High Performance Computing in Science and Engineering ‘13: Transactions of the High Performance Computing Center, Stuttgart (HLRS) 2013

Front Matter....Pages i-xiii
Front Matter....Pages 1-4
A Dissipative-Particle-Dynamics Model for Simulating Dynamics of Charged Colloids....Pages 5-18
Phase Separation of Colloid Polymer Mixtures Under Confinement....Pages 19-31
Heterogeneous and Homogeneous Crystallization of Soft Spheres in Suspension....Pages 33-52
Simplified Models for Coarse-Grained Hemodynamics Simulations....Pages 53-64
Report: Thermodynamics with $$2 + 1 + 1$$ Dynamical Quark Flavors....Pages 65-72
Unconventional Fractionalization of Strongly Correlated Electrons....Pages 73-80
Numerically-Exact Schrödinger Dynamics of Closed and Open Many-Boson Systems with the MCTDHB Package....Pages 81-92
Lithium Niobate Dielectric Function and Second-Order Polarizability Tensor From Massively Parallel Ab Initio Calculations....Pages 93-104
Acoustic and Elastic Full Waveform Tomography....Pages 105-122
Particle Simulation in Turbulent Plasmas with Amplified Wavemodes....Pages 123-137
Front Matter....Pages 139-140
Molecular Dynamics Simulations with Long-Range Interactions....Pages 141-154
Polarization Dependent Water Adsorption on the Lithium Niobate Z-Cut Surfaces....Pages 155-166
Ab-Initio Calculations of the Vibrational Properties of Nanostructures....Pages 167-181
Front Matter....Pages 183-184
From Molecules to Thin Films: GaP Nucleation on Si Substrates....Pages 185-199
Numerical Studies of the Tunneling Splitting of Malonaldehyde and the Eigenstates of Hydrated Hydroxide Anion Using MCTDH....Pages 201-218
Efficient Calculation of Multi-dimensional Potential Energy Surfaces of Molecules and Molecular Clusters....Pages 219-230
Front Matter....Pages 231-232
Delayed Detached Eddy Simulation of a Rotationally Symmetric Supersonic Jet....Pages 233-244
DNS of Lean Premixed Flames....Pages 245-257
Impact of Grid Refinement on Turbulent Combustion and Combustion Noise Modeling with Large Eddy Simulation....Pages 259-274
Front Matter....Pages 275-280
Discontinuous Galerkin for High Performance Computational Fluid Dynamics....Pages 281-294
Front Matter....Pages 275-280
Industrial Turbulence Simulations at Large Scale....Pages 295-319
Direct Numerical Simulation of Inelastic Non-Newtonian Jet Breakup....Pages 321-335
Direct Numerical Simulation of Boundary Layer Transition in Streamwise Corner-Flow....Pages 337-348
LES of Turbulent Cavitating Shear Layers....Pages 349-359
Large Eddy Simulation of Cavitating Flows Using a Novel Stochastic Field Formulation....Pages 361-375
Large-Eddy Simulation of the Particle-Laden Turbulent Flow in a Cyclone Separator....Pages 377-391
Efficient Coupling of an Eulerian Flow Solver with a Lagrangian Particle Solver for the Investigation of Particle Clustering in Turbulence....Pages 393-404
Lagrangian Simulation of a Fluid with Solid Particle Loading Performed on Supercomputers....Pages 405-421
Computation of Helicopter Phenomena Using a Higher Order Method....Pages 423-438
Unsteady CFD Simulation of the NASA Common Research Model in Low Speed Stall....Pages 439-453
Flow Simulation of a Francis Turbine Using the SAS Turbulence Model....Pages 455-463
3D CFD Simulation of Twin Entry Turbochargers in an Engine Environment....Pages 465-476
Numerical Simulation of Flow with Volume Condensation in a Model Containment....Pages 477-492
Highly Efficient Integrated Simulation of Electro-membrane Processes for Desalination of Sea Water....Pages 493-508
Front Matter....Pages 509-510
High Resolution Climate Modeling with the CCLM Regional Model....Pages 511-527
High-Resolution Climate Predictions and Short-Range Forecasts to Improve the Process Understanding and the Representation of Land-Surface Interactions in the WRF Model in Southwest Germany (WRFCLIM)....Pages 529-542
High Resolution Climate Change Information for the Lower Mekong River Basin of Southeast Asia....Pages 543-551
Reducing the Uncertainties of Climate Projections: High-Resolution Climate Modeling of Aerosol and Climate Interactions on the Regional Scale Using COSMO-ART....Pages 553-555
Global Long-Term MIPAS Data Processing....Pages 557-567
The Agulhas System in a Global Context....Pages 569-576
Front Matter....Pages 577-578
Optimal Versus Alternative Economic Capital Allocation in Banking....Pages 579-589
Geodynamic Mantle Modeling and Its Relation to Origin and Preservation of Life....Pages 591-617
Magma Ocean Cumulate Overturn and Its Implications for the Thermo-chemical Evolution of Mars....Pages 619-634
Surface Tension, Large Scale Thermodynamic Data Generation and Vapor-Liquid Equilibria of Real Compounds....Pages 635-646
Molecular Modelling and Simulation of Electrolyte Solutions, Biomolecules, and Wetting of Component Surfaces....Pages 647-661
Focal Adhesion Kinase as a Cellular Mechano-Sensor....Pages 663-669
A Highly Scalable Multigrid Method with Parallel Direct Coarse Grid Solver for Maxwell’s Equations....Pages 671-677
Reduction of Numerical Sensitivities in Crash Simulations on HPC-Computers (HPC-10)....Pages 679-697