High Performance Computing in Science & Engineering 1999
The 2nd Results and Review Workshop of the HLRS, October 4-6, 1999
at the University of Stuttgart Computing-Center, Allmandring 30, 70569 Stuttgart
Agenda
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Monday, October 4th 1999 |
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| 13:00 |
Opening Prof. Dr. Egon Krause |
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| 13:15 |
Session 1: Computational Fluid Dynamics Chairman: Prof. Dr.-Ing. S. Wagner, Universität Stuttgart |
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| 13:15 |
Martin Rieber and Arnold Frohn Institut für Thermodynamik der Luft- und Raumfahrt, Universität Stuttgart "Parallel Computation of Interface Dynamics in Incompressible Two-Phase Flows" |
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| 13:40 |
Discussion |
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| 13:50 |
Sven Enger, Michael Breuer, and Biswajit Basu Lehrstuhl für Strömungsmechanik Friedrich-Alexander-Universität Erlangen-Nürnberg "Numerical Simulation of Fluid Flow and Heat Transfer in an Industrial Czochralski Melt Using a Parallel-Vector Supercomputer" |
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| 14:15 |
Discussion |
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| 14:25 |
T. J. Hüttl, M. Smieszek, M. Fröhlich, M. Manhart, R. J. D. Schmidt, and R. Friedrich Technische Universität München Technische Universität Cottbus "Numerical flow simulation in cylindrical geometries" |
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| 14:50 |
Discussion |
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| 15:00 |
U. Maucher, U. Rist, M. Kloker, and S. Wagner Institut für Aerodynamik und Gasdynamik, Universität Stuttgart "DNS of Laminar-Turbulent Transition in Separation Bubbles" |
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| 15:25 |
Discussion |
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| 15:35 |
Coffee |
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| 16:00 |
Session 2: Reacting Flows Chairman: Prof. Dr. D. Kröner, Universität Freiburg |
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| 16:00 |
Marc Lange and Jürgen Warnatz Interdisziplinäres Zentrum für Wissenschaftliches Rechnen, Universität Heidelberg "Investigation of Chemistry-Turbulence Interactions Using DNS on the CRAY T3E" |
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| 16:25 |
Discussion |
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| 16:35 |
Andreas Werner Rechenzentrum, Universität Stuttgart "3D Simulation of instationary turbulent flow and combustion in internal combustion engines" |
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| 17:00 |
Discussion |
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| 17:10 |
C. P. Schenk, A. W. Liehr, M. Bode, and H.-G. Purwins Institut für Angewandte Physik, Universität Münster "Quasi-Particle in a Three-Dimensional Three-Component Reaction-Diffusion System" |
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| 17:35 |
Discussion |
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| 17:45 |
Alexander Bundschuh, Benedetto Risio, Uwe Schnell, Klaus R. G. Hein Institut für Verfahrenstechnik und Dampfkesselwesen, Universität Stuttgart "Numerical predicition of load changes in a coal-fired utility boiler" |
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| 18:10 |
Discussion |
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| 18:20 |
Session 3: Structural Mechanics Chairman: Prof. Dr.-Ing. E. Stein |
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| 18:45 |
Kai Höfler, Matthias Müller, and Stefan Schwarzer Institut für Computeranwendungen I, Universität Stuttgart "Design and Application of Object Oriented Parallel Data Structures in Particle and Continuous Systems" |
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| 19:10 |
Discussion |
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| 19:30 |
Reception on behalf of HLRS |
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Tuesday, October 5th 1999 |
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| 9:00 |
Session 4: Solid State Physics Chairman: Prof. Dr. W. Hanke, Universität Würzburg |
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| 9:00 |
Ulrich Freking, Albert Mazur, and Johannes Pollmann Institut für Theoretische Physik II, Westfälische-wilhelms-Universität Münster "Vibronic studies of adsorbate-covered semiconductor surfaces with the help of HPC" |
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| 9:25 |
Discussion |
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| 9:35 |
Coffee |
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| 10:00 |
Session 5: Physics Chairman: Prof. Dr. H. Ruder, Universität Tübingen |
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| 10:00 |
Trond Ryberg, Marc Tittgemeyer, and Friedemann Wenzel GeoForschungsZentrum, Potsdam Geophysikalisches Institut, Universität Karlsruhe "Finite difference modelling of elastic wave propagation in the Earth's uppermost mantle" |
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| 10:25 |
Discussion |
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| 10:35 |
Martin Karrenbach Geophysikalisches Institut, Universität Karlsruhe "Direct Simulation of Seismic Wave Propagation" |
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| 11:00 |
Discussion |
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| 11:10 |
Stefan Kunze, Erik Schnetter, and Roland Speith Institut für Astronomie und Astrophysik, Abt. Theoretische Astrophysik, Universität Tübingen "Development and Astrophysical Applications of a Parallel Smoothed Particle Hydrodynamics Code with MPI" |
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| 11:35 |
Discussion |
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| 11:45 |
Johannes Roth, Jörg Stadler, Marco Brunelli, Dietmar Bunz, Franz Gähler, Jutta Hahn, Martin Hohl, Christof Horn, Jutta Kaiser, Ralf Mikulla, Gunther Schaaf, Joachim Stelzer, and Hans-Rainer Trebin Institut für Theoretische und Angewandte Physik, Universität Stuttgart "IMD – A Massively Parallel Molecular Dynamics Package for Classical Simulations in Condensed Matter Physics" |
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| 12:20 |
Discussion |
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| 12:30 |
Lunch |
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| 13:40 |
Session 6: Chemistry Chairman: Prof. Dr. B. Hess, Universität Erlangen |
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| 13:40 |
P. Stampfuß and W. Wenzel Institut für Physik, Universität Dortmund "The multi-reference configuration interaction method on massively parallel architectures" |
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| 14:15 |
Discussion |
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| 14:25 |
Guntram Rauhut and Frank Eckert Institut für Theoretische Chemie, Universität Stuttgart "Quantum Chemical Studies on Heterocyclic Rearrangements in Benzofuroxans: Reaction Paths, Vibrational Spectra, and Rate Constants" |
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| 14:50 |
Discussion |
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| 15:00 |
Peter R. Schreiner and Matthias Prall Institut für Organische Chemie, Georg-August-Universität Göttingen "Myers-Saito versus C2-C6 ("Schmittel") Cyclizations of Parent and Monocyclic Enyne-Allenes – Challenges to Chemistry and Computation" |
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| 15:25 |
Discussion |
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| 15:35 |
Ralf Schmelter, Alfons Geiger Institut für Physikalische Chemie, Universität Dortmund "MD Simulation of a Phospholipid Bilayer" |
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| 16:00 |
Discussion |
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| 16:10 |
Coffee |
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| 16:20 |
Poster-Session I Jens Uwe Sommer, Stefan Lay, and Alexander Blumen Institut für Theoretische Polymerphysik, Universität Freiburg "Simulation of random copolymers at selective interfaces and of cross-linked polymer blends" T. Geisinger, M. Müller, and K. Binder Institut für Physik, Johannes-Gutenberg-Universität Mainz "Symmetric diblock copolymers confined into thin films: A Monte Carlo investigation on the CRAY T3E" J. Hahn and H.-R. Trebin Institut für Theoretische und Angewandte Physik, Universität Stuttgart "Molecular Dynamics of Covalent Crystals" Marc Hemsendorf Astronomisches Recheninstitut, Universität Heidelberg "Collisional dynamics around black hole binaries in galactic centres" Gerhard Wellein and Holger Fehske Regionales Rechenzentrum Erlangen, Universität Erlangen-Nürnberg Physikalisches Institut, Universität Bayreuth "Towards the Limits of present-day Supercomputers: Exact Diagonalization of Strongly Correlated Electron-Phonon Systems" M.G. Zacher, A. Dorneich, C. Gröber, R. Eder, and W. Hanke Institut für Theoretische Physik, Universität Würzburg "The Metal-Insulator Transition in the Hubbard Model" Wolfgang Rieger, André Buchau, Christian Huber, and Wolfgang M. Rucker Institut für Theorie der Elektrotechnik, Universität Stuttgart "Direct and Inverse Electromagnetic Scattering" Ottilia Werner-Kytölä Institut für Programmstrukturen und Datenorganisation, Universität Karlsruhe "ParGrad System: Dynamical Adaption of the Parallelism Degree of Programs on CRAY T3E" Matthias M. Müller Institut für Programmstrukturen und Datenorganisation, Universität Karlsruhe "KaHPF: Compiler generated Data Prefetching for HPF" Andreas Paul Institut für Rechenarchitektur, Universität Saarbrücken "Comparative Measurements of the Solution of PDE's on the PARAGON and the SB-PRAM" M. Hipp, S. Hüttemann, M. Konold, M. Klingler, P. Leinen, M. Ritt, W. Rosenstiel, H. Ruder, R. Speith, and H. Yserentant Wilhelm-Schickard-Institut für Informatik, Universität Tübingen Institut für Astronomie und Astrophysik, Universität Tübingen Mathematisches Institut, Universität Tübingen "A Parallel Object Oriented Framework for Particle Methods" |
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| 16:50 |
Poster-Exhibit |
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| 17:30 |
Poster-Discussion I |
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| 18:00 |
Poster-Session II B. Buchtala, K.-H. Hierholz, and S. Wagner Institut für Aerodynamik und Gasdynamik, Universität Stuttgart "Aeroelastic Analysis of a Helicopter Rotor in Forward Flight" Ernst von Lavante, Michael Kallenberg, and Dirk Zeitz Lehrstuhl für Strömungsmaschinen, Universität Essen "Numerical Simulation of Supersonic Air Flow with Transverse Hydrogen Injection" M. Schmid, M. Peric Institut für Schiffbau, Universität Hamburg "Computation of Turbulent Flows with Separation by Coherent Structure Capturing" J. Fröhlich, W. Rodi Institut für Hydromechanik, Universität Karlsruhe "Large Eddy Simulation of the Flow around a Circular Cylinder" Michael Manhart Lehrstuhl für Fluidmechanik, Technische Universität München "Direct Numerical Simulations of an Adverse Pressure Gradient Turbulent Boundary Layer on High Performance Computers" P. Gerlinger, D. Brüggemann LTTT, Universität Bayreuth "Multigrid Convergence Acceleration for Non-Reactiv and Reactive Flows" H.-H. Frühauf, M. Fertig, F. Olawsky, and T.Bönisch Institut für Raumfahrstsysteme, Universität Stuttgart Rechenzentrum, Universität Stuttgart "Upwind Relaxation Algorithm for Re-Entry Nonequilibrium Flows" Erik H. Saenger, Peter Hubral, Andreas Kirchner, Kai-Uwe Vieth, Tobias Müller, and Serge A. Shapiro Geophysikalisches Institut, Universität Karlsruhe Fachrichtung Geophysik, Freie Universität Berlin "Modelling of elastic waves in fractured media" |
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| 18:40 |
Poster-Exhibit |
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| 19:00 |
Poster-Discussion II |
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| 19:30 |
Walk to the International Meeting-Center of Stuttgart University (IBZ) |
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| 20:00 |
Workshop-Dinner on behalf of NEC-Corporation and Golden Spike of HLRS award-session at IBZ |
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Wednesday, October 6th 1999 |
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| 9:00 |
Session 7: Bioinformatics and Life Sciences Chairman: Prof. Dr. W. Jäger, Universität Heidelberg |
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| 9:00 |
Tobias A. Knoch, Christian Münkel, and Jörg Langoswki Deutsches Krebsforschungszentrum, Heidelberg "Three-Dimensional Organization of Chromosome Territories and the Human Cell Nucleus" |
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| 9:25 |
Discussion |
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| 9:35 |
Session 8: Electrodynamics Chairman: Prof. Dr. W. Nagel, TU Dresden |
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| 9:35 |
Ulrich Jakobus Institut für Hochfrequenztechnik, Universität Stuttgart "Computation of Electromagnetic Fields by the Method of Moments on the CRAY T3E: Iterative Solution Techniques and Large Scale Applications" |
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| 10:00 |
Discussion |
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| 10:10 |
Coffee |
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| 10:30 |
Session 9: Computer-Science and Informatics Chairman: Prof. Dr. C. Zenger, TU München |
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| 10:30 |
Andreas Grävinghoff and Jörg Keller Technische Informatik II, FernUniversität Hagen "Fine-Grained Multithreading on the CRAY T3E" |
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| 10:55 |
Discussion |
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| 11:05 |
P. Adamidis, A. Beck, U. Becker-Lemgau, Y. Ding, M. Hackenberg, H. Holthoff, M. Laux, A. Müller, M. Münch, B. Steckel, C. Pospiech, and R. Tilch GMD St. Augustin, IBM Heidelberg, IPVR Universität Stuttgart "Coupling and Parallelization of Grid-based Numerical Simulation Software" |
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| 11:30 |
Discussion |
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| 11:40 |
Peter Bastian, Klaus Birken, Klaus Johannsen, Stefan Lang, Volker Reichenberger, Christian Wieners, Gabriel Wittum, and Christian Wrobel Interdisziplinäres Zentrum für Wissenschaftliches Rechnen, Universität Heidelberg "Parallel Solutions of Partial Differential Equations with Adaptive Multigrid Methods on Unstructured Grids" |
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| 12:05 |
Discussion |
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| 12:15 |
Lunch |
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| 13:30 |
Tutorial-Session 1: MPI-2 R. Rabenseifner, HLRS |
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| 15:30 |
Coffee |
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| 16:00 |
Tutorial-Session 2: Performance-Analysis on High Performance Computers W.Krotz-Vogel, Pallas GmbH, I. Loebich, HLRS |
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| 17:30 |
End of Workshop |
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