Inhaltsangabe
I High Performance Systems.- TeraFlops Computing with the Hitachi SR8000-F1: From Vision to Reality.- II Computational Fluid Dynamics.- Numerical Prediction of Deformations and Oscillations of Wind-Exposed Structures.- Large-Eddy and Detached-Eddy Simulation of the Flow Around High-Lift Configurations.- Direct Simulation with the Lattice Boltzmann Code BEST of Developed Turbulence in Channel Flows.- DNS of Homogeneous Shear Flow and Data Analysis for the Development of a Four-Equation Turbulence Model.- Large-Eddy Simulations of High Reynolds Number Flow Around a Circular Cylinder.- Numerical Simulation of Passively Controlled Turbulent Flows over Sharp-Edged and Smoothly Contoured Backward-Facing Steps.- Parallel Single- and Multiphase CFD-Applications Using Lattice Boltzmann Methods.- Models of Type Ia Supernova Explosions.- Direct Numerical Simulation of Boundary Layer Separation along a Curved Wall with Oscillating Oncoming Flow.- III Biosciences.- QM/MM Study of Rhodopsin.- Simulation of Neuronal Map Formation in the Primary Visual Cortex.- IV Chemistry.- A User-Oriented Set of Quantum Chemical Benchmarks.- Structure, Energetics, and Spectroscopy of Models for Enzyme Cofactors.- Ruthenium Dioxide, a Versatile Oxidation Catalyst: First Principles Analysis.- Theoretical Studies of Structures of Vanadate Complexes in Aqueous Solution.- V Solid-State Physics.- Large Scale Car-Parrinello Simulation of Fully Hydrated DNA.- Metal-Insulator Transitions and Realistic Modelling of Correlated Electron Systems.- Monte Carlo Studies of Three-Dimensional Bond-Diluted Ferromagnets.- Microwave Ionisation of Non-Hydrogenic Alkali Rydberg States.- Density-Functional Calculation and Inelastic Neutron Scattering of Structural and Dynamical Properties in Fluoride Crystals.- Optical Response of Semiconductor Surfaces and Molecules Calculated from First Principles.- Phase Fluctuations and the Role of Electron Phonon Coupling in High-TcSuperconductors.- The Cluster-Perturbation-Theory and its Application to Strongly-Correlated Materials.- Object-Oriented C++ Class Library for Many Body Physics on Finite Lattices and a First Application to High-Temperature Superconductivity.- From Fermi Liquid to Non-Fermi Liquid Physics - Influence of Non-Local Fluctuations in Low-Dimensional Fermion Systems.- One-Dimensional Electron-Phonon Systems: Mott- Versus Peierls-Insulators.- VI Geophysics.- 3-D Seismic Wave Propagation on a Global and Regional Scale: Earthquakes, Fault Zones, Volcanoes.- VII Fundamental Physics.- Simulation of QCD with Dynamical Quarks.- Quantum Chromodynamics with Chiral Quarks.- Three-Nucleon Force in the4He Scattering System.- Simulations of the Local Universe.- The Free Electron Maser in Pulsar Magnetospheres.- VIII Computer Science.- Pseudo-Vectorization and RISC Optimization Techniques for the Hitachi SR8000 Architecture.- Automatic Performance Analysis on Hitachi SR8000.- Adapting PAxML to the Hitachi SR8000-F1 Supercomputer.- Load Balancing for Spatial-Grid-Based Parallel Numeric Simulations on Clusters of SMPs - A Case Study from an Industrial CFD Simulation.- Scientific Progress in the Par-EXPDE-Project.- gridlib - A Parallel, Object-Oriented Framework for Hierarchical-Hybrid Grid Structures in Technical Simulation and Scientific Visualization.
Reseña del editor
This volume presents a selection of reports from scientific projects requiring high end computing resources on the Hitachi SR8000-F1 supercomputer operated by Leibniz Computing Center in Munich. All reports were presented at the joint HLRB and KONWHIR workshop at the Technical University of Munich in October 2002. The following areas of scientific research are covered: Applied Mathematics, Biosciences, Chemistry, Computational Fluid Dynamics, Cosmology, Geosciences, High-Energy Physics, Informatics, Nuclear Physics, Solid-State Physics. Moreover, projects from interdisciplinary research within the KONWIHR framework (Competence Network for Scientific High Performance Computing in Bavaria) are also included. Each report summarizes its scientific background and discusses the results with special consideration of the quantity and quality of Hitachi SR8000 resources needed to complete the research.
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