six collaborations with industrial partners are using the Laboratory's high-performance computing resources to find solutions to urgent energy-related problems.

Hybrid petacomputing meets cosmology: The Roadrunner Universe project

International Nuclear Information System (INIS)

Habib, Salman; Pope, Adrian; Lukic, Zarija; Daniel, David; Fasel, Patricia; Desai, Nehal; Heitmann, Katrin; Hsu, Chung-Hsing; Ankeny, Lee; Mark, Graham; Bhattacharya, Suman; Ahrens, James

2009-01-01

The target of the Roadrunner Universe project at Los Alamos National Laboratory is a set of very large cosmological N-body simulation runs on the hybrid supercomputer Roadrunner, the world's first petaflop platform. Roadrunner's architecture presents opportunities and difficulties characteristic of next-generation supercomputing. We describe a new code designed to optimize performance and scalability by explicitly matching the underlying algorithms to the machine architecture, and by using the physics of the problem as an essential aid in this process. While applications will differ in specific exploits, we believe that such a design process will become increasingly important in the future. The Roadrunner Universe project code, MC 3 (Mesh-based Cosmology Code on the Cell), uses grid and direct particle methods to balance the capabilities of Roadrunner's conventional (Opteron) and accelerator (Cell BE) layers. Mirrored particle caches and spectral techniques are used to overcome communication bandwidth limitations and possible difficulties with complicated particle-grid interaction templates.

Optimizing the Performance of Reactive Molecular Dynamics Simulations for Multi-core Architectures

Energy Technology Data Exchange (ETDEWEB)

Aktulga, Hasan Metin [Michigan State Univ., East Lansing, MI (United States); Coffman, Paul [Argonne National Lab. (ANL), Argonne, IL (United States); Shan, Tzu-Ray [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States); Knight, Chris [Argonne National Lab. (ANL), Argonne, IL (United States); Jiang, Wei [Argonne National Lab. (ANL), Argonne, IL (United States)

2015-12-01

Hybrid parallelism allows high performance computing applications to better leverage the increasing on-node parallelism of modern supercomputers. In this paper, we present a hybrid parallel implementation of the widely used LAMMPS/ReaxC package, where the construction of bonded and nonbonded lists and evaluation of complex ReaxFF interactions are implemented efficiently using OpenMP parallelism. Additionally, the performance of the QEq charge equilibration scheme is examined and a dual-solver is implemented. We present the performance of the resulting ReaxC-OMP package on a state-of-the-art multi-core architecture Mira, an IBM BlueGene/Q supercomputer. For system sizes ranging from 32 thousand to 16.6 million particles, speedups in the range of 1.5-4.5x are observed using the new ReaxC-OMP software. Sustained performance improvements have been observed for up to 262,144 cores (1,048,576 processes) of Mira with a weak scaling efficiency of 91.5% in larger simulations containing 16.6 million particles.

Dal CERN, flusso si dati a una media di 600 megabytes al secondo per dieci giorni consecutivi

CERN Multimedia

2005-01-01

The supercomputer Grid took up successfully its first technologic challenge. Egiht supercomputing centers have supported on internet a continuous flow of data from CERN in Geneva and directed them to seven centers in Europe and United States

SOME PARADIGMS OF ARTIFICIAL INTELLIGENCE IN FINANCIAL COMPUTER SYSTEMS

OpenAIRE

Jerzy Balicki

2015-01-01

The article discusses some paradigms of artificial intelligence in the context of their applications in computer financial systems. The proposed approach has a significant po-tential to increase the competitiveness of enterprises, including financial institutions. However, it requires the effective use of supercomputers, grids and cloud computing. A reference is made to the computing environment for Bitcoin. In addition, we characterized genetic programming and artificial neural networks to p...

Lattice QCD - a challenge in large scale computing

International Nuclear Information System (INIS)

Schilling, K.

1987-01-01

The computation of the hadron spectrum within the framework of lattice QCD sets a demanding goal for the application of supercomputers in basic science. It requires both big computer capacities and clever algorithms to fight all the numerical evils that one encounters in the Euclidean space-time-world. The talk will attempt to introduce to the present state of the art of spectrum calculations by lattice simulations. (orig.)

Study on the climate system and mass transport by a climate model

International Nuclear Information System (INIS)

Numaguti, A.; Sugata, S.; Takahashi, M.; Nakajima, T.; Sumi, A.

1997-01-01

The Center for Global Environmental Research (CGER), an organ of the National Institute for Environmental Studies of the Environment Agency of Japan, was established in October 1990 to contribute broadly to the scientific understanding of global change, and to the elucidation of and solution for our pressing environmental problems. CGER conducts environmental research from interdisciplinary, multiagency, and international perspective, provides research support facilities such as a supercomputer and databases, and offers its own data from long-term monitoring of the global environment. In March 1992, CGER installed a supercomputer system (NEC SX-3, Model 14) to facilitate research on global change. The system is open to environmental researchers worldwide. Proposed research programs are evaluated by the Supercomputer Steering Committee which consists of leading scientists in climate modeling, atmospheric chemistry, oceanic circulation, and computer science. After project approval, authorization for system usage is provided. In 1995 and 1996, several research proposals were designated as priority research and allocated larger shares of computer resources. The CGER supercomputer monograph report Vol. 3 is a report of priority research of CGER's supercomputer. The report covers the description of CCSR-NIES atmospheric general circulation model, lagragian general circulation based on the time-scale of particle motion, and ability of the CCSR-NIES atmospheric general circulation model in the stratosphere. The results obtained from these three studies are described in three chapters. We hope this report provides you with useful information on the global environmental research conducted on our supercomputer

Energy efficiency vs. performance of the numerical solution of PDEs: An application study on a low-power ARM-based cluster

Science.gov (United States)

Göddeke, Dominik; Komatitsch, Dimitri; Geveler, Markus; Ribbrock, Dirk; Rajovic, Nikola; Puzovic, Nikola; Ramirez, Alex

2013-03-01

Power consumption and energy efficiency are becoming critical aspects in the design and operation of large scale HPC facilities, and it is unanimously recognised that future exascale supercomputers will be strongly constrained by their power requirements. At current electricity costs, operating an HPC system over its lifetime can already be on par with the initial deployment cost. These power consumption constraints, and the benefits a more energy-efficient HPC platform may have on other societal areas, have motivated the HPC research community to investigate the use of energy-efficient technologies originally developed for the embedded and especially mobile markets. However, lower power does not always mean lower energy consumption, since execution time often also increases. In order to achieve competitive performance, applications then need to efficiently exploit a larger number of processors. In this article, we discuss how applications can efficiently exploit this new class of low-power architectures to achieve competitive performance. We evaluate if they can benefit from the increased energy efficiency that the architecture is supposed to achieve. The applications that we consider cover three different classes of numerical solution methods for partial differential equations, namely a low-order finite element multigrid solver for huge sparse linear systems of equations, a Lattice-Boltzmann code for fluid simulation, and a high-order spectral element method for acoustic or seismic wave propagation modelling. We evaluate weak and strong scalability on a cluster of 96 ARM Cortex-A9 dual-core processors and demonstrate that the ARM-based cluster can be more efficient in terms of energy to solution when executing the three applications compared to an x86-based reference machine.

Massively Parallel QCD

International Nuclear Information System (INIS)

Soltz, R; Vranas, P; Blumrich, M; Chen, D; Gara, A; Giampap, M; Heidelberger, P; Salapura, V; Sexton, J; Bhanot, G

2007-01-01

The theory of the strong nuclear force, Quantum Chromodynamics (QCD), can be numerically simulated from first principles on massively-parallel supercomputers using the method of Lattice Gauge Theory. We describe the special programming requirements of lattice QCD (LQCD) as well as the optimal supercomputer hardware architectures that it suggests. We demonstrate these methods on the BlueGene massively-parallel supercomputer and argue that LQCD and the BlueGene architecture are a natural match. This can be traced to the simple fact that LQCD is a regular lattice discretization of space into lattice sites while the BlueGene supercomputer is a discretization of space into compute nodes, and that both are constrained by requirements of locality. This simple relation is both technologically important and theoretically intriguing. The main result of this paper is the speedup of LQCD using up to 131,072 CPUs on the largest BlueGene/L supercomputer. The speedup is perfect with sustained performance of about 20% of peak. This corresponds to a maximum of 70.5 sustained TFlop/s. At these speeds LQCD and BlueGene are poised to produce the next generation of strong interaction physics theoretical results

Performance Analysis of FEM Algorithmson GPU and Many-Core Architectures

KAUST Repository

Khurram, Rooh; Kortas, Samuel

2015-01-01

-only Exascale systems will be unsustainable, thus accelerators such as graphic processing units (GPUs) and many-integrated-core (MIC) will likely be the integral part of the TOP500 (http://www.top500.org/) supercomputers, beyond 2020. The emerging supercomputer

Hierarchical approach to optimization of parallel matrix multiplication on large-scale platforms

KAUST Repository

Hasanov, Khalid; Quintin, Jean-Noë l; Lastovetsky, Alexey

2014-01-01

-scale parallelism in mind. Indeed, while in 1990s a system with few hundred cores was considered a powerful supercomputer, modern top supercomputers have millions of cores. In this paper, we present a hierarchical approach to optimization of message-passing parallel

Collaborating CPU and GPU for large-scale high-order CFD simulations with complex grids on the TianHe-1A supercomputer

Energy Technology Data Exchange (ETDEWEB)

Xu, Chuanfu, E-mail: xuchuanfu@nudt.edu.cn [College of Computer Science, National University of Defense Technology, Changsha 410073 (China); Deng, Xiaogang; Zhang, Lilun [College of Computer Science, National University of Defense Technology, Changsha 410073 (China); Fang, Jianbin [Parallel and Distributed Systems Group, Delft University of Technology, Delft 2628CD (Netherlands); Wang, Guangxue; Jiang, Yi [State Key Laboratory of Aerodynamics, P.O. Box 211, Mianyang 621000 (China); Cao, Wei; Che, Yonggang; Wang, Yongxian; Wang, Zhenghua; Liu, Wei; Cheng, Xinghua [College of Computer Science, National University of Defense Technology, Changsha 410073 (China)

2014-12-01

Programming and optimizing complex, real-world CFD codes on current many-core accelerated HPC systems is very challenging, especially when collaborating CPUs and accelerators to fully tap the potential of heterogeneous systems. In this paper, with a tri-level hybrid and heterogeneous programming model using MPI + OpenMP + CUDA, we port and optimize our high-order multi-block structured CFD software HOSTA on the GPU-accelerated TianHe-1A supercomputer. HOSTA adopts two self-developed high-order compact definite difference schemes WCNS and HDCS that can simulate flows with complex geometries. We present a dual-level parallelization scheme for efficient multi-block computation on GPUs and perform particular kernel optimizations for high-order CFD schemes. The GPU-only approach achieves a speedup of about 1.3 when comparing one Tesla M2050 GPU with two Xeon X5670 CPUs. To achieve a greater speedup, we collaborate CPU and GPU for HOSTA instead of using a naive GPU-only approach. We present a novel scheme to balance the loads between the store-poor GPU and the store-rich CPU. Taking CPU and GPU load balance into account, we improve the maximum simulation problem size per TianHe-1A node for HOSTA by 2.3×, meanwhile the collaborative approach can improve the performance by around 45% compared to the GPU-only approach. Further, to scale HOSTA on TianHe-1A, we propose a gather/scatter optimization to minimize PCI-e data transfer times for ghost and singularity data of 3D grid blocks, and overlap the collaborative computation and communication as far as possible using some advanced CUDA and MPI features. Scalability tests show that HOSTA can achieve a parallel efficiency of above 60% on 1024 TianHe-1A nodes. With our method, we have successfully simulated an EET high-lift airfoil configuration containing 800M cells and China's large civil airplane configuration containing 150M cells. To our best knowledge, those are the largest-scale CPU–GPU collaborative simulations

Collaborating CPU and GPU for large-scale high-order CFD simulations with complex grids on the TianHe-1A supercomputer

International Nuclear Information System (INIS)

Xu, Chuanfu; Deng, Xiaogang; Zhang, Lilun; Fang, Jianbin; Wang, Guangxue; Jiang, Yi; Cao, Wei; Che, Yonggang; Wang, Yongxian; Wang, Zhenghua; Liu, Wei; Cheng, Xinghua

2014-01-01

Programming and optimizing complex, real-world CFD codes on current many-core accelerated HPC systems is very challenging, especially when collaborating CPUs and accelerators to fully tap the potential of heterogeneous systems. In this paper, with a tri-level hybrid and heterogeneous programming model using MPI + OpenMP + CUDA, we port and optimize our high-order multi-block structured CFD software HOSTA on the GPU-accelerated TianHe-1A supercomputer. HOSTA adopts two self-developed high-order compact definite difference schemes WCNS and HDCS that can simulate flows with complex geometries. We present a dual-level parallelization scheme for efficient multi-block computation on GPUs and perform particular kernel optimizations for high-order CFD schemes. The GPU-only approach achieves a speedup of about 1.3 when comparing one Tesla M2050 GPU with two Xeon X5670 CPUs. To achieve a greater speedup, we collaborate CPU and GPU for HOSTA instead of using a naive GPU-only approach. We present a novel scheme to balance the loads between the store-poor GPU and the store-rich CPU. Taking CPU and GPU load balance into account, we improve the maximum simulation problem size per TianHe-1A node for HOSTA by 2.3×, meanwhile the collaborative approach can improve the performance by around 45% compared to the GPU-only approach. Further, to scale HOSTA on TianHe-1A, we propose a gather/scatter optimization to minimize PCI-e data transfer times for ghost and singularity data of 3D grid blocks, and overlap the collaborative computation and communication as far as possible using some advanced CUDA and MPI features. Scalability tests show that HOSTA can achieve a parallel efficiency of above 60% on 1024 TianHe-1A nodes. With our method, we have successfully simulated an EET high-lift airfoil configuration containing 800M cells and China's large civil airplane configuration containing 150M cells. To our best knowledge, those are the largest-scale CPU–GPU collaborative simulations

Toward petascale computing in geosciences: application to the Hanford 300 area

International Nuclear Information System (INIS)

Hammond, G E; Lichtner, P C; Mills, R T; Lu, C

2008-01-01

Modeling uranium transport at the Hanford 300 Area presents new challenges for high performance computing. A field-scale three-dimensional domain with an hourly fluctuating Columbia river stage coupled to flow in highly permeable sediments results in fast groundwater flow rates requiring small time steps. In this work, high-performance computing has been applied to simulate variably saturated groundwater flow and tracer transport at the 300 Area using PFLOTRAN. Simulation results are presented for discretizations up to 10.8 million degrees of freedom, while PFLOTRAN performance was assessed on up to one billion degrees of freedom and 12,000 processor cores on Jaguar, the Cray XT4 supercomputer at ORNL

Production experience with the ATLAS Event Service

Science.gov (United States)

Benjamin, D.; Calafiura, P.; Childers, T.; De, K.; Guan, W.; Maeno, T.; Nilsson, P.; Tsulaia, V.; Van Gemmeren, P.; Wenaus, T.; ATLAS Collaboration

2017-10-01

The ATLAS Event Service (AES) has been designed and implemented for efficient running of ATLAS production workflows on a variety of computing platforms, ranging from conventional Grid sites to opportunistic, often short-lived resources, such as spot market commercial clouds, supercomputers and volunteer computing. The Event Service architecture allows real time delivery of fine grained workloads to running payload applications which process dispatched events or event ranges and immediately stream the outputs to highly scalable Object Stores. Thanks to its agile and flexible architecture the AES is currently being used by grid sites for assigning low priority workloads to otherwise idle computing resources; similarly harvesting HPC resources in an efficient back-fill mode; and massively scaling out to the 50-100k concurrent core level on the Amazon spot market to efficiently utilize those transient resources for peak production needs. Platform ports in development include ATLAS@Home (BOINC) and the Google Compute Engine, and a growing number of HPC platforms. After briefly reviewing the concept and the architecture of the Event Service, we will report the status and experience gained in AES commissioning and production operations on supercomputers, and our plans for extending ES application beyond Geant4 simulation to other workflows, such as reconstruction and data analysis.

Computational chemistry

Science.gov (United States)

Arnold, J. O.

1987-01-01

With the advent of supercomputers, modern computational chemistry algorithms and codes, a powerful tool was created to help fill NASA's continuing need for information on the properties of matter in hostile or unusual environments. Computational resources provided under the National Aerodynamics Simulator (NAS) program were a cornerstone for recent advancements in this field. Properties of gases, materials, and their interactions can be determined from solutions of the governing equations. In the case of gases, for example, radiative transition probabilites per particle, bond-dissociation energies, and rates of simple chemical reactions can be determined computationally as reliably as from experiment. The data are proving to be quite valuable in providing inputs to real-gas flow simulation codes used to compute aerothermodynamic loads on NASA's aeroassist orbital transfer vehicles and a host of problems related to the National Aerospace Plane Program. Although more approximate, similar solutions can be obtained for ensembles of atoms simulating small particles of materials with and without the presence of gases. Computational chemistry has application in studying catalysis, properties of polymers, all of interest to various NASA missions, including those previously mentioned. In addition to discussing these applications of computational chemistry within NASA, the governing equations and the need for supercomputers for their solution is outlined.

Parallel processor programs in the Federal Government

Science.gov (United States)

Schneck, P. B.; Austin, D.; Squires, S. L.; Lehmann, J.; Mizell, D.; Wallgren, K.

1985-01-01

In 1982, a report dealing with the nation's research needs in high-speed computing called for increased access to supercomputing resources for the research community, research in computational mathematics, and increased research in the technology base needed for the next generation of supercomputers. Since that time a number of programs addressing future generations of computers, particularly parallel processors, have been started by U.S. government agencies. The present paper provides a description of the largest government programs in parallel processing. Established in fiscal year 1985 by the Institute for Defense Analyses for the National Security Agency, the Supercomputing Research Center will pursue research to advance the state of the art in supercomputing. Attention is also given to the DOE applied mathematical sciences research program, the NYU Ultracomputer project, the DARPA multiprocessor system architectures program, NSF research on multiprocessor systems, ONR activities in parallel computing, and NASA parallel processor projects.

The chiral condensate from lattice QCD with Wilson twisted mass quarks

Energy Technology Data Exchange (ETDEWEB)

Urbach, Carsten [Bonn Univ. (Germany). HISKP (Theorie)

2016-11-01

Lattice QCD is a very computer time demanding scientific application. Only with the computer time made available on supercomputers like SuperMUC significant progress, like the one reported here, can be reached. Moreover, the computing resources made available by LRZ are used to reduce the systematic uncertainties in our results even further: in another project we are generating ensembles with physical values of the quark masses, such that a chiral extrapolation is not needed anymore.

Computing the real-time Green's Functions of large Hamiltonian matrices

OpenAIRE

Iitaka, Toshiaki

1998-01-01

A numerical method is developed for calculating the real time Green's functions of very large sparse Hamiltonian matrices, which exploits the numerical solution of the inhomogeneous time-dependent Schroedinger equation. The method has a clear-cut structure reflecting the most naive definition of the Green's functions, and is very suitable to parallel and vector supercomputers. The effectiveness of the method is illustrated by applying it to simple lattice models. An application of this method...

Parallel computing works!

CERN Document Server

Fox, Geoffrey C; Messina, Guiseppe C

2014-01-01

A clear illustration of how parallel computers can be successfully appliedto large-scale scientific computations. This book demonstrates how avariety of applications in physics, biology, mathematics and other scienceswere implemented on real parallel computers to produce new scientificresults. It investigates issues of fine-grained parallelism relevant forfuture supercomputers with particular emphasis on hypercube architecture. The authors describe how they used an experimental approach to configuredifferent massively parallel machines, design and implement basic systemsoftware, and develop

Development of computer aided engineering system for TRAC applications

International Nuclear Information System (INIS)

Arai, Kenji; Itoya, Seihiro; Uematsu, Hitoshi; Tsunoyama, Shigeaki

1990-01-01

An advanced best estimate computer program for nuclear reactor transient analysis, TRAC has been extensively used to carry out various thermal hydraulic calculations in the nuclear engineering field, because of its versatility. To perform efficiently a wide variety of TRAC calculation, the efficient utilization of computers and the convenient environment for input and output processing is necessary. We have applied a computer network comprising a super-computer, engineering work stations and personal computers to TRAC calculations and have assigned the appropriate functions to each computer. We have also been developing an interactive graphics system for input and output processing on an EWS. This hardware and software environment can improve the effectiveness of TRAC utilization for various thermal hydraulic calculations. (author)

MAESTRO, CASTRO, and SEDONA -- Petascale Codes for Astrophysical Applications

Energy Technology Data Exchange (ETDEWEB)

Almgren, A. [Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States); Bell, J. [Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States); Kasen, D [Univ. of California, Santa Cruz, CA (United States); Lijewski, M. [Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States); Nonaka, A. [Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States); Nugent, P. [Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States); Rendleman, C. [Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States); Thomas, R. [Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States); Zingale, M [Stony Brook Univ., NY (United States)

2017-07-03

Performing high-resolution, high-fidelity, three-dimensional simulations of Type Ia supernovae (SNe Ia) requires not only algorithms that accurately represent the correct physics, but also codes that effectively harness the resources of the most powerful supercomputers. We are developing a suite of codes that provide the capability to perform end-to-end simulations of SNe Ia, from the early convective phase leading up to ignition to the explosion phase in which deflagration/detonation waves explode the star to the computation of the light curves resulting from the explosion. In this paper we discuss these codes with an emphasis on the techniques needed to scale them to petascale architectures. We also demonstrate our ability to map data from a low Mach number formulation to a compressible solver.

ArcticDEM Validation and Accuracy Assessment

Science.gov (United States)

Candela, S. G.; Howat, I.; Noh, M. J.; Porter, C. C.; Morin, P. J.

2017-12-01

ArcticDEM comprises a growing inventory Digital Elevation Models (DEMs) covering all land above 60°N. As of August, 2017, ArcticDEM had openly released 2-m resolution, individual DEM covering over 51 million km2, which includes areas of repeat coverage for change detection, as well as over 15 million km2 of 5-m resolution seamless mosaics. By the end of the project, over 80 million km2 of 2-m DEMs will be produced, averaging four repeats of the 20 million km2 Arctic landmass. ArcticDEM is produced from sub-meter resolution, stereoscopic imagery using open source software (SETSM) on the NCSA Blue Waters supercomputer. These DEMs have known biases of several meters due to errors in the sensor models generated from satellite positioning. These systematic errors are removed through three-dimensional registration to high-precision Lidar or other control datasets. ArcticDEM is registered to seasonally-subsetted ICESat elevations due its global coverage and high report accuracy ( 10 cm). The vertical accuracy of ArcticDEM is then obtained from the statistics of the fit to the ICESat point cloud, which averages -0.01 m ± 0.07 m. ICESat, however, has a relatively coarse measurement footprint ( 70 m) which may impact the precision of the registration. Further, the ICESat data predates the ArcticDEM imagery by a decade, so that temporal changes in the surface may also impact the registration. Finally, biases may exist between different the different sensors in the ArcticDEM constellation. Here we assess the accuracy of ArcticDEM and the ICESat registration through comparison to multiple high-resolution airborne lidar datasets that were acquired within one year of the imagery used in ArcticDEM. We find the ICESat dataset is performing as anticipated, introducing no systematic bias during the coregistration process, and reducing vertical errors to within the uncertainty of the airborne Lidars. Preliminary sensor comparisons show no significant difference post coregistration

Trends in computerized structural analysis and synthesis; Proceedings of the Symposium, Washington, D.C., October 30-November 1, 1978

Science.gov (United States)

Noor, A. K. (Editor); Mccomb, H. G., Jr.

1978-01-01

The subjects considered are related to future directions of structural applications and potential of new computing systems, advances and trends in data management and engineering software development, advances in applied mathematics and symbolic computing, computer-aided instruction and interactive computer graphics, nonlinear analysis, dynamic analysis and transient response, structural synthesis, structural analysis and design systems, advanced structural applications, supercomputers, numerical analysis, and trends in software systems. Attention is given to the reliability and optimality of the finite element method, computerized symbolic manipulation in structural mechanics, a standard computer graphics subroutine package, and a drag method as a finite element mesh generation scheme.

MODA A Framework for Memory Centric Performance Characterization

Energy Technology Data Exchange (ETDEWEB)

Shrestha, Sunil; Su, Chun-Yi; White, Amanda M.; Manzano Franco, Joseph B.; Marquez, Andres; Feo, John T.

2012-06-29

In the age of massive parallelism, the focus of performance analysis has switched from the processor and related structures to the memory and I/O resources. Adapting to this new reality, a performance analysis tool has to provide a way to analyze resource usage to pinpoint existing and potential problems in a given application. This paper provides an overview of the Memory Observant Data Analysis (MODA) tool, a memory-centric tool first implemented on the Cray XMT supercomputer. Throughout the paper, MODA's capabilities have been showcased with experiments done on matrix multiply and Graph-500 application codes.

SOME PARADIGMS OF ARTIFICIAL INTELLIGENCE IN FINANCIAL COMPUTER SYSTEMS

Directory of Open Access Journals (Sweden)

Jerzy Balicki

2015-12-01

Full Text Available The article discusses some paradigms of artificial intelligence in the context of their applications in computer financial systems. The proposed approach has a significant po-tential to increase the competitiveness of enterprises, including financial institutions. However, it requires the effective use of supercomputers, grids and cloud computing. A reference is made to the computing environment for Bitcoin. In addition, we characterized genetic programming and artificial neural networks to prepare investment strategies on the stock exchange market.

Migration of vectorized iterative solvers to distributed memory architectures

Energy Technology Data Exchange (ETDEWEB)

Pommerell, C. [AT& T Bell Labs., Murray Hill, NJ (United States); Ruehl, R. [CSCS-ETH, Manno (Switzerland)

1994-12-31

Both necessity and opportunity motivate the use of high-performance computers for iterative linear solvers. Necessity results from the size of the problems being solved-smaller problems are often better handled by direct methods. Opportunity arises from the formulation of the iterative methods in terms of simple linear algebra operations, even if this {open_quote}natural{close_quotes} parallelism is not easy to exploit in irregularly structured sparse matrices and with good preconditioners. As a result, high-performance implementations of iterative solvers have attracted a lot of interest in recent years. Most efforts are geared to vectorize or parallelize the dominating operation-structured or unstructured sparse matrix-vector multiplication, or to increase locality and parallelism by reformulating the algorithm-reducing global synchronization in inner products or local data exchange in preconditioners. Target architectures for iterative solvers currently include mostly vector supercomputers and architectures with one or few optimized (e.g., super-scalar and/or super-pipelined RISC) processors and hierarchical memory systems. More recently, parallel computers with physically distributed memory and a better price/performance ratio have been offered by vendors as a very interesting alternative to vector supercomputers. However, programming comfort on such distributed memory parallel processors (DMPPs) still lags behind. Here the authors are concerned with iterative solvers and their changing computing environment. In particular, they are considering migration from traditional vector supercomputers to DMPPs. Application requirements force one to use flexible and portable libraries. They want to extend the portability of iterative solvers rather than reimplementing everything for each new machine, or even for each new architecture.

Lattice gauge theory using parallel processors

International Nuclear Information System (INIS)

Lee, T.D.; Chou, K.C.; Zichichi, A.

1987-01-01

The book's contents include: Lattice Gauge Theory Lectures: Introduction and Current Fermion Simulations; Monte Carlo Algorithms for Lattice Gauge Theory; Specialized Computers for Lattice Gauge Theory; Lattice Gauge Theory at Finite Temperature: A Monte Carlo Study; Computational Method - An Elementary Introduction to the Langevin Equation, Present Status of Numerical Quantum Chromodynamics; Random Lattice Field Theory; The GF11 Processor and Compiler; and The APE Computer and First Physics Results; Columbia Supercomputer Project: Parallel Supercomputer for Lattice QCD; Statistical and Systematic Errors in Numerical Simulations; Monte Carlo Simulation for LGT and Programming Techniques on the Columbia Supercomputer; Food for Thought: Five Lectures on Lattice Gauge Theory

Multi-level programming paradigm for extreme computing

International Nuclear Information System (INIS)

Petiton, S.; Sato, M.; Emad, N.; Calvin, C.; Tsuji, M.; Dandouna, M.

2013-01-01

In order to propose a framework and programming paradigms for post peta-scale computing, on the road to exa-scale computing and beyond, we introduced new languages, associated with a hierarchical multi-level programming paradigm, allowing scientific end-users and developers to program highly hierarchical architectures designed for extreme computing. In this paper, we explain the interest of such hierarchical multi-level programming paradigm for extreme computing and its well adaptation to several large computational science applications, such as for linear algebra solvers used for reactor core physic. We describe the YML language and framework allowing describing graphs of parallel components, which may be developed using PGAS-like language such as XMP, scheduled and computed on supercomputers. Then, we propose experimentations on supercomputers (such as the 'K' and 'Hooper' ones) of the hybrid method MERAM (Multiple Explicitly Restarted Arnoldi Method) as a case study for iterative methods manipulating sparse matrices, and the block Gauss-Jordan method as a case study for direct method manipulating dense matrices. We conclude proposing evolutions for this programming paradigm. (authors)

A mesh density study for application to large deformation rolling process evaluation

International Nuclear Information System (INIS)

Martin, J.A.

1997-12-01

When addressing large deformation through an elastic-plastic analysis the mesh density is paramount in determining the accuracy of the solution. However, given the nonlinear nature of the problem, a highly-refined mesh will generally require a prohibitive amount of computer resources. This paper addresses finite element mesh optimization studies considering accuracy of results and computer resource needs as applied to large deformation rolling processes. In particular, the simulation of the thread rolling manufacturing process is considered using the MARC software package and a Cray C90 supercomputer. Both mesh density and adaptive meshing on final results for both indentation of a rigid body to a specified depth and contact rolling along a predetermined length are evaluated

NIC symposium 2012. 25 years HLRZ/NIC. Proceedings

International Nuclear Information System (INIS)

Binder, Kurt

2012-01-01

Since 25 years the John von Neumann Institute for Computing (NIC), the former ''Hoechstleistungsrechenzentrum'', plays a pioneering role in supporting research in computational science at the fore-front, by giving large grants of computer time to carefully selected research projects. The scope of these projects ranges from fundamental aspects of physics, such as the physics of elementary particles and nuclear physics, astrophysics, statistical physics and physics of condensed matter, computational chemistry and life sciences, to more applied areas of research, such as the modelling of processes in the atmosphere, materials science, fluid dynamics applications in engineering, etc. Use of the supercomputer resources that the Juelich Supercomputing Centre (JSC) provides for these research projects. The present book, which appears in the framework of the biannual NIC Symposia series, continues a tradition started 10 years ago, to present selected highlights of this research to a broader audience. Due to space restrictions, only a small number of the research projects that are carried out at the NIC can be presented in this way. Projects that stand out as particularly excellent are nominated as ''John von Neumann Excellence Project'' by the review board. In 2010 this award was given to A. Muramatsu (Stuttgart) for his project on ''Quantum Monte Carlo studies of strongly correlated systems''. In 2011, two such awards were given to C. Hoelbling (Wuppertal) for his project ''Computing B K with 2+1 flavours at the physical mass point'', and another one to W. Paul (Halle) for ''Long range correlations at polymer-solid interfaces''. The procedures adopted by the NIC to identify the scientifically best projects for the allocation of computer time are of the same character as those used by organisations founded more recently, such as (in Germany) the Gauss Centre for Supercomputing (GCS), an alliance of the three German national supercomputing centres in Juelich, Garching and

NIC symposium 2012. 25 years HLRZ/NIC. Proceedings

Energy Technology Data Exchange (ETDEWEB)

Binder, Kurt [Mainz Univ. (Germany). Inst. fuer Physik; Muenster, Gernot [Muenster Univ. (Germany). Inst. fuer Theoretische Physik 1; Kremer, Manfred [Forschungszentrum Juelich GmbH (DE). Juelich Supercomputing Centre (JSC)

2012-08-07

Since 25 years the John von Neumann Institute for Computing (NIC), the former ''Hoechstleistungsrechenzentrum'', plays a pioneering role in supporting research in computational science at the fore-front, by giving large grants of computer time to carefully selected research projects. The scope of these projects ranges from fundamental aspects of physics, such as the physics of elementary particles and nuclear physics, astrophysics, statistical physics and physics of condensed matter, computational chemistry and life sciences, to more applied areas of research, such as the modelling of processes in the atmosphere, materials science, fluid dynamics applications in engineering, etc. Use of the supercomputer resources that the Juelich Supercomputing Centre (JSC) provides for these research projects. The present book, which appears in the framework of the biannual NIC Symposia series, continues a tradition started 10 years ago, to present selected highlights of this research to a broader audience. Due to space restrictions, only a small number of the research projects that are carried out at the NIC can be presented in this way. Projects that stand out as particularly excellent are nominated as ''John von Neumann Excellence Project'' by the review board. In 2010 this award was given to A. Muramatsu (Stuttgart) for his project on ''Quantum Monte Carlo studies of strongly correlated systems''. In 2011, two such awards were given to C. Hoelbling (Wuppertal) for his project ''Computing B{sub K} with 2+1 flavours at the physical mass point'', and another one to W. Paul (Halle) for ''Long range correlations at polymer-solid interfaces''. The procedures adopted by the NIC to identify the scientifically best projects for the allocation of computer time are of the same character as those used by organisations founded more recently, such as (in Germany) the Gauss Centre for Supercomputing (GCS), an alliance of the three German national supercomputing centres in Juelich, Garching

NIC symposium 2012. 25 years HLRZ/NIC. Proceedings

Energy Technology Data Exchange (ETDEWEB)

Binder, Kurt [Mainz Univ. (Germany). Inst. fuer Physik; Muenster, Gernot [Muenster Univ. (Germany). Inst. fuer Theoretische Physik 1; Kremer, Manfred (eds.) [Forschungszentrum Juelich GmbH (DE). Juelich Supercomputing Centre (JSC)

2012-08-07

Since 25 years the John von Neumann Institute for Computing (NIC), the former ''Hoechstleistungsrechenzentrum'', plays a pioneering role in supporting research in computational science at the fore-front, by giving large grants of computer time to carefully selected research projects. The scope of these projects ranges from fundamental aspects of physics, such as the physics of elementary particles and nuclear physics, astrophysics, statistical physics and physics of condensed matter, computational chemistry and life sciences, to more applied areas of research, such as the modelling of processes in the atmosphere, materials science, fluid dynamics applications in engineering, etc. Use of the supercomputer resources that the Juelich Supercomputing Centre (JSC) provides for these research projects. The present book, which appears in the framework of the biannual NIC Symposia series, continues a tradition started 10 years ago, to present selected highlights of this research to a broader audience. Due to space restrictions, only a small number of the research projects that are carried out at the NIC can be presented in this way. Projects that stand out as particularly excellent are nominated as ''John von Neumann Excellence Project'' by the review board. In 2010 this award was given to A. Muramatsu (Stuttgart) for his project on ''Quantum Monte Carlo studies of strongly correlated systems''. In 2011, two such awards were given to C. Hoelbling (Wuppertal) for his project ''Computing B{sub K} with 2+1 flavours at the physical mass point'', and another one to W. Paul (Halle) for ''Long range correlations at polymer-solid interfaces''. The procedures adopted by the NIC to identify the scientifically best projects for the allocation of computer time are of the same character as those used by organisations founded more recently, such as (in Germany) the Gauss Centre for

Challenges and opportunities of cloud computing for atmospheric sciences

Science.gov (United States)

Pérez Montes, Diego A.; Añel, Juan A.; Pena, Tomás F.; Wallom, David C. H.

2016-04-01

Cloud computing is an emerging technological solution widely used in many fields. Initially developed as a flexible way of managing peak demand it has began to make its way in scientific research. One of the greatest advantages of cloud computing for scientific research is independence of having access to a large cyberinfrastructure to fund or perform a research project. Cloud computing can avoid maintenance expenses for large supercomputers and has the potential to 'democratize' the access to high-performance computing, giving flexibility to funding bodies for allocating budgets for the computational costs associated with a project. Two of the most challenging problems in atmospheric sciences are computational cost and uncertainty in meteorological forecasting and climate projections. Both problems are closely related. Usually uncertainty can be reduced with the availability of computational resources to better reproduce a phenomenon or to perform a larger number of experiments. Here we expose results of the application of cloud computing resources for climate modeling using cloud computing infrastructures of three major vendors and two climate models. We show how the cloud infrastructure compares in performance to traditional supercomputers and how it provides the capability to complete experiments in shorter periods of time. The monetary cost associated is also analyzed. Finally we discuss the future potential of this technology for meteorological and climatological applications, both from the point of view of operational use and research.

Spatiotemporal Variation of China’s State-Owned Construction Land Supply from 2003 to 2014

Directory of Open Access Journals (Sweden)

Min Jiang

2016-11-01

Full Text Available State-owned construction land is the dominant legal land source for construction in China and its supply influences urban expansion, house prices, and economic development, among other factors. Surprisingly, limited attention has been directly devoted to the spatiotemporal variation in land supply or the driving factors. This paper applied a centroid model and hotspot analysis, and created a newly increased construction land dependence-degree index (NCD to present the spatiotemporal variations of China’s construction land supply magnitude and pattern from 2003 to 2014, using land supply data from 339 cities. A two-way fixed effect model was introduced to reveal the influence of the socio-economic driving factors. The results showed that China’s state-owned construction land supply area (CLSA and newly increased construction land supply area (NCSA both increased during the period from 2003 to 2014, the geographic centroid of CLSA and NCSA moved northwest. NCD showed an overall increasing trend, and hotspots with high NCD migrated from the east region to the west region and shifted from an “east hot and west cold” pattern in 2003 to an “east cold and west hot” pattern in 2014. The gross domestic product (GDP has a U-shape effect on CLSA and NCD. The population, average annual wage of workers, and investment in fixed assets (fiv have positive effects on CLSA, and fiv also has a positive effect on NCD. The increasing ratio of tertiary industry added value to secondary industry added value reduces CLSA and NCD, and the effects of state policies vary from year to year. Different land supply policies should be implemented for cities in different development stages.

The next Generation of Exascale-class Systems: the ExaNeSt Project

OpenAIRE

R. Ammendolay; A. Biagioni; P. Cretaro; O. Frezza; F. Lo Cicero; A. Lonardo; M. Martinelli; P. S. Paolucci; E. Pastorelli; F. Simula; P. Vicini; G. Taffoni; J. Goodacree; M. Lujn; J. Navaridas

2017-01-01

The ExaNeSt project started on December 2015 and is funded by EU H2020 research framework (call H2020-FETHPC-2014, n. 671553) to study the adoption of low-cost, Linux-based power-efficient 64-bit ARM processors clusters for Exascale-class systems. The ExaNeSt consortium pools partners with industrial and academic research expertise in storage, interconnects and applications that share a vision of an European Exascale-class supercomputer. Their goal is designing and implementing a physical rac...

Final report on the Copper Mountain conference on multigrid methods

Energy Technology Data Exchange (ETDEWEB)

NONE

1997-10-01

The Copper Mountain Conference on Multigrid Methods was held on April 6-11, 1997. It took the same format used in the previous Copper Mountain Conferences on Multigrid Method conferences. Over 87 mathematicians from all over the world attended the meeting. 56 half-hour talks on current research topics were presented. Talks with similar content were organized into sessions. Session topics included: fluids; domain decomposition; iterative methods; basics; adaptive methods; non-linear filtering; CFD; applications; transport; algebraic solvers; supercomputing; and student paper winners.

20th and 21st Joint Workshop on Sustained Simulation Performance

CERN Document Server

Bez, Wolfgang; Focht, Erich; Kobayashi, Hiroaki; Qi, Jiaxing; Roller, Sabine

2015-01-01

The book presents the state of the art in high-performance computing and simulation on modern supercomputer architectures. It covers trends in hardware and software development in general, and the future of high-performance systems and heterogeneous architectures specifically. The application contributions cover computational fluid dynamics, material science, medical applications and climate research. Innovative fields like coupled multi-physics or multi-scale simulations are also discussed. All papers were chosen from presentations given at the 20th Workshop on Sustained Simulation Performance in December 2014 at the HLRS, University of Stuttgart, Germany, and the subsequent Workshop on Sustained Simulation Performance at Tohoku University in February 2015.  .

20th Joint Workshop on Sustained Simulation Performance

CERN Document Server

Bez, Wolfgang; Focht, Erich; Patel, Nisarg; Kobayashi, Hiroaki

2016-01-01

The book presents the state of the art in high-performance computing and simulation on modern supercomputer architectures. It explores general trends in hardware and software development, and then focuses specifically on the future of high-performance systems and heterogeneous architectures. It also covers applications such as computational fluid dynamics, material science, medical applications and climate research and discusses innovative fields like coupled multi-physics or multi-scale simulations. The papers included were selected from the presentations given at the 20th Workshop on Sustained Simulation Performance at the HLRS, University of Stuttgart, Germany in December 2015, and the subsequent Workshop on Sustained Simulation Performance at Tohoku University in February 2016.

18th and 19th Workshop on Sustained Simulation Performance

CERN Document Server

Bez, Wolfgang; Focht, Erich; Kobayashi, Hiroaki; Patel, Nisarg

2015-01-01

This book presents the state of the art in high-performance computing and simulation on modern supercomputer architectures. It covers trends in hardware and software development in general and the future of high-performance systems and heterogeneous architectures in particular. The application-related contributions cover computational fluid dynamics, material science, medical applications and climate research; innovative fields such as coupled multi-physics and multi-scale simulations are highlighted. All papers were chosen from presentations given at the 18th Workshop on Sustained Simulation Performance held at the HLRS, University of Stuttgart, Germany in October 2013 and subsequent Workshop of the same name held at Tohoku University in March 2014.  

Lawrence Livermore National Laboratory selects Intel Itanium 2 processors for world's most powerful Linux cluster

CERN Multimedia

2003-01-01

"Intel Corporation, system manufacturer California Digital and the University of California at Lawrence Livermore National Laboratory (LLNL) today announced they are building one of the world's most powerful supercomputers. The supercomputer project, codenamed "Thunder," uses nearly 4,000 Intel® Itanium® 2 processors... is expected to be complete in January 2004" (1 page).

MADmap: A Massively Parallel Maximum-Likelihood Cosmic Microwave Background Map-Maker

Energy Technology Data Exchange (ETDEWEB)

Cantalupo, Christopher; Borrill, Julian; Jaffe, Andrew; Kisner, Theodore; Stompor, Radoslaw

2009-06-09

MADmap is a software application used to produce maximum-likelihood images of the sky from time-ordered data which include correlated noise, such as those gathered by Cosmic Microwave Background (CMB) experiments. It works efficiently on platforms ranging from small workstations to the most massively parallel supercomputers. Map-making is a critical step in the analysis of all CMB data sets, and the maximum-likelihood approach is the most accurate and widely applicable algorithm; however, it is a computationally challenging task. This challenge will only increase with the next generation of ground-based, balloon-borne and satellite CMB polarization experiments. The faintness of the B-mode signal that these experiments seek to measure requires them to gather enormous data sets. MADmap is already being run on up to O(1011) time samples, O(108) pixels and O(104) cores, with ongoing work to scale to the next generation of data sets and supercomputers. We describe MADmap's algorithm based around a preconditioned conjugate gradient solver, fast Fourier transforms and sparse matrix operations. We highlight MADmap's ability to address problems typically encountered in the analysis of realistic CMB data sets and describe its application to simulations of the Planck and EBEX experiments. The massively parallel and distributed implementation is detailed and scaling complexities are given for the resources required. MADmap is capable of analysing the largest data sets now being collected on computing resources currently available, and we argue that, given Moore's Law, MADmap will be capable of reducing the most massive projected data sets.

Evolution of a minimal parallel programming model

International Nuclear Information System (INIS)

Lusk, Ewing; Butler, Ralph; Pieper, Steven C.

2017-01-01

Here, we take a historical approach to our presentation of self-scheduled task parallelism, a programming model with its origins in early irregular and nondeterministic computations encountered in automated theorem proving and logic programming. We show how an extremely simple task model has evolved into a system, asynchronous dynamic load balancing (ADLB), and a scalable implementation capable of supporting sophisticated applications on today’s (and tomorrow’s) largest supercomputers; and we illustrate the use of ADLB with a Green’s function Monte Carlo application, a modern, mature nuclear physics code in production use. Our lesson is that by surrendering a certain amount of generality and thus applicability, a minimal programming model (in terms of its basic concepts and the size of its application programmer interface) can achieve extreme scalability without introducing complexity.

THE ANALYSIS TOWARDS STATE APPARATUS COMMISSION ROLE IN ASN MANAGEMENT SYSTEM IN INDONESIA

Directory of Open Access Journals (Sweden)

Ajib Rakhmawanto

2015-05-01

Full Text Available In administrating bureaurcy business process, professional state apparatus are needed. Law number 5 of 2014 about the state civil apparatus mentions management based on merit that supposed to be supervised by an independen institution: State Apparatuss Commision (KASN. This article aims to analyze the KASN, and identify its task, function, and responsibilities. The analysis showed that KASN was formed to create professional state apparatus and supervise the merit system based management. The function of KASN becomes ineffective considering there is NCSA, an establish body with a role to supervise the ASN management. KASN will cause an overlapping and conflict of interest between the two institutions.

Parallel adaptation of a vectorised quantumchemical program system

International Nuclear Information System (INIS)

Van Corler, L.C.H.; Van Lenthe, J.H.

1987-01-01

Supercomputers, like the CRAY 1 or the Cyber 205, have had, and still have, a marked influence on Quantum Chemistry. Vectorization has led to a considerable increase in the performance of Quantum Chemistry programs. However, clockcycle times more than a factor 10 smaller than those of the present supercomputers are not to be expected. Therefore future supercomputers will have to depend on parallel structures. Recently, the first examples of such supercomputers have been installed. To be prepared for this new generation of (parallel) supercomputers one should consider the concepts one wants to use and the kind of problems one will encounter during implementation of existing vectorized programs on those parallel systems. The authors implemented four important parts of a large quantumchemical program system (ATMOL), i.e. integrals, SCF, 4-index and Direct-CI in the parallel environment at ECSEC (Rome, Italy). This system offers simulated parallellism on the host computer (IBM 4381) and real parallellism on at most 10 attached processors (FPS-164). Quantumchemical programs usually handle large amounts of data and very large, often sparse matrices. The transfer of that many data can cause problems concerning communication and overhead, in view of which shared memory and shared disks must be considered. The strategy and the tools that were used to parallellise the programs are shown. Also, some examples are presented to illustrate effectiveness and performance of the system in Rome for these type of calculations

Accelerating Scientific Applications using High Performance Dense and Sparse Linear Algebra Kernels on GPUs

KAUST Repository

Abdelfattah, Ahmad

2015-01-15

High performance computing (HPC) platforms are evolving to more heterogeneous configurations to support the workloads of various applications. The current hardware landscape is composed of traditional multicore CPUs equipped with hardware accelerators that can handle high levels of parallelism. Graphical Processing Units (GPUs) are popular high performance hardware accelerators in modern supercomputers. GPU programming has a different model than that for CPUs, which means that many numerical kernels have to be redesigned and optimized specifically for this architecture. GPUs usually outperform multicore CPUs in some compute intensive and massively parallel applications that have regular processing patterns. However, most scientific applications rely on crucial memory-bound kernels and may witness bottlenecks due to the overhead of the memory bus latency. They can still take advantage of the GPU compute power capabilities, provided that an efficient architecture-aware design is achieved. This dissertation presents a uniform design strategy for optimizing critical memory-bound kernels on GPUs. Based on hierarchical register blocking, double buffering and latency hiding techniques, this strategy leverages the performance of a wide range of standard numerical kernels found in dense and sparse linear algebra libraries. The work presented here focuses on matrix-vector multiplication kernels (MVM) as repre- sentative and most important memory-bound operations in this context. Each kernel inherits the benefits of the proposed strategies. By exposing a proper set of tuning parameters, the strategy is flexible enough to suit different types of matrices, ranging from large dense matrices, to sparse matrices with dense block structures, while high performance is maintained. Furthermore, the tuning parameters are used to maintain the relative performance across different GPU architectures. Multi-GPU acceleration is proposed to scale the performance on several devices. The

Evaluation of existing and proposed computer architectures for future ground-based systems

Science.gov (United States)

Schulbach, C.

1985-01-01

Parallel processing architectures and techniques used in current supercomputers are described and projections are made of future advances. Presently, the von Neumann sequential processing pattern has been accelerated by having separate I/O processors, interleaved memories, wide memories, independent functional units and pipelining. Recent supercomputers have featured single-input, multiple data stream architectures, which have different processors for performing various operations (vector or pipeline processors). Multiple input, multiple data stream machines have also been developed. Data flow techniques, wherein program instructions are activated only when data are available, are expected to play a large role in future supercomputers, along with increased parallel processor arrays. The enhanced operational speeds are essential for adequately treating data from future spacecraft remote sensing instruments such as the Thematic Mapper.

On The Export Control Of High Speed Imaging For Nuclear Weapons Applications

Energy Technology Data Exchange (ETDEWEB)

Watson, Scott Avery [Los Alamos National Lab. (LANL), Los Alamos, NM (United States); Altherr, Michael Robert [Los Alamos National Lab. (LANL), Los Alamos, NM (United States)

2017-09-15

Since the Manhattan Project, the use of high-speed photography, and its cousins flash radiography1 and schieleren photography have been a technological proliferation concern. Indeed, like the supercomputer, the development of high-speed photography as we now know it essentially grew out of the nuclear weapons program at Los Alamos2,3,4. Naturally, during the course of the last 75 years the technology associated with computers and cameras has been export controlled by the United States and others to prevent both proliferation among non-P5-nations and technological parity among potential adversaries among P5 nations. Here we revisit these issues as they relate to high-speed photographic technologies and make recommendations about how future restrictions, if any, should be guided.

Applied techniques for high bandwidth data transfers across wide area networks

International Nuclear Information System (INIS)

Lee, J.; Gunter, D.; Tierney, B.; Allcock, B.; Bester, J.; Bresnahan, J.; Tuecke, S.

2001-01-01

Large distributed systems such as Computational/Data Grids require large amounts of data to be co-located with the computing facilities for processing. From their work developing a scalable distributed network cache, the authors have gained experience with techniques necessary to achieve high data throughput over high bandwidth Wide Area Networks (WAN). The authors discuss several hardware and software design techniques, and then describe their application to an implementation of an enhanced FTP protocol called GridFTP. The authors describe results from the Supercomputing 2000 conference

14th annual Results and Review Workshop on High Performance Computing in Science and Engineering

CERN Document Server

Nagel, Wolfgang E; Resch, Michael M; Transactions of the High Performance Computing Center, Stuttgart (HLRS) 2011; High Performance Computing in Science and Engineering '11

2012-01-01

This book presents the state-of-the-art in simulation on supercomputers. Leading researchers present results achieved on systems of the High Performance Computing Center Stuttgart (HLRS) for the year 2011. The reports cover all fields of computational science and engineering, ranging from CFD to computational physics and chemistry, to computer science, with a special emphasis on industrially relevant applications. Presenting results for both vector systems and microprocessor-based systems, the book allows readers to compare the performance levels and usability of various architectures. As HLRS

Advanced Architectures for Astrophysical Supercomputing

Science.gov (United States)

Barsdell, B. R.; Barnes, D. G.; Fluke, C. J.

2010-12-01

Astronomers have come to rely on the increasing performance of computers to reduce, analyze, simulate and visualize their data. In this environment, faster computation can mean more science outcomes or the opening up of new parameter spaces for investigation. If we are to avoid major issues when implementing codes on advanced architectures, it is important that we have a solid understanding of our algorithms. A recent addition to the high-performance computing scene that highlights this point is the graphics processing unit (GPU). The hardware originally designed for speeding-up graphics rendering in video games is now achieving speed-ups of O(100×) in general-purpose computation - performance that cannot be ignored. We are using a generalized approach, based on the analysis of astronomy algorithms, to identify the optimal problem-types and techniques for taking advantage of both current GPU hardware and future developments in computing architectures.

ASCI's Vision for supercomputing future

International Nuclear Information System (INIS)

Nowak, N.D.

2003-01-01

The full text of publication follows. Advanced Simulation and Computing (ASC, formerly Accelerated Strategic Computing Initiative [ASCI]) was established in 1995 to help Defense Programs shift from test-based confidence to simulation-based confidence. Specifically, ASC is a focused and balanced program that is accelerating the development of simulation capabilities needed to analyze and predict the performance, safety, and reliability of nuclear weapons and certify their functionality - far exceeding what might have been achieved in the absence of a focused initiative. To realize its vision, ASC is creating simulation and proto-typing capabilities, based on advanced weapon codes and high-performance computing

Supercomputer requirements for theoretical chemistry

International Nuclear Information System (INIS)

Walker, R.B.; Hay, P.J.; Galbraith, H.W.

1980-01-01

Many problems important to the theoretical chemist would, if implemented in their full complexity, strain the capabilities of today's most powerful computers. Several such problems are now being implemented on the CRAY-1 computer at Los Alamos. Examples of these problems are taken from the fields of molecular electronic structure calculations, quantum reactive scattering calculations, and quantum optics. 12 figures

The World Wide Web and Technology Transfer at NASA Langley Research Center

Science.gov (United States)

Nelson, Michael L.; Bianco, David J.

1994-01-01

NASA Langley Research Center (LaRC) began using the World Wide Web (WWW) in the summer of 1993, becoming the first NASA installation to provide a Center-wide home page. This coincided with a reorganization of LaRC to provide a more concentrated focus on technology transfer to both aerospace and non-aerospace industry. Use of the WWW and NCSA Mosaic not only provides automated information dissemination, but also allows for the implementation, evolution and integration of many technology transfer applications. This paper describes several of these innovative applications, including the on-line presentation of the entire Technology Opportunities Showcase (TOPS), an industrial partnering showcase that exists on the Web long after the actual 3-day event ended. During its first year on the Web, LaRC also developed several WWW-based information repositories. The Langley Technical Report Server (LTRS), a technical paper delivery system with integrated searching and retrieval, has proved to be quite popular. The NASA Technical Report Server (NTRS), an outgrowth of LTRS, provides uniform access to many logically similar, yet physically distributed NASA report servers. WWW is also the foundation of the Langley Software Server (LSS), an experimental software distribution system which will distribute LaRC-developed software with the possible phase-out of NASA's COSMIC program. In addition to the more formal technology distribution projects, WWW has been successful in connecting people with technologies and people with other people. With the completion of the LaRC reorganization, the Technology Applications Group, charged with interfacing with non-aerospace companies, opened for business with a popular home page.

Report on the achievements in fiscal 1999 of research and development of fusion zones. Calculation science; 1999 nendo yugo ryoiki kenkyu kaihatsu seika hokokusho. Keisan kagaku

Energy Technology Data Exchange (ETDEWEB)

NONE

2000-03-01

In order to elucidate the mechanism for specific phenomena from the atom scale to the meso-scale, developmental research has been performed on a fusion type calculation method. This paper reports the achievements in fiscal 1999. In planning the policy of structuring the program package TACPAC and its application method, the program for materials STATE using the classical molecule dynamics method and the biological program, Peach, were selected as the programs to act as the nuclei. In continuing performance improvements respectively in the computer programs to be fused, and improving the performance of the software fused with them, the programs were transferred into a super-computer. As a result, it was found that the classical and the first principle quantum molecular dynamics method program STATE can be executed at high efficiency on the super-computer. In executing the challenging computer simulation and developing a calculation method for large scale systems, researches were performed on alcohol synthesizing reaction on copper surface and the status of association of gene DNA molecules with enzymes, and development was carried out on a matrix generation method to calculate non-empirical molecule trajectories of the large scale systems. (NEDO)

Massive hybrid parallelism for fully implicit multiphysics

International Nuclear Information System (INIS)

Gaston, D. R.; Permann, C. J.; Andrs, D.; Peterson, J. W.

2013-01-01

As hardware advances continue to modify the supercomputing landscape, traditional scientific software development practices will become more outdated, ineffective, and inefficient. The process of rewriting/retooling existing software for new architectures is a Sisyphean task, and results in substantial hours of development time, effort, and money. Software libraries which provide an abstraction of the resources provided by such architectures are therefore essential if the computational engineering and science communities are to continue to flourish in this modern computing environment. The Multiphysics Object Oriented Simulation Environment (MOOSE) framework enables complex multiphysics analysis tools to be built rapidly by scientists, engineers, and domain specialists, while also allowing them to both take advantage of current HPC architectures, and efficiently prepare for future supercomputer designs. MOOSE employs a hybrid shared-memory and distributed-memory parallel model and provides a complete and consistent interface for creating multiphysics analysis tools. In this paper, a brief discussion of the mathematical algorithms underlying the framework and the internal object-oriented hybrid parallel design are given. Representative massively parallel results from several applications areas are presented, and a brief discussion of future areas of research for the framework are provided. (authors)

Progress on H5Part: A Portable High Performance Parallel Data Interface for Electromagnetics Simulations

International Nuclear Information System (INIS)

Adelmann, Andreas; Gsell, Achim; Oswald, Benedikt; Schietinger, Thomas; Bethel, Wes; Shalf, John; Siegerist, Cristina; Stockinger, Kurt

2007-01-01

Significant problems facing all experimental and computational sciences arise from growing data size and complexity. Common to all these problems is the need to perform efficient data I/O on diverse computer architectures. In our scientific application, the largest parallel particle simulations generate vast quantities of six-dimensional data. Such a simulation run produces data for an aggregate data size up to several TB per run. Motivated by the need to address data I/O and access challenges, we have implemented H5Part, an open source data I/O API that simplifies the use of the Hierarchical Data Format v5 library (HDF5). HDF5 is an industry standard for high performance, cross-platform data storage and retrieval that runs on all contemporary architectures from large parallel supercomputers to laptops. H5Part, which is oriented to the needs of the particle physics and cosmology communities, provides support for parallel storage and retrieval of particles, structured and in the future unstructured meshes. In this paper, we describe recent work focusing on I/O support for particles and structured meshes and provide data showing performance on modern supercomputer architectures like the IBM POWER 5

Time-dependent density-functional theory in massively parallel computer architectures: the OCTOPUS project.

Science.gov (United States)

Andrade, Xavier; Alberdi-Rodriguez, Joseba; Strubbe, David A; Oliveira, Micael J T; Nogueira, Fernando; Castro, Alberto; Muguerza, Javier; Arruabarrena, Agustin; Louie, Steven G; Aspuru-Guzik, Alán; Rubio, Angel; Marques, Miguel A L

2012-06-13

Octopus is a general-purpose density-functional theory (DFT) code, with a particular emphasis on the time-dependent version of DFT (TDDFT). In this paper we present the ongoing efforts to achieve the parallelization of octopus. We focus on the real-time variant of TDDFT, where the time-dependent Kohn-Sham equations are directly propagated in time. This approach has great potential for execution in massively parallel systems such as modern supercomputers with thousands of processors and graphics processing units (GPUs). For harvesting the potential of conventional supercomputers, the main strategy is a multi-level parallelization scheme that combines the inherent scalability of real-time TDDFT with a real-space grid domain-partitioning approach. A scalable Poisson solver is critical for the efficiency of this scheme. For GPUs, we show how using blocks of Kohn-Sham states provides the required level of data parallelism and that this strategy is also applicable for code optimization on standard processors. Our results show that real-time TDDFT, as implemented in octopus, can be the method of choice for studying the excited states of large molecular systems in modern parallel architectures.

Time-dependent density-functional theory in massively parallel computer architectures: the octopus project

Science.gov (United States)

Andrade, Xavier; Alberdi-Rodriguez, Joseba; Strubbe, David A.; Oliveira, Micael J. T.; Nogueira, Fernando; Castro, Alberto; Muguerza, Javier; Arruabarrena, Agustin; Louie, Steven G.; Aspuru-Guzik, Alán; Rubio, Angel; Marques, Miguel A. L.

2012-06-01

Octopus is a general-purpose density-functional theory (DFT) code, with a particular emphasis on the time-dependent version of DFT (TDDFT). In this paper we present the ongoing efforts to achieve the parallelization of octopus. We focus on the real-time variant of TDDFT, where the time-dependent Kohn-Sham equations are directly propagated in time. This approach has great potential for execution in massively parallel systems such as modern supercomputers with thousands of processors and graphics processing units (GPUs). For harvesting the potential of conventional supercomputers, the main strategy is a multi-level parallelization scheme that combines the inherent scalability of real-time TDDFT with a real-space grid domain-partitioning approach. A scalable Poisson solver is critical for the efficiency of this scheme. For GPUs, we show how using blocks of Kohn-Sham states provides the required level of data parallelism and that this strategy is also applicable for code optimization on standard processors. Our results show that real-time TDDFT, as implemented in octopus, can be the method of choice for studying the excited states of large molecular systems in modern parallel architectures.

Time-dependent density-functional theory in massively parallel computer architectures: the octopus project

International Nuclear Information System (INIS)

Andrade, Xavier; Aspuru-Guzik, Alán; Alberdi-Rodriguez, Joseba; Rubio, Angel; Strubbe, David A; Louie, Steven G; Oliveira, Micael J T; Nogueira, Fernando; Castro, Alberto; Muguerza, Javier; Arruabarrena, Agustin; Marques, Miguel A L

2012-01-01

Octopus is a general-purpose density-functional theory (DFT) code, with a particular emphasis on the time-dependent version of DFT (TDDFT). In this paper we present the ongoing efforts to achieve the parallelization of octopus. We focus on the real-time variant of TDDFT, where the time-dependent Kohn-Sham equations are directly propagated in time. This approach has great potential for execution in massively parallel systems such as modern supercomputers with thousands of processors and graphics processing units (GPUs). For harvesting the potential of conventional supercomputers, the main strategy is a multi-level parallelization scheme that combines the inherent scalability of real-time TDDFT with a real-space grid domain-partitioning approach. A scalable Poisson solver is critical for the efficiency of this scheme. For GPUs, we show how using blocks of Kohn-Sham states provides the required level of data parallelism and that this strategy is also applicable for code optimization on standard processors. Our results show that real-time TDDFT, as implemented in octopus, can be the method of choice for studying the excited states of large molecular systems in modern parallel architectures. (topical review)

Massive hybrid parallelism for fully implicit multiphysics

Energy Technology Data Exchange (ETDEWEB)

Gaston, D. R.; Permann, C. J.; Andrs, D.; Peterson, J. W. [Idaho National Laboratory, 2525 N. Fremont Ave., Idaho Falls, ID 83415 (United States)

2013-07-01

As hardware advances continue to modify the supercomputing landscape, traditional scientific software development practices will become more outdated, ineffective, and inefficient. The process of rewriting/retooling existing software for new architectures is a Sisyphean task, and results in substantial hours of development time, effort, and money. Software libraries which provide an abstraction of the resources provided by such architectures are therefore essential if the computational engineering and science communities are to continue to flourish in this modern computing environment. The Multiphysics Object Oriented Simulation Environment (MOOSE) framework enables complex multiphysics analysis tools to be built rapidly by scientists, engineers, and domain specialists, while also allowing them to both take advantage of current HPC architectures, and efficiently prepare for future supercomputer designs. MOOSE employs a hybrid shared-memory and distributed-memory parallel model and provides a complete and consistent interface for creating multiphysics analysis tools. In this paper, a brief discussion of the mathematical algorithms underlying the framework and the internal object-oriented hybrid parallel design are given. Representative massively parallel results from several applications areas are presented, and a brief discussion of future areas of research for the framework are provided. (authors)

MASSIVE HYBRID PARALLELISM FOR FULLY IMPLICIT MULTIPHYSICS

Energy Technology Data Exchange (ETDEWEB)

Cody J. Permann; David Andrs; John W. Peterson; Derek R. Gaston

2013-05-01

As hardware advances continue to modify the supercomputing landscape, traditional scientific software development practices will become more outdated, ineffective, and inefficient. The process of rewriting/retooling existing software for new architectures is a Sisyphean task, and results in substantial hours of development time, effort, and money. Software libraries which provide an abstraction of the resources provided by such architectures are therefore essential if the computational engineering and science communities are to continue to flourish in this modern computing environment. The Multiphysics Object Oriented Simulation Environment (MOOSE) framework enables complex multiphysics analysis tools to be built rapidly by scientists, engineers, and domain specialists, while also allowing them to both take advantage of current HPC architectures, and efficiently prepare for future supercomputer designs. MOOSE employs a hybrid shared-memory and distributed-memory parallel model and provides a complete and consistent interface for creating multiphysics analysis tools. In this paper, a brief discussion of the mathematical algorithms underlying the framework and the internal object-oriented hybrid parallel design are given. Representative massively parallel results from several applications areas are presented, and a brief discussion of future areas of research for the framework are provided.

Contribution to the algorithmic and efficient programming of new parallel architectures including accelerators for neutron physics and shielding computations

International Nuclear Information System (INIS)

Dubois, J.

2011-01-01

In science, simulation is a key process for research or validation. Modern computer technology allows faster numerical experiments, which are cheaper than real models. In the field of neutron simulation, the calculation of eigenvalues is one of the key challenges. The complexity of these problems is such that a lot of computing power may be necessary. The work of this thesis is first the evaluation of new computing hardware such as graphics card or massively multi-core chips, and their application to eigenvalue problems for neutron simulation. Then, in order to address the massive parallelism of supercomputers national, we also study the use of asynchronous hybrid methods for solving eigenvalue problems with this very high level of parallelism. Then we experiment the work of this research on several national supercomputers such as the Titane hybrid machine of the Computing Center, Research and Technology (CCRT), the Curie machine of the Very Large Computing Centre (TGCC), currently being installed, and the Hopper machine at the Lawrence Berkeley National Laboratory (LBNL). We also do our experiments on local workstations to illustrate the interest of this research in an everyday use with local computing resources. (author) [fr

PyMercury: Interactive Python for the Mercury Monte Carlo Particle Transport Code

International Nuclear Information System (INIS)

Iandola, F.N.; O'Brien, M.J.; Procassini, R.J.

2010-01-01

Monte Carlo particle transport applications are often written in low-level languages (C/C++) for optimal performance on clusters and supercomputers. However, this development approach often sacrifices straightforward usability and testing in the interest of fast application performance. To improve usability, some high-performance computing applications employ mixed-language programming with high-level and low-level languages. In this study, we consider the benefits of incorporating an interactive Python interface into a Monte Carlo application. With PyMercury, a new Python extension to the Mercury general-purpose Monte Carlo particle transport code, we improve application usability without diminishing performance. In two case studies, we illustrate how PyMercury improves usability and simplifies testing and validation in a Monte Carlo application. In short, PyMercury demonstrates the value of interactive Python for Monte Carlo particle transport applications. In the future, we expect interactive Python to play an increasingly significant role in Monte Carlo usage and testing.

Application of an upwind Navier-Stokes code to two-dimensional transonic airfoil flow

International Nuclear Information System (INIS)

Rumsey, C.L.; Thomas, J.L.; Anderson, W.K.; Taylor, S.L.

1987-01-01

An upwind-biased implicit approximate factorization Navier-Stokes algorithm is applied to a variety of steady transonic airfoil cases, using the NACA 0012, RAE 2822, and Jones supercritical airfoils. The thin-layer form of the compressible Navier-Stokes equations is used. Both the CYBER 205 and CRAY 2 supercomputers are utilized, with average computational speeds of about 18 and 16 microsec/gridpoint/iteration, respectively. Lift curves, drag polars, and variations in drag coefficient with Mach number are determined for the NACA 0012 and Jones supercritical airfoils. Also, several cases are computed for comparison with experiment. The effect of grid density and grid extent on a typical turbulent airfoil solution is shown. An algebraic eddy-viscosity turbulence model is used for all of the computations. 10 references

Neutron beam testing of triblades

Energy Technology Data Exchange (ETDEWEB)

Michalak, Sarah E [Los Alamos National Laboratory; Du Bois, Andrew J [Los Alamos National Laboratory; Storlie, Curtis B [Los Alamos National Laboratory; Rust, William N [Los Alamos National Laboratory; Du Bois, David H [Los Alamos National Laboratory; Modl, David G [Los Alamos National Laboratory; Quinn, Heather M [Los Alamos National Laboratory; Blanchard, Sean P [Los Alamos National Laboratory; Manuzzato, Andrea [UNIV DEGLI STUDI DI PADOVA ITALY

2010-12-16

Four IBM Triblades were tested in the Irradiation of Chips and Electronics facility at the Los Alamos Neutron Science Center. Triblades include two dual-core Opteron processors and four PowerXCell 8i (Cell) processors. The Triblades were tested in their field configuration while running different applications, with the beam aimed at the Cell processor or the Opteron running the application. Testing focused on the Cell processors, which were tested while running five different applications and an idle condition. While neither application nor Triblade was statistically important in predicting the hazard rate, the hazard rate when the beam was aimed at the Opterons was significantly higher than when it was aimed at the Cell processors. In addition, four Cell blades (one in each Triblade) suffered voltage shorts, leading to their inoperability. The hardware tested is the same as that in the Roadrunner supercomputer.

Development of in-situ visualization tool for PIC simulation

International Nuclear Information System (INIS)

Ohno, Nobuaki; Ohtani, Hiroaki

2014-01-01

As the capability of a supercomputer is improved, the sizes of simulation and its output data also become larger and larger. Visualization is usually carried out on a researcher's PC with interactive visualization software after performing the computer simulation. However, the data size is becoming too large to do it currently. A promising answer is in-situ visualization. For this case a simulation code is coupled with the visualization code and visualization is performed with the simulation on the same supercomputer. We developed an in-situ visualization tool for particle-in-cell (PIC) simulation and it is provided as a Fortran's module. We coupled it with a PIC simulation code and tested the coupled code on Plasma Simulator supercomputer, and ensured that it works. (author)

Applied techniques for high bandwidth data transfers across wide area networks

International Nuclear Information System (INIS)

Lee, Jason; Gunter, Dan; Tierney, Brian; Allcock, Bill; Bester, Joe; Bresnahan, John; Tuecke, Steve

2001-01-01

Large distributed systems such as Computational/Data Grids require large amounts of data to be co-located with the computing facilities for processing. Ensuring that the data is there in time for the computation in today's Internet is a massive problem. From our work developing a scalable distributed network cache, we have gained experience with techniques necessary to achieve high data throughput over high bandwidth Wide Area Networks (WAN). In this paper, we discuss several hardware and software design techniques and issues, and then describe their application to an implementation of an enhanced FTP protocol called GridFTP. We also describe results from two applications using these techniques, which were obtained at the Supercomputing 2000 conference

Progress in complementary metal–oxide–semiconductor silicon photonics and optoelectronic integrated circuits

International Nuclear Information System (INIS)

Chen Hongda; Zhang Zan; Huang Beiju; Mao Luhong; Zhang Zanyun

2015-01-01

Silicon photonics is an emerging competitive solution for next-generation scalable data communications in different application areas as high-speed data communication is constrained by electrical interconnects. Optical interconnects based on silicon photonics can be used in intra/inter-chip interconnects, board-to-board interconnects, short-reach communications in datacenters, supercomputers and long-haul optical transmissions. In this paper, we present an overview of recent progress in silicon optoelectronic devices and optoelectronic integrated circuits (OEICs) based on a complementary metal–oxide–semiconductor-compatible process, and focus on our research contributions. The silicon optoelectronic devices and OEICs show good characteristics, which are expected to benefit several application domains, including communication, sensing, computing and nonlinear systems. (review)

Data Flow for the TERRA-REF project

Science.gov (United States)

Kooper, R.; Burnette, M.; Maloney, J.; LeBauer, D.

2017-12-01

The Transportation Energy Resources from Renewable Agriculture Phenotyping Reference Platform (TERRA-REF) program aims to identify crop traits that are best suited to producing high-energy sustainable biofuels and match those plant characteristics to their genes to speed the plant breeding process. One tool used to achieve this goal is a high-throughput phenotyping robot outfitted with sensors and cameras to monitor the growth of 1.25 acres of sorghum. Data types range from hyperspectral imaging to 3D reconstructions and thermal profiles, all at 1mm resolution. This system produces thousands of daily measurements with high spatiotemporal resolution. The team at NCSA processes, annotates, organizes and stores the massive amounts of data produced by this system - up to 5 TB per day. Data from the sensors is streamed to a local gantry-cache server. The standardized sensor raw data stream is automatically and securely delivered to NCSA using Globus Connect service. Once files have been successfully received by the Globus endpoint, the files are removed from the gantry-cache server. As each dataset arrives or is created the Clowder system automatically triggers different software tools to analyze each file, extract information, and convert files to a common format. Other tools can be triggered to run after all required data is uploaded. For example, a stitched image of the entire field is created after all images of the field become available. Some of these tools were developed by external collaborators based on predictive models and algorithms, others were developed as part of other projects and could be leveraged by the TERRA project. Data will be stored for the lifetime of the project and is estimated to reach 10 PB over 3 years. The Clowder system, BETY and other systems will allow users to easily find data by browsing or searching the extracted information.

Computational approach to large quantum dynamical problems

International Nuclear Information System (INIS)

Friesner, R.A.; Brunet, J.P.; Wyatt, R.E.; Leforestier, C.; Binkley, S.

1987-01-01

The organizational structure is described for a new program that permits computations on a variety of quantum mechanical problems in chemical dynamics and spectroscopy. Particular attention is devoted to developing and using algorithms that exploit the capabilities of current vector supercomputers. A key component in this procedure is the recursive transformation of the large sparse Hamiltonian matrix into a much smaller tridiagonal matrix. An application to time-dependent laser molecule energy transfer is presented. Rate of energy deposition in the multimode molecule for systematic variations in the molecular intermode coupling parameters is emphasized

Advances in software science and technology

CERN Document Server

Hikita, Teruo; Kakuda, Hiroyasu

1993-01-01

Advances in Software Science and Technology, Volume 4 provides information pertinent to the advancement of the science and technology of computer software. This book discusses the various applications for computer systems.Organized into two parts encompassing 10 chapters, this volume begins with an overview of the historical survey of programming languages for vector/parallel computers in Japan and describes compiling methods for supercomputers in Japan. This text then explains the model of a Japanese software factory, which is presented by the logical configuration that has been satisfied by

MR-AFS: a global hierarchical file-system

International Nuclear Information System (INIS)

Reuter, H.

2000-01-01

The next generation of fusion experiments will use object-oriented technology creating the need for world wide sharing of an underlying hierarchical file-system. The Andrew file system (AFS) is a well known and widely spread global distributed file-system. Multiple-resident-AFS (MR-AFS) combines the features of AFS with hierarchical storage management systems. Files in MR-AFS therefore may be migrated on secondary storage, such as roboted tape libraries. MR-AFS is in use at IPP for the current experiments and data originating from super-computer applications. Experiences and scalability issues are discussed

The application of neural network techniques to magnetic and optical inverse problems

International Nuclear Information System (INIS)

Jones, H.V.

2000-12-01

The processing power of the computer has increased at unimaginable rates over the last few decades. However, even today's fastest computer can take several hours to find solutions to some mathematical problems; and there are instances where a high powered supercomputer may be impractical, with the need for near instant solutions just as important (such as in an on-line testing system). This led us to believe that such complex problems could be solved using a novel approach, whereby the system would have prior knowledge about the expected solutions through a process of learning. One method of approaching this kind of problem is through the use of machine learning. Just as a human can be trained and is able to learn from past experiences, a machine is can do just the same. This is the concept of neural networks. The research which was conducted involves the investigation of various neural network techniques, and their applicability to solve some known complex inverse problems in the field of magnetic and optical recording. In some cases a comparison is also made to more conventional methods of solving the problems, from which it was possible to outline some key advantages of using a neural network approach. We initially investigated the application of neural networks to transverse susceptibility data in order to determine anisotropy distributions. This area of research is proving to be very important, as it gives us information about the switching field distribution, which then determines the minimum transition width achievable in a medium, and affects the overwrite characteristics of the media. Secondly, we investigated a similar situation, but applied to an optical problem. This involved the determination of important compact disc parameters from the diffraction pattern of a laser from a disc. This technique was then intended for use in an on-line testing system. Finally we investigated another area of neural networks with the analysis of magnetisation maps and

Recent CFD Simulations of turbulent reactive flows with supercomputing for hydrogen safety

International Nuclear Information System (INIS)

Rehm, W.

2001-01-01

This paper describes the R and D work performed within the scope of joint project activities concerning the numerical simulation of reacting flow in complex geometries. The aim is the refinement of numerical methods used in computational fluid dynamics (CFD) by introducing high-performance computations (HPC) to analyse explosion processes in technical systems in more detail. Application examples concern conventional and nuclear energy systems, especially the safety aspects of future hydrogen technology. The project work is mainly focused on the modelling of the accident-related behaviour of hydrogen in safety enclosures regarding the distribution and combustion of burnable gas mixtures, ranging from slow to fast or even rapid flames. For fire and explosion protection, special models and criteria are being developed for the assessment of adequate safety measures to control deflagration-to-detonation transition (DDT) processes. Therefore, the physical mixing concept with dilution and inertization media is studied and recommended. (orig.) [de

BDML Metadata: 171 [SSBD[Archive

Lifescience Database Archive (English)

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Supporting geoscience with graphical-user-interface Internet tools for the Macintosh

Science.gov (United States)

Robin, Bernard

1995-07-01

This paper describes a suite of Macintosh graphical-user-interface (GUI) software programs that can be used in conjunction with the Internet to support geoscience education. These software programs allow science educators to access and retrieve a large body of resources from an increasing number of network sites, taking advantage of the intuitive, simple-to-use Macintosh operating system. With these tools, educators easily can locate, download, and exchange not only text files but also sound resources, video movie clips, and software application files from their desktop computers. Another major advantage of these software tools is that they are available at no cost and may be distributed freely. The following GUI software tools are described including examples of how they can be used in an educational setting: ∗ Eudora—an e-mail program ∗ NewsWatcher—a newsreader ∗ TurboGopher—a Gopher program ∗ Fetch—a software application for easy File Transfer Protocol (FTP) ∗ NCSA Mosaic—a worldwide hypertext browsing program. An explosive growth of online archives currently is underway as new electronic sites are being added continuously to the Internet. Many of these resources may be of interest to science educators who learn they can share not only ASCII text files, but also graphic image files, sound resources, QuickTime movie clips, and hypermedia projects with colleagues from locations around the world. These powerful, yet simple to learn GUI software tools are providing a revolution in how knowledge can be accessed, retrieved, and shared.

Aviation Research and the Internet

Science.gov (United States)

Scott, Antoinette M.

1995-01-01

The Internet is a network of networks. It was originally funded by the Defense Advanced Research Projects Agency or DOD/DARPA and evolved in part from the connection of supercomputer sites across the United States. The National Science Foundation (NSF) made the most of their supercomputers by connecting the sites to each other. This made the supercomputers more efficient and now allows scientists, engineers and researchers to access the supercomputers from their own labs and offices. The high speed networks that connect the NSF supercomputers form the backbone of the Internet. The World Wide Web (WWW) is a menu system. It gathers Internet resources from all over the world into a series of screens that appear on your computer. The WWW is also a distributed. The distributed system stores data information on many computers (servers). These servers can go out and get data when you ask for it. Hypermedia is the base of the WWW. One can 'click' on a section and visit other hypermedia (pages). Our approach to demonstrating the importance of aviation research through the Internet began with learning how to put pages on the Internet (on-line) ourselves. We were assigned two aviation companies; Vision Micro Systems Inc. and Innovative Aerodynamic Technologies (IAT). We developed home pages for these SBIR companies. The equipment used to create the pages were the UNIX and Macintosh machines. HTML Supertext software was used to write the pages and the Sharp JX600S scanner to scan the images. As a result, with the use of the UNIX, Macintosh, Sun, PC, and AXIL machines, we were able to present our home pages to over 800,000 visitors.

Fast methods for long-range interactions in complex systems. Lecture notes

Energy Technology Data Exchange (ETDEWEB)

Sutmann, Godehard; Gibbon, Paul; Lippert, Thomas (eds.)

2011-10-13

Parallel computing and computer simulations of complex particle systems including charges have an ever increasing impact in a broad range of fields in the physical sciences, e.g. in astrophysics, statistical physics, plasma physics, material sciences, physical chemistry, and biophysics. The present summer school, funded by the German Heraeus-Foundation, took place at the Juelich Supercomputing Centre from 6 - 10 September 2010. The focus was on providing an introduction and overview over different methods, algorithms and new trends for the computational treatment of long-range interactions in particle systems. The Lecture Notes contain an introduction into particle simulation, as well as five different fast methods, i.e. the Fast Multipole Method, Barnes-Hut Tree Method, Multigrid, FFT based methods, and Fast Summation using the non-equidistant FFT. In addition to introducing the methods, efficient parallelization of the methods is presented in detail. This publication was edited at the Juelich Supercomputing Centre (JSC) which is an integral part of the Institute for Advanced Simulation (IAS). The IAS combines the Juelich simulation sciences and the supercomputer facility in one organizational unit. It includes those parts of the scientific institutes at Forschungszentrum Juelich which use simulation on supercomputers as their main research methodology. (orig.)

Fast methods for long-range interactions in complex systems. Lecture notes

International Nuclear Information System (INIS)

Sutmann, Godehard; Gibbon, Paul; Lippert, Thomas

2011-01-01

Parallel computing and computer simulations of complex particle systems including charges have an ever increasing impact in a broad range of fields in the physical sciences, e.g. in astrophysics, statistical physics, plasma physics, material sciences, physical chemistry, and biophysics. The present summer school, funded by the German Heraeus-Foundation, took place at the Juelich Supercomputing Centre from 6 - 10 September 2010. The focus was on providing an introduction and overview over different methods, algorithms and new trends for the computational treatment of long-range interactions in particle systems. The Lecture Notes contain an introduction into particle simulation, as well as five different fast methods, i.e. the Fast Multipole Method, Barnes-Hut Tree Method, Multigrid, FFT based methods, and Fast Summation using the non-equidistant FFT. In addition to introducing the methods, efficient parallelization of the methods is presented in detail. This publication was edited at the Juelich Supercomputing Centre (JSC) which is an integral part of the Institute for Advanced Simulation (IAS). The IAS combines the Juelich simulation sciences and the supercomputer facility in one organizational unit. It includes those parts of the scientific institutes at Forschungszentrum Juelich which use simulation on supercomputers as their main research methodology. (orig.)

Unified, Cross-Platform, Open-Source Library Package for High-Performance Computing

Energy Technology Data Exchange (ETDEWEB)

Kozacik, Stephen [EM Photonics, Inc., Newark, DE (United States)

2017-05-15

Compute power is continually increasing, but this increased performance is largely found in sophisticated computing devices and supercomputer resources that are difficult to use, resulting in under-utilization. We developed a unified set of programming tools that will allow users to take full advantage of the new technology by allowing them to work at a level abstracted away from the platform specifics, encouraging the use of modern computing systems, including government-funded supercomputer facilities.

Energy consumption optimization of the total-FETI solver by changing the CPU frequency

Science.gov (United States)

Horak, David; Riha, Lubomir; Sojka, Radim; Kruzik, Jakub; Beseda, Martin; Cermak, Martin; Schuchart, Joseph

2017-07-01

The energy consumption of supercomputers is one of the critical problems for the upcoming Exascale supercomputing era. The awareness of power and energy consumption is required on both software and hardware side. This paper deals with the energy consumption evaluation of the Finite Element Tearing and Interconnect (FETI) based solvers of linear systems, which is an established method for solving real-world engineering problems. We have evaluated the effect of the CPU frequency on the energy consumption of the FETI solver using a linear elasticity 3D cube synthetic benchmark. In this problem, we have evaluated the effect of frequency tuning on the energy consumption of the essential processing kernels of the FETI method. The paper provides results for two types of frequency tuning: (1) static tuning and (2) dynamic tuning. For static tuning experiments, the frequency is set before execution and kept constant during the runtime. For dynamic tuning, the frequency is changed during the program execution to adapt the system to the actual needs of the application. The paper shows that static tuning brings up 12% energy savings when compared to default CPU settings (the highest clock rate). The dynamic tuning improves this further by up to 3%.

Navier-Stokes computer

International Nuclear Information System (INIS)

Hayder, M.E.

1988-01-01

A new scientific supercomputer, known as the Navier-Stokes Computer (NSC), has been designed. The NSC is a multi-purpose machine, and for applications in the field of computational fluid dynamics (CFD), this supercomputer is expected to yield a computational speed far exceeding that of the present-day super computers. This computer has a few very powerful processors (known as nodes) connected by an internodal network. There are three versions of the NSC nodes: micro-, mini- and full-node. The micro-node was developed to prove, to demonstrate and to refine the key architectural features of the NSC. Architectures of the two recent versions of the NSC nodes are presented, with the main focus on the full-node. At a clock speed of 20 MHz, the mini- and the full-node have peak computational speeds of 200 and 640 MFLOPS, respectively. The full-node is the final version for the NSC nodes and an NSC is expected to have 128 full-nodes. To test the suitability of different algorithms on the NSC architecture, an NSC simulator was developed. Some of the existing computational fluid dynamics codes were placed on this simulator to determine important and relevant issues relating to the efficient use of the NSC architecture

High Performance Computing Facility Operational Assessment, FY 2010 Oak Ridge Leadership Computing Facility

Energy Technology Data Exchange (ETDEWEB)

Bland, Arthur S Buddy [ORNL; Hack, James J [ORNL; Baker, Ann E [ORNL; Barker, Ashley D [ORNL; Boudwin, Kathlyn J. [ORNL; Kendall, Ricky A [ORNL; Messer, Bronson [ORNL; Rogers, James H [ORNL; Shipman, Galen M [ORNL; White, Julia C [ORNL

2010-08-01

Oak Ridge National Laboratory's (ORNL's) Cray XT5 supercomputer, Jaguar, kicked off the era of petascale scientific computing in 2008 with applications that sustained more than a thousand trillion floating point calculations per second - or 1 petaflop. Jaguar continues to grow even more powerful as it helps researchers broaden the boundaries of knowledge in virtually every domain of computational science, including weather and climate, nuclear energy, geosciences, combustion, bioenergy, fusion, and materials science. Their insights promise to broaden our knowledge in areas that are vitally important to the Department of Energy (DOE) and the nation as a whole, particularly energy assurance and climate change. The science of the 21st century, however, will demand further revolutions in computing, supercomputers capable of a million trillion calculations a second - 1 exaflop - and beyond. These systems will allow investigators to continue attacking global challenges through modeling and simulation and to unravel longstanding scientific questions. Creating such systems will also require new approaches to daunting challenges. High-performance systems of the future will need to be codesigned for scientific and engineering applications with best-in-class communications networks and data-management infrastructures and teams of skilled researchers able to take full advantage of these new resources. The Oak Ridge Leadership Computing Facility (OLCF) provides the nation's most powerful open resource for capability computing, with a sustainable path that will maintain and extend national leadership for DOE's Office of Science (SC). The OLCF has engaged a world-class team to support petascale science and to take a dramatic step forward, fielding new capabilities for high-end science. This report highlights the successful delivery and operation of a petascale system and shows how the OLCF fosters application development teams, developing cutting-edge tools

Towards real-time photon Monte Carlo dose calculation in the cloud

Science.gov (United States)

Ziegenhein, Peter; Kozin, Igor N.; Kamerling, Cornelis Ph; Oelfke, Uwe

2017-06-01

Near real-time application of Monte Carlo (MC) dose calculation in clinic and research is hindered by the long computational runtimes of established software. Currently, fast MC software solutions are available utilising accelerators such as graphical processing units (GPUs) or clusters based on central processing units (CPUs). Both platforms are expensive in terms of purchase costs and maintenance and, in case of the GPU, provide only limited scalability. In this work we propose a cloud-based MC solution, which offers high scalability of accurate photon dose calculations. The MC simulations run on a private virtual supercomputer that is formed in the cloud. Computational resources can be provisioned dynamically at low cost without upfront investment in expensive hardware. A client-server software solution has been developed which controls the simulations and transports data to and from the cloud efficiently and securely. The client application integrates seamlessly into a treatment planning system. It runs the MC simulation workflow automatically and securely exchanges simulation data with the server side application that controls the virtual supercomputer. Advanced encryption standards were used to add an additional security layer, which encrypts and decrypts patient data on-the-fly at the processor register level. We could show that our cloud-based MC framework enables near real-time dose computation. It delivers excellent linear scaling for high-resolution datasets with absolute runtimes of 1.1 seconds to 10.9 seconds for simulating a clinical prostate and liver case up to 1% statistical uncertainty. The computation runtimes include the transportation of data to and from the cloud as well as process scheduling and synchronisation overhead. Cloud-based MC simulations offer a fast, affordable and easily accessible alternative for near real-time accurate dose calculations to currently used GPU or cluster solutions.

With Unix under the hood, the Mac has a toehold in the geophysical sector

Energy Technology Data Exchange (ETDEWEB)

Roche, P.

2004-05-01

A new lease on life in the geophysical sector is predicted for Apple Computer as result of the company's decision first to convert to the Unix System, and then to develop a new operating system called OS X (O-S-Ten) which runs under a version of Unix called Free BSD. While Apple shows no indication of interest to market its hardware and software to the oil industry, at least one oil company, Houston-based Seitel Inc., is using Apple products for its high performance computing and technical desktop applications, such as storing its onshore and offshore 3-D seismic data on Apple's Xserve RAID rack storage system. In another application, Virginia Polytechnic Institute built a supercomputer using 1,100 64-bit G5 Power Macs. The result is the third fastest super-computer in the world, running at a blazing 10.28 teraflops, or 10.28 trillion calculations per second. By all accounts, it is well suited to oilpatch tasks such as seismic data processing and running large-scale simulations such as fluid flow through porous media. Seitel is also interested in Apple's 64-bit G5 computers to run its seismic data processing operations which require large amounts of computing power. While Apple's hardware and software appear to be well adopted to perform oilpatch tasks, proliferation of use of Apple products by oilpatch companies is hindered by the almost complete absence of oilpatch software. Parallel Geoscience Corporation which had long been interested in creating Mac-based software for geoscience applications, is in the process of filling that gap by refocusing its attention on an O-S-Ten version of its Seismic Precessing Workshop{sup T}M{sup (}SPW). How long it will take to make the conversion will depend on customer demand. 2 figs.

An Evaluation of Molecular Dynamics Performance on the Hybrid Cray XK6 Supercomputer

International Nuclear Information System (INIS)

Brown, W. Michael; Nguyen, Trung D.; Fuentes-Cabrera, Miguel A.; Fowlkes, Jason Davidson; Rack, Philip D.; Berger, Mark

2012-01-01

For many years, the drive towards computational physics studies that match the size and time-scales of experiment has been fueled by increases in processor and interconnect performance that could be exploited with relatively little modification to existing codes. Engineering and electrical power constraints have disrupted this trend, requiring more drastic changes to both hardware and software solutions. Here, we present details of the Cray XK6 architecture that achieves increased performance with the use of GPU accelerators. We review software development efforts in the LAMMPS molecular dynamics package that have been implemented in order to utilize hybrid high performance computers. We present benchmark results for solid-state, biological, and mesoscopic systems and discuss some challenges for utilizing hybrid systems. We present some early work in improving application performance on the XK6 and performance results for the simulation of liquid copper nanostructures with the embedded atom method.

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Radio Astronomy at the Centre for High Performance Computing in South Africa

Science.gov (United States)

Catherine Cress; UWC Simulation Team

2014-04-01

I will present results on galaxy evolution and cosmology which we obtained using the supercomputing facilities at the CHPC. These include cosmological-scale N-body simulations modelling neutral hydrogen as well as the study of the clustering of radio galaxies to probe the relationship between dark and luminous matter in the universe. I will also discuss the various roles that the CHPC is playing in Astronomy in SA, including the provision of HPC for a variety of Astronomical applications, the provision of storage for radio data, our educational programs and our participation in planning for the SKA.

Interactive Data Exploration for High-Performance Fluid Flow Computations through Porous Media

KAUST Repository

Perovic, Nevena

2014-09-01

© 2014 IEEE. Huge data advent in high-performance computing (HPC) applications such as fluid flow simulations usually hinders the interactive processing and exploration of simulation results. Such an interactive data exploration not only allows scientiest to \\'play\\' with their data but also to visualise huge (distributed) data sets in both an efficient and easy way. Therefore, we propose an HPC data exploration service based on a sliding window concept, that enables researches to access remote data (available on a supercomputer or cluster) during simulation runtime without exceeding any bandwidth limitations between the HPC back-end and the user front-end.

Status of computational fluid dynamics in the United States

International Nuclear Information System (INIS)

Kutler, P.; Steger, J.L.; Bailey, F.R.

1987-01-01

CFD-related progress in U.S. aerospace industries and research institutions is evaluated with respect to methods employed, their applications, and the computer technologies employed in their implementation. Goals for subsonic CFD are primarily aimed at greater fuel efficiency; those of supersonic CFD involve the achievement of high sustained cruise efficiency. Transatmospheric/hypersonic vehicles are noted to have recently become important concerns for CFD efforts. Attention is given to aspects of discretization, Euler and Navier-Stokes general purpose codes, zonal equation methods, internal and external flows, and the impact of supercomputers and their networks in advancing the state-of-the-art. 91 references

Review of multi-dimensional large-scale kinetic simulation and physics validation of ion acceleration in relativistic laser-matter interaction

International Nuclear Information System (INIS)

Wu, Hui-Chun; Hegelich, B.M.; Fernandez, J.C.; Shah, R.C.; Palaniyappan, S.; Jung, D.; Yin, L.; Albright, B.J.; Bowers, K.; Kwan, T.J.

2012-01-01

Two new experimental technologies enabled realization of Break-out afterburner (BOA) - High quality Trident laser and free-standing C nm-targets. VPIC is an powerful tool for fundamental research of relativistic laser-matter interaction. Predictions from VPIC are validated - Novel BOA and Solitary ion acceleration mechanisms. VPIC is a fully explicit Particle In Cell (PIC) code: models plasma as billions of macro-particles moving on a computational mesh. VPIC particle advance (which typically dominates computation) has been optimized extensively for many different supercomputers. Laser-driven ions lead to realization promising applications - Ion-based fast ignition; active interrogation, hadron therapy.

DySectAPI: Scalable Prescriptive Debugging

DEFF Research Database (Denmark)

Jensen, Nicklas Bo; Karlsson, Sven; Quarfot Nielsen, Niklas

We present the DySectAPI, a tool that allow users to construct probe trees for automatic, event-driven debugging at scale. The traditional, interactive debugging model, whereby users manually step through and inspect their application, does not scale well even for current supercomputers. While...... lightweight debugging models scale well, they can currently only debug a subset of bug classes. DySectAPI fills the gap between these two approaches with a novel user-guided approach. Using both experimental results and analytical modeling we show how DySectAPI scales and can run with a low overhead...

Parallel-Vector Algorithm For Rapid Structural Anlysis

Science.gov (United States)

Agarwal, Tarun R.; Nguyen, Duc T.; Storaasli, Olaf O.

1993-01-01

New algorithm developed to overcome deficiency of skyline storage scheme by use of variable-band storage scheme. Exploits both parallel and vector capabilities of modern high-performance computers. Gives engineers and designers opportunity to include more design variables and constraints during optimization of structures. Enables use of more refined finite-element meshes to obtain improved understanding of complex behaviors of aerospace structures leading to better, safer designs. Not only attractive for current supercomputers but also for next generation of shared-memory supercomputers.

Strategic research field no.4, industrial innovations

International Nuclear Information System (INIS)

Kato, Chisachi

2011-01-01

'Kei'-supercomputer is planned to start its full-scale operation in about one year and a half. With this, High Performance Computing (HPC) is most likely to contribute not only to further progress in basic and applied sciences, but also to bringing about innovations in various fields of industries. It is expected to substantially shorten design time, drastically improve performance and/or liability of various industrial products, and greatly enhance safety of large-scale power plants. In this particle, six research themes, which are currently being prepared in this strategic research field, 'industrial innovations' so as to use 'Kei'-supercomputer as soon as it starts operations, will be briefly described regarding their specific goals and break-through that they are expected to bring about in industries. It is also explained how we have determined these themes. We are also planning several measures in order to promote widespread use of HPC including 'Kei'-supercomputer in industries, which will also be elaborated in this article. (author)

An evaluation of current high-performance networks

Energy Technology Data Exchange (ETDEWEB)

Bell, Christian; Bonachea, Dan; Cote, Yannick; Duell, Jason; Hargrove, Paul; Husbands, Parry; Iancu, Costin; Welcome, Michael; Yelick, Katherine

2003-01-25

High-end supercomputers are increasingly built out of commodity components, and lack tight integration between the processor and network. This often results in inefficiencies in the communication subsystem, such as high software overheads and/or message latencies. In this paper we use a set of microbenchmarks to quantify the cost of this commoditization, measuring software overhead, latency, and bandwidth on five contemporary supercomputing networks. We compare the performance of the ubiquitous MPI layer to that of lower-level communication layers, and quantify the advantages of the latter for small message performance. We also provide data on the potential for various communication-related optimizations, such as overlapping communication with computation or other communication. Finally, we determine the minimum size needed for a message to be considered 'large' (i.e., bandwidth-bound) on these platforms, and provide historical data on the software overheads of a number of supercomputers over the past decade.

Trends in supercomputers and computational physics

International Nuclear Information System (INIS)

Bloch, T.

1985-01-01

Today, scientists using numerical models explore the basic mechanisms of semiconductors, apply global circulation models to climatic and oceanographic problems, probe into the behaviour of galaxies and try to verify basic theories of matter, such as Quantum Chromo Dynamics by simulating the constitution of elementary particles. Chemists, crystallographers and molecular dynamics researchers develop models for chemical reactions, formation of crystals and try to deduce the chemical properties of molecules as a function of the shapes of their states. Chaotic systems are studied extensively in turbulence (combustion included) and the design of the next generation of controlled fusion devices relies heavily on computational physics. (orig./HSI)

A supercomputer for parallel data analysis

International Nuclear Information System (INIS)

Kolpakov, I.F.; Senner, A.E.; Smirnov, V.A.

1987-01-01

The project of a powerful multiprocessor system is proposed. The main purpose of the project is to develop a low cost computer system with a processing rate of a few tens of millions of operations per second. The system solves many problems of data analysis from high-energy physics spectrometers. It includes about 70 MOTOROLA-68020 based powerful slave microprocessor boards liaisoned through the VME crates to a host VAX micro computer. Each single microprocessor board performs the same algorithm requiring large computing time. The host computer distributes data over the microprocessor board, collects and combines obtained results. The architecture of the system easily allows one to use it in the real time mode

Delivering LHC software to HPC compute elements

CERN Document Server

Blomer, Jakob; Hardi, Nikola; Popescu, Radu

2017-01-01

In recent years, there was a growing interest in improving the utilization of supercomputers by running applications of experiments at the Large Hadron Collider (LHC) at CERN when idle cores cannot be assigned to traditional HPC jobs. At the same time, the upcoming LHC machine and detector upgrades will produce some 60 times higher data rates and challenge LHC experiments to use so far untapped compute resources. LHC experiment applications are tailored to run on high-throughput computing resources and they have a different anatomy than HPC applications. LHC applications comprise a core framework that allows hundreds of researchers to plug in their specific algorithms. The software stacks easily accumulate to many gigabytes for a single release. New releases are often produced on a daily basis. To facilitate the distribution of these software stacks to world-wide distributed computing resources, LHC experiments use a purpose-built, global, POSIX file system, the CernVM File System. CernVM-FS pre-processes dat...

NCS--a software for visual modeling and simulation of PWR nuclear power plant control system

International Nuclear Information System (INIS)

Cui Zhenhua

1998-12-01

The modeling and simulation of nuclear power plant control system has been investigated. Some mathematical models for rapid and accurate simulation are derived, including core models, pressurizer model, steam generator model, etc. Several numerical methods such as Runge-Kutta Method and Treanor Method are adopted to solve the above system models. In order to model the control system conveniently, a block diagram-oriented visual modeling platform is designed. And the Discrete Similarity Method is used to calculate the control system models. A corresponding simulating software, NCS, is developed for researching on the control systems of commercial nuclear power plant. And some satisfactory results are obtained. The research works will be of referential and applying value to design and analysis of nuclear power plant control system

Some computational challenges of developing efficient parallel algorithms for data-dependent computations in thermal-hydraulics supercomputer applications

International Nuclear Information System (INIS)

Woodruff, S.B.

1994-01-01

The Transient Reactor Analysis Code (TRAC), which features a two-fluid treatment of thermal-hydraulics, is designed to model transients in water reactors and related facilities. One of the major computational costs associated with TRAC and similar codes is calculating constitutive coefficients. Although the formulations for these coefficients are local, the costs are flow-regime- or data-dependent; i.e., the computations needed for a given spatial node often vary widely as a function of time. Consequently, a fixed, uniform assignment of nodes to prallel processors will result in degraded computational efficiency due to the poor load balancing. A standard method for treating data-dependent models on vector architectures has been to use gather operations (or indirect adressing) to sort the nodes into subsets that (temporarily) share a common computational model. However, this method is not effective on distributed memory data parallel architectures, where indirect adressing involves expensive communication overhead. Another serious problem with this method involves software engineering challenges in the areas of maintainability and extensibility. For example, an implementation that was hand-tuned to achieve good computational efficiency would have to be rewritten whenever the decision tree governing the sorting was modified. Using an example based on the calculation of the wall-to-liquid and wall-to-vapor heat-transfer coefficients for three nonboiling flow regimes, we describe how the use of the Fortran 90 WHERE construct and automatic inlining of functions can be used to ameliorate this problem while improving both efficiency and software engineering. Unfortunately, a general automatic solution to the load-balancing problem associated with data-dependent computations is not yet available for massively parallel architectures. We discuss why developers should either wait for such solutions or consider alternative numerical algorithms, such as a neural network representation, that do not exhibit load-balancing problems. (orig.)

Some computational challenges of developing efficient parallel algorithms for data-dependent computations in thermal-hydraulics supercomputer applications

International Nuclear Information System (INIS)

Woodruff, S.B.

1992-01-01

The Transient Reactor Analysis Code (TRAC), which features a two- fluid treatment of thermal-hydraulics, is designed to model transients in water reactors and related facilities. One of the major computational costs associated with TRAC and similar codes is calculating constitutive coefficients. Although the formulations for these coefficients are local the costs are flow-regime- or data-dependent; i.e., the computations needed for a given spatial node often vary widely as a function of time. Consequently, poor load balancing will degrade efficiency on either vector or data parallel architectures when the data are organized according to spatial location. Unfortunately, a general automatic solution to the load-balancing problem associated with data-dependent computations is not yet available for massively parallel architectures. This document discusses why developers algorithms, such as a neural net representation, that do not exhibit algorithms, such as a neural net representation, that do not exhibit load-balancing problems

Nonlinear Circuits and Neural Networks: Chip Implementation and Applications of the TeraOPS CNN Dynamic Array Supercomputer

National Research Council Canada - National Science Library

Chua, L

1998-01-01

.... Advances in research have been made in the following areas: (1) The design and implementation of the first-ever ARAM in the CNN Chip Set Architecture was successfully competed, and the samples were successfully tested; (2...

Inter operability studies between the GTRS and EUMEDGRID e-Infrastructures

International Nuclear Information System (INIS)

Abbes, H.; Jemni, M.; Barbera, R.

2007-01-01

Grid computing enables sharing, selection, and aggregation of a wide variety of geographically distributed computational resources such as supercomputers, clusters, storage systems and data sources. A grid presents them as one unified resource for solving large scale and data intensive computing applications. A middle ware supports applications in distributed computing environments by providing services that enable the inter connectivity and inter operability of applications, systems and machines. Considering the evolution of this type of middle ware, it is important to regroup several national and international grids, by creating a gateway between middle wares, to gather more power and resources. In this setting, our work consists on making the Tunisian national grid GTRS inter operable with the grid infrastructure of EU funded project EUMEDGRID. A new concept of Super Worker Node is proposed in this work to reach the inter operability between the two grids of GTRS and EUMEDGRID. (Author)

Connecting the dots, or nuclear data in the age of supercomputing

International Nuclear Information System (INIS)

Bauge, E.; Dupuis, M.; Hilaire, S.; Peru, S.; Koning, A.J.; Rochman, D.; Goriely, S.

2014-01-01

Recent increases in computing power have allowed for much progress to be made in the field of nuclear data. The advances listed below are each significant, but together bring the potential to completely change our perspective on the nuclear data evaluation process. The use of modern nuclear modeling codes like TALYS and the Monte Carlo sampling of its model parameter space, together with a code system developed at NRG Petten, which automates the production of ENDF-6 formatted files, their processing, and their use in nuclear reactor calculations, constitutes the Total Monte Carlo approach, which directly links physical model parameters with calculated integral observables like k_e_f_f. Together with the Backward-Forward Monte Carlo method for weighting samples according their statistical likelihood, the Total Monte Carlo can be applied to complete isotopic chains in a consistent way, to simultaneously evaluate nuclear data and the associated uncertainties in the continuum region. Another improvement is found in the uses of microscopic models for nuclear reaction calculations. For example, making use of QRPA excited states calculated with the Gogny interaction to solve the long standing question of the origin of the ad hoc 'pseudo-states' that are introduced in evaluated nuclear data files to account for the Livermore pulsed sphere experiments. A third advance consists of the recent optimization of the Gogny D1M effective nuclear interaction, including constraints from experimental nuclear masses at the 'beyond the mean field' level. All these advances are only made possible by the availability of vast resources of computing power, and even greater resources will allow connecting them, going continuously from the parameters of the nuclear interaction to reactor calculations. However, such scheme will surely only be usable for applications if a few fine-tuning 'knobs' are introduced in it. The values of these adjusted parameters will have to be calibrated versus

The situation and future deployment of the simulation technology relevant to dry type re-processing methods, to an argument sake

International Nuclear Information System (INIS)

Kobayashi, Hiroaki

2004-01-01

Arithmetic calculation ability of computers has recently made remarkable progress, especially the power will be accelerated by using distributed computing methods. Based on this situation, application of simulation technology to dry type re-processing is firstly presented, the main purpose of which is reduction of experimental cost. Then, what the simulation technologies should be in future age when powerful computer can be used easily is discussed. The discussion is also done for now and for transition period when such a powerful computer age has not come yet. The concept of future computer simulation is argued from points of its purpose, advantage, methods, and applicable technical fields. The arithmetic calculation ability of supercomputer expected in future and distributed computing methods recently getting footlights are viewed showing concrete examples. (A. Hishinuma)

Scalability of a Low-Cost Multi-Teraflop Linux Cluster for High-End Classical Atomistic and Quantum Mechanical Simulations

Science.gov (United States)

Kikuchi, Hideaki; Kalia, Rajiv K.; Nakano, Aiichiro; Vashishta, Priya; Shimojo, Fuyuki; Saini, Subhash

2003-01-01

Scalability of a low-cost, Intel Xeon-based, multi-Teraflop Linux cluster is tested for two high-end scientific applications: Classical atomistic simulation based on the molecular dynamics method and quantum mechanical calculation based on the density functional theory. These scalable parallel applications use space-time multiresolution algorithms and feature computational-space decomposition, wavelet-based adaptive load balancing, and spacefilling-curve-based data compression for scalable I/O. Comparative performance tests are performed on a 1,024-processor Linux cluster and a conventional higher-end parallel supercomputer, 1,184-processor IBM SP4. The results show that the performance of the Linux cluster is comparable to that of the SP4. We also study various effects, such as the sharing of memory and L2 cache among processors, on the performance.

PRODEEDINGS OF RIKEN BNL RESEARCH CENTER WORKSHOP : HIGH PERFORMANCE COMPUTING WITH QCDOC AND BLUEGENE.

Energy Technology Data Exchange (ETDEWEB)

CHRIST,N.; DAVENPORT,J.; DENG,Y.; GARA,A.; GLIMM,J.; MAWHINNEY,R.; MCFADDEN,E.; PESKIN,A.; PULLEYBLANK,W.

2003-03-11

Staff of Brookhaven National Laboratory, Columbia University, IBM and the RIKEN BNL Research Center organized a one-day workshop held on February 28, 2003 at Brookhaven to promote the following goals: (1) To explore areas other than QCD applications where the QCDOC and BlueGene/L machines can be applied to good advantage, (2) To identify areas where collaboration among the sponsoring institutions can be fruitful, and (3) To expose scientists to the emerging software architecture. This workshop grew out of an informal visit last fall by BNL staff to the IBM Thomas J. Watson Research Center that resulted in a continuing dialog among participants on issues common to these two related supercomputers. The workshop was divided into three sessions, addressing the hardware and software status of each system, prospective applications, and future directions.

High Performance Computing in Science and Engineering '15 : Transactions of the High Performance Computing Center

CERN Document Server

Kröner, Dietmar; Resch, Michael

2016-01-01

This book presents the state-of-the-art in supercomputer simulation. It includes the latest findings from leading researchers using systems from the High Performance Computing Center Stuttgart (HLRS) in 2015. The reports cover all fields of computational science and engineering ranging from CFD to computational physics and from chemistry to computer science with a special emphasis on industrially relevant applications. Presenting findings of one of Europe’s leading systems, this volume covers a wide variety of applications that deliver a high level of sustained performance. The book covers the main methods in high-performance computing. Its outstanding results in achieving the best performance for production codes are of particular interest for both scientists and engineers. The book comes with a wealth of color illustrations and tables of results.

High Performance Computing in Science and Engineering '14

CERN Document Server

Kröner, Dietmar; Resch, Michael

2015-01-01

This book presents the state-of-the-art in supercomputer simulation. It includes the latest findings from leading researchers using systems from the High Performance Computing Center Stuttgart (HLRS). The reports cover all fields of computational science and engineering ranging from CFD to computational physics and from chemistry to computer science with a special emphasis on industrially relevant applications. Presenting findings of one of Europe’s leading systems, this volume covers a wide variety of applications that deliver a high level of sustained performance. The book covers the main methods in high-performance computing. Its outstanding results in achieving the best performance for production codes are of particular interest for both scientists and   engineers. The book comes with a wealth of color illustrations and tables of results.  

High Performance Computing in Science and Engineering '17 : Transactions of the High Performance Computing Center

CERN Document Server

Kröner, Dietmar; Resch, Michael; HLRS 2017

2018-01-01

This book presents the state-of-the-art in supercomputer simulation. It includes the latest findings from leading researchers using systems from the High Performance Computing Center Stuttgart (HLRS) in 2017. The reports cover all fields of computational science and engineering ranging from CFD to computational physics and from chemistry to computer science with a special emphasis on industrially relevant applications. Presenting findings of one of Europe’s leading systems, this volume covers a wide variety of applications that deliver a high level of sustained performance.The book covers the main methods in high-performance computing. Its outstanding results in achieving the best performance for production codes are of particular interest for both scientists and engineers. The book comes with a wealth of color illustrations and tables of results.

High Performance Computing in Science and Engineering '16 : Transactions of the High Performance Computing Center, Stuttgart (HLRS) 2016

CERN Document Server

Kröner, Dietmar; Resch, Michael

2016-01-01

This book presents the state-of-the-art in supercomputer simulation. It includes the latest findings from leading researchers using systems from the High Performance Computing Center Stuttgart (HLRS) in 2016. The reports cover all fields of computational science and engineering ranging from CFD to computational physics and from chemistry to computer science with a special emphasis on industrially relevant applications. Presenting findings of one of Europe’s leading systems, this volume covers a wide variety of applications that deliver a high level of sustained performance. The book covers the main methods in high-performance computing. Its outstanding results in achieving the best performance for production codes are of particular interest for both scientists and engineers. The book comes with a wealth of color illustrations and tables of results.

A complete implementation of the conjugate gradient algorithm on a reconfigurable supercomputer

International Nuclear Information System (INIS)

Dubois, David H.; Dubois, Andrew J.; Connor, Carolyn M.; Boorman, Thomas M.; Poole, Stephen W.

2008-01-01

The conjugate gradient is a prominent iterative method for solving systems of sparse linear equations. Large-scale scientific applications often utilize a conjugate gradient solver at their computational core. In this paper we present a field programmable gate array (FPGA) based implementation of a double precision, non-preconditioned, conjugate gradient solver for fmite-element or finite-difference methods. OUf work utilizes the SRC Computers, Inc. MAPStation hardware platform along with the 'Carte' software programming environment to ease the programming workload when working with the hybrid (CPUIFPGA) environment. The implementation is designed to handle large sparse matrices of up to order N x N where N <= 116,394, with up to 7 non-zero, 64-bit elements per sparse row. This implementation utilizes an optimized sparse matrix-vector multiply operation which is critical for obtaining high performance. Direct parallel implementations of loop unrolling and loop fusion are utilized to extract performance from the various vector/matrix operations. Rather than utilize the FPGA devices as function off-load accelerators, our implementation uses the FPGAs to implement the core conjugate gradient algorithm. Measured run-time performance data is presented comparing the FPGA implementation to a software-only version showing that the FPGA can outperform processors running up to 30x the clock rate. In conclusion we take a look at the new SRC-7 system and estimate the performance of this algorithm on that architecture.

Quantum simulation of superconductors on quantum computers. Toward the first applications of quantum processors

Energy Technology Data Exchange (ETDEWEB)

Dallaire-Demers, Pierre-Luc

2016-10-07

Quantum computers are the ideal platform for quantum simulations. Given enough coherent operations and qubits, such machines can be leveraged to simulate strongly correlated materials, where intricate quantum effects give rise to counter-intuitive macroscopic phenomena such as high-temperature superconductivity. Many phenomena of strongly correlated materials are encapsulated in the Fermi-Hubbard model. In general, no closed-form solution is known for lattices of more than one spatial dimension, but they can be numerically approximated using cluster methods. To model long-range effects such as order parameters, a powerful method to compute the cluster's Green's function consists in finding its self-energy through a variational principle. As is shown in this thesis, this allows the possibility of studying various phase transitions at finite temperature in the Fermi-Hubbard model. However, a classical cluster solver quickly hits an exponential wall in the memory (or computation time) required to store the computation variables. We show theoretically that the cluster solver can be mapped to a subroutine on a quantum computer whose quantum memory usage scales linearly with the number of orbitals in the simulated cluster and the number of measurements scales quadratically. We also provide a gate decomposition of the cluster Hamiltonian and a simple planar architecture for a quantum simulator that can also be used to simulate more general fermionic systems. We briefly analyze the Trotter-Suzuki errors and estimate the scaling properties of the algorithm for more complex applications. A quantum computer with a few tens of qubits could therefore simulate the thermodynamic properties of complex fermionic lattices inaccessible to classical supercomputers.

Quantum simulation of superconductors on quantum computers. Toward the first applications of quantum processors

International Nuclear Information System (INIS)

Dallaire-Demers, Pierre-Luc

2016-01-01

Quantum computers are the ideal platform for quantum simulations. Given enough coherent operations and qubits, such machines can be leveraged to simulate strongly correlated materials, where intricate quantum effects give rise to counter-intuitive macroscopic phenomena such as high-temperature superconductivity. Many phenomena of strongly correlated materials are encapsulated in the Fermi-Hubbard model. In general, no closed-form solution is known for lattices of more than one spatial dimension, but they can be numerically approximated using cluster methods. To model long-range effects such as order parameters, a powerful method to compute the cluster's Green's function consists in finding its self-energy through a variational principle. As is shown in this thesis, this allows the possibility of studying various phase transitions at finite temperature in the Fermi-Hubbard model. However, a classical cluster solver quickly hits an exponential wall in the memory (or computation time) required to store the computation variables. We show theoretically that the cluster solver can be mapped to a subroutine on a quantum computer whose quantum memory usage scales linearly with the number of orbitals in the simulated cluster and the number of measurements scales quadratically. We also provide a gate decomposition of the cluster Hamiltonian and a simple planar architecture for a quantum simulator that can also be used to simulate more general fermionic systems. We briefly analyze the Trotter-Suzuki errors and estimate the scaling properties of the algorithm for more complex applications. A quantum computer with a few tens of qubits could therefore simulate the thermodynamic properties of complex fermionic lattices inaccessible to classical supercomputers.

Large scale visualization on the Cray XT3 using ParaView.

Energy Technology Data Exchange (ETDEWEB)

Rogers, David; Geveci, Berk (Kitware, Inc.); Eschenbert, Kent (Pittsburgh Supercomputing Center); Neundorf, Alexander (Technical University of Kaiserslautern); Marion, Patrick (Kitware, Inc.); Moreland, Kenneth D.; Greenfield, John

2008-05-01

Post-processing and visualization are key components to understanding any simulation. Porting ParaView, a scalable visualization tool, to the Cray XT3 allows our analysts to leverage the same supercomputer they use for simulation to perform post-processing. Visualization tools traditionally rely on a variety of rendering, scripting, and networking resources; the challenge of running ParaView on the Lightweight Kernel is to provide and use the visualization and post-processing features in the absence of many OS resources. We have successfully accomplished this at Sandia National Laboratories and the Pittsburgh Supercomputing Center.

Magnetic fusion energy and computers. The role of computing in magnetic fusion energy research and development (second edition)

International Nuclear Information System (INIS)

1983-01-01

This report documents the structure and uses of the MFE Network and presents a compilation of future computing requirements. Its primary emphasis is on the role of supercomputers in fusion research. One of its key findings is that with the introduction of each successive class of supercomputer, qualitatively improved understanding of fusion processes has been gained. At the same time, even the current Class VI machines severely limit the attainable realism of computer models. Many important problems will require the introduction of Class VII or even larger machines before they can be successfully attacked

Publisher Correction

DEFF Research Database (Denmark)

Bonàs-Guarch, Sílvia; Guindo-Martínez, Marta; Miguel-Escalada, Irene

2018-01-01

In the originally published version of this Article, the affiliation details for Santi González, Jian'an Luan and Claudia Langenberg were inadvertently omitted. Santi González should have been affiliated with 'Barcelona Supercomputing Center (BSC), Joint BSC-CRG-IRB Research Program in Computatio......In the originally published version of this Article, the affiliation details for Santi González, Jian'an Luan and Claudia Langenberg were inadvertently omitted. Santi González should have been affiliated with 'Barcelona Supercomputing Center (BSC), Joint BSC-CRG-IRB Research Program...

LDRD final report : massive multithreading applied to national infrastructure and informatics.

Energy Technology Data Exchange (ETDEWEB)

Henderson, Bruce A.; Murphy, Richard C.; Wheeler, Kyle; Mackey, Gregory; Berry, Jonathan W.; LaViolette, Randall A.; Mancke, Brad; Barrett, Brian W.; Phillips, Cynthia Ann; Pinar, Ali; Leung, Vitus Joseph

2009-09-01

Large relational datasets such as national-scale social networks and power grids present different computational challenges than do physical simulations. Sandia's distributed-memory supercomputers are well suited for solving problems concerning the latter, but not the former. The reason is that problems such as pattern recognition and knowledge discovery on large networks are dominated by memory latency and not by computation. Furthermore, most memory requests in these applications are very small, and when the datasets are large, most requests miss the cache. The result is extremely low utilization. We are unlikely to be able to grow out of this problem with conventional architectures. As the power density of microprocessors has approached that of a nuclear reactor in the past two years, we have seen a leveling of Moores Law. Building larger and larger microprocessor-based supercomputers is not a solution for informatics and network infrastructure problems since the additional processors are utilized to only a tiny fraction of their capacity. An alternative solution is to use the paradigm of massive multithreading with a large shared memory. There is only one instance of this paradigm today: the Cray MTA-2. The proposal team has unique experience with and access to this machine. The XMT, which is now being delivered, is a Red Storm machine with up to 8192 multithreaded 'Threadstorm' processors and 128 TB of shared memory. For many years, the XMT will be the only way to address very large graph problems efficiently, and future generations of supercomputers will include multithreaded processors. Roughly 10 MTA processor can process a simple short paths problem in the time taken by the Gordon Bell Prize-nominated distributed memory code on 32,000 processors of Blue Gene/Light. We have developed algorithms and open-source software for the XMT, and have modified that software to run some of these algorithms on other multithreaded platforms such as the Sun