This book presents the state-of-the-art in simulation on supercomputers. Leading researchers present results achieved on systems of the Stuttgart High Performance Computing Center in 2007. The reports cover all fields of computational science and engineering, with emphasis on industrially relevant applications. Presenting results for both vector-based and microprocessor-based systems, the book allows comparison between performance levels and usability of various architectures.
This book presents the state-of-the-art in simulation on supercomputers. Leading researchers present results achieved on systems of the Stuttgart High Performance Computing Center in 2007. The reports cover all fields of computational science and engineering, with emphasis on industrially relevant applications. Presenting results for both vector-based and microprocessor-based systems, the book allows comparison between performance levels and usability of various architectures.
Physics.- The SuperN-Project: Current Progress in Modelling Core Collapse Supernovae.- Toward Conquering the Parameter Space of Gravitational Wave Signals from Black Hole Coalescence.- Massless Four-Loop Integrals and the Total Cross Section in e+ e? Annihilation.- Structural Transitions in Colloidal Suspensions.- Solid State Physics.- Simulations of Strongly Correlated Quantum Systems out of Equilibrium.- Computer Simulations of Soft Matter- and Nano-Systems.- Signal Transport in and Conductance of Correlated Nanostructures.- Ab initio Simulations of PbTe-CdTe Nanostructures.- The Basic Structure of Ti-Si-N Superhard Nanocomposite Coatings: Ab Initio Studies.- Chemistry.- Shared Memory Parallelization of the Multi-Configuration Time-Dependent Hartree Method and Application to the Dynamics and Spectroscopy of the Protonated Water-Dimer.- Green Chemistry from Supercomputers: Car-Parrinello Simulations of Emim-Chloroaluminates Ionic Liquids.- DFT Modelling of Oxygen Adsorption on CoCr Surfaces.- Comparison of the Incorporation of Watson-Crick Complementary and Mismatched Nucleotides Catalyzed by DNA Polymerase I.- Reacting Flows.- Assumed PDF Modeling of Turbulence Chemistry Interaction in Scramjet Combustors.- Simulations of Premixed Swirling Flames Using a Hybrid Finite-Volume/Transported PDF Approach.- Computations of Premixed Turbulent Flames.- Ignition of Droplets in a Laminar Convective Environment.- Computational Fluid Dynamics.- Laminar-Turbulent Transition in a Laminar Separation Bubble: Influence of Disturbance Amplitude on Bubble Size and Bursting.- Direct Numerical Simulation on the Influence of the Nozzle Design for Water Sheets Emerged at Moderate Reynolds Numbers.- DNS of Heat Transfer from a Flat Plate Affected by Free-Stream Fluctuations.- DirectNumerical Simulation of Turbulent Flow Over Dimples - Code Optimization for NEC SX-8 plus Flow Results.- Direct Numerical Simulation of a Serrated Nozzle End for Jet-Noise Reduction.- Direct Numerical Simulation of a Round Jet into a Crossflow - Analysis and Required Resources.- Transport of Heavy Spherical Particles in Horizontal Channel Flow.- Analysis of Turbulent Structures in a Czochralski System Using DNS and LES Predictions.- Aeroacoustic Prediction of Jet and Slat Noise.- Investigation of the Turbulent Flow Separation from an Axisymmetric Hill.- Large Eddy Simulation (LES) with Moving Meshes on a Rapid Compression Machine: Part 2: Numerical Investigations Using Euler-Lagrange-Technique.- Numerical Characterization of the Non-Reacting Flow in a Swirled Gasturbine Model Combustor.- On Implementing the Hybrid Particle-Level-Set Method on Supercomputers for Two-Phase Flow Simulations.- Lattice Boltzmann Simulations of Microemulsions and Binary Immiscible Fluids Under Shear.- Numerical Investigation of Hypersonic Intake Flows.- Trimmed Simulation of a Complete Helicopter Configuration Using Fluid-Structure Coupling.- FEAST: Development of HPC Technologies for FEM Applications.- Transport and Climate.- Global Long-Term MIPAS Processing.- Modelling the Regional Climate of Southwest Germany: Sensitivity to Simulation Setup.- OpenMP Parallelization of the METRAS Meteorology Model: Application to the America's Cup.- Structural Mechanics.- Adaptive Analysis of Bifurcation Points of Shell Structures.- Miscellaneous Topics.- Molecular Modeling of Hydrogen Bonding Fluids: Formic Acid and Ethanol + R227ea.- Modeling Elastic and Poroelastic Wave Propagation in Complex Geological Structures.- Whole-Mantle Convection, Continent Generation, and Preservation of GeochemicalHeterogeneity.- Numerical Simulation of Human Radiation Heat Transfer Using a Mathematical Model of Human Physiology and Computational Fluid Dynamics (CFD).- Parallel Finite Element Methods with Weighted Linear B-Splines.
Physics.- The SuperN-Project: Current Progress in Modelling Core Collapse Supernovae.- Toward Conquering the Parameter Space of Gravitational Wave Signals from Black Hole Coalescence.- Massless Four-Loop Integrals and the Total Cross Section in e+ e? Annihilation.- Structural Transitions in Colloidal Suspensions.- Solid State Physics.- Simulations of Strongly Correlated Quantum Systems out of Equilibrium.- Computer Simulations of Soft Matter- and Nano-Systems.- Signal Transport in and Conductance of Correlated Nanostructures.- Ab initio Simulations of PbTe-CdTe Nanostructures.- The Basic Structure of Ti-Si-N Superhard Nanocomposite Coatings: Ab Initio Studies.- Chemistry.- Shared Memory Parallelization of the Multi-Configuration Time-Dependent Hartree Method and Application to the Dynamics and Spectroscopy of the Protonated Water-Dimer.- Green Chemistry from Supercomputers: Car-Parrinello Simulations of Emim-Chloroaluminates Ionic Liquids.- DFT Modelling of Oxygen Adsorption on CoCr Surfaces.- Comparison of the Incorporation of Watson-Crick Complementary and Mismatched Nucleotides Catalyzed by DNA Polymerase I.- Reacting Flows.- Assumed PDF Modeling of Turbulence Chemistry Interaction in Scramjet Combustors.- Simulations of Premixed Swirling Flames Using a Hybrid Finite-Volume/Transported PDF Approach.- Computations of Premixed Turbulent Flames.- Ignition of Droplets in a Laminar Convective Environment.- Computational Fluid Dynamics.- Laminar-Turbulent Transition in a Laminar Separation Bubble: Influence of Disturbance Amplitude on Bubble Size and Bursting.- Direct Numerical Simulation on the Influence of the Nozzle Design for Water Sheets Emerged at Moderate Reynolds Numbers.- DNS of Heat Transfer from a Flat Plate Affected by Free-Stream Fluctuations.- DirectNumerical Simulation of Turbulent Flow Over Dimples - Code Optimization for NEC SX-8 plus Flow Results.- Direct Numerical Simulation of a Serrated Nozzle End for Jet-Noise Reduction.- Direct Numerical Simulation of a Round Jet into a Crossflow - Analysis and Required Resources.- Transport of Heavy Spherical Particles in Horizontal Channel Flow.- Analysis of Turbulent Structures in a Czochralski System Using DNS and LES Predictions.- Aeroacoustic Prediction of Jet and Slat Noise.- Investigation of the Turbulent Flow Separation from an Axisymmetric Hill.- Large Eddy Simulation (LES) with Moving Meshes on a Rapid Compression Machine: Part 2: Numerical Investigations Using Euler-Lagrange-Technique.- Numerical Characterization of the Non-Reacting Flow in a Swirled Gasturbine Model Combustor.- On Implementing the Hybrid Particle-Level-Set Method on Supercomputers for Two-Phase Flow Simulations.- Lattice Boltzmann Simulations of Microemulsions and Binary Immiscible Fluids Under Shear.- Numerical Investigation of Hypersonic Intake Flows.- Trimmed Simulation of a Complete Helicopter Configuration Using Fluid-Structure Coupling.- FEAST: Development of HPC Technologies for FEM Applications.- Transport and Climate.- Global Long-Term MIPAS Processing.- Modelling the Regional Climate of Southwest Germany: Sensitivity to Simulation Setup.- OpenMP Parallelization of the METRAS Meteorology Model: Application to the America's Cup.- Structural Mechanics.- Adaptive Analysis of Bifurcation Points of Shell Structures.- Miscellaneous Topics.- Molecular Modeling of Hydrogen Bonding Fluids: Formic Acid and Ethanol + R227ea.- Modeling Elastic and Poroelastic Wave Propagation in Complex Geological Structures.- Whole-Mantle Convection, Continent Generation, and Preservation of GeochemicalHeterogeneity.- Numerical Simulation of Human Radiation Heat Transfer Using a Mathematical Model of Human Physiology and Computational Fluid Dynamics (CFD).- Parallel Finite Element Methods with Weighted Linear B-Splines.
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