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At least 1,225 records · Page 68

Tartarus: A relativistic Green's function quantum average atom code

A relativistic Green’s Function quantum average atom model is implemented in the Tartarus code for the calculation of equation of state data in dense plasmas. We first present the relativistic extension of the quantum Green’s Function average atom model described by Starrett [1]. The Green’s Function approach addresses the numerical challenges arising from resonances in the continuum density of states without the need for resonance tracking algorithms or adaptive meshes, though there are still numerical challenges inherent to this algorithm. We discuss how these challenges are addressed in the Tartarus algorithm. The outputs of the calculation are shown in comparison to PIMC/DFT-MD simulations of the Principal Shock Hugoniot in Silicon. Finally, we also present the calculation of the Hugoniot for Silver coming from both the relativistic and nonrelativistic modes of the Tartarus code.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

A mass-conserving lattice Boltzmann method with dynamic grid refinement for immiscible two-phase flows

A mass-conserving lattice Boltzmann method (LBM) for multiphase flows is presented in this paper. The proposed LBM improves a previous model (Lee and Liu, 2010 [21]) in terms of mass conservation, speed-up, and efficiency, and also extends its capabilities for implementation on non-uniform grids. The presented model consists of a phase-field lattice Boltzmann equation (LBE) for tracking the interface between different fluids and a pressure-evolution LBM for recovering the hydrodynamic properties. In addition to the mass conservation property and the simplicity of the algorithm, the advantages of the current phase-field LBE are that it is an order of magnitude faster than the previous interface tracking LBE proposed by Lee and Liu (2010) [21] and it requires less memory resources for data storage. Meanwhile, the pressure-evolution LBM is equipped with a multi-relaxation-time (MRT) collision operator to facilitate attainability of small relaxation rates thereby allowing simulation of multiphase flows at higher Reynolds numbers. Additionally, we reformulate the presented MRT-LBM on nonuniform grids within an adaptive mesh refinement (AMR) framework. Various benchmark studies such as a rising bubble and a falling drop under buoyancy, droplet splashing on a wet surface, and droplet coalescence onto a fluid interface are conducted to examine the accuracy and versatility of the proposed AMR-LBM. The proposed model is further validated by comparing the results with other LB models on uniform grids. A factor of about 20 in savings of computational resources is achieved by using the proposed AMR-LBM. As a more demanding application, the Kelvin–Helmholtz instability (KHI) of a shear-layer flow is investigated for both density-matched and density-stratified binary fluids. The KHI results of the density-matched fluids are shown to be in good agreement with the benchmark AMR results based on the sharp-interface approach. When a density contrast between the two fluids exists, a typical chaotic structure in the flow field is observed at a Reynolds number of 10000, which indicates that the proposed model is a promising tool for direct numerical simulation of two-phase flows.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Laser-generated plasmas in length scales relevant for thin film growth and processing: simulation and experiment

In pulsed laser deposition, thin film growth is mediated by a laser-generated plasma, whose properties are critical for controlling the film microstructure. The advent of 2D materials has renewed the interest in how this ablation plasma can be used to manipulate the growth and processing of atomically thin systems. For such purpose, a quantitative understanding of the density, charge state, and kinetic energy of plasma constituents is needed at the location where they contribute to materials processes. Here, we study laser-induced plasmas over expansion distances of several centimeters from the ablation target, which is the relevant length scale for materials growth and modification. The study is enabled by a fast implementation of a laser ablation/plasma expansion model using an adaptive Cartesian mesh solver. Simulation outcomes for KrF excimer laser ablation of Cu are compared with Langmuir probe and optical emission spectroscopy measurements. Furthermore, simulation predictions for the plasma-shielding threshold, the ionization state of species in the plasma, and the kinetic energy of ions, are in good correspondence with experimental data. For laser fluences of 1–4 J cm -2 , the plume is dominated by Cu 0 , with small concentrations of Cu+ and electrons at the expansion front. Higher laser fluences (e.g. 7 J cm -2 ) lead to a Cu + -rich plasma, with a fully ionized leading edge where Cu 2+ is the dominant species. In both regimes, simulations indicate the presence of a low-density, high-temperature plasma expansion front with a high degree of ionization that may play a significant role in doping, annealing, and kinetically-driven phase transformations in 2D materials.

2D materials↗

Deploy threading in Nalu solver stack

The goal of the ExaWind project is to enable predictive simulations of wind farms composed of many MW-scale turbines situated in complex terrain. Predictive simulations will require computational fluid dynamics (CFD) simulations for which the mesh resolves the geometry of the turbines, and captures the rotation and large deflections of blades. Whereas such simulations for a single turbine are arguably petascale class, multi-turbine wind farm simulations will require exascale-class resources. The primary code in the ExaWind project is Nalu, which is an unstructured-grid solver for the acousticallyincompressible Navier-Stokes equations, and mass continuity is maintained through pressure projection. The model consists of the mass-continuity Poisson-type equation for pressure and a momentum equation for the velocity. For such modeling approaches, simulation times are dominated by linear-system setup and solution for the continuity and momentum systems. For the ExaWind challenge problem, the moving meshes greatly affect overall solver costs as re-initialization of matrices and re-computation of preconditioners is required at every time step In this Milestone, we examine the effect of threading on the solver stack performance against flat-MPI results obtained from previous milestones using Haswell performance data full-turbine simulations. Whereas the momentum equations are solved only with the Trilinos solvers, we investigate two algebraic-multigrid preconditioners for the continuity equations: Trilinos/Muelu and HYPRE/BoomerAMG. These two packages embody smoothed-aggregation and classical Ruge-Stiiben AMG methods, respectively. In our FY18 Q2 report, we described our efforts to improve setup and solve of the continuity equations under flat-MPI parallelism. While significant improvement was demonstrated in the solve phase, setup times remained larger than expected. Starting with the optimized settings described in the Q2 report, we explore here simulation performance where OpenMP threading is employed in the solver stack. For Trilinos, threading is acheived through the Kokkos abstraction where, whereas HYPRE/BoomerAMG employs straight OpenMP. We examined results for our mid-resolution baseline turbine simulation configuration (229M DOF). Simulations on 2048 Haswell cores explored the effect of decreasing the number of MPI ranks while increasing the number of threads. Both HYPRE and Trilinos exhibited similar overal solution times, and both showed dramatic increases in simulation time in the shift from MPI ranks to OpenMP threads. This increase is attributed to the large amount of work per MPI rank starting at the single-thread configuration. Decreasing MPI ranks, while increasing threads, may be increasing simulation time due to thread synchronization and start-up overhead contributing to the latency and serial time in the model. These result showed that an MPI+OpenMP parallel decomposition will be more effective as the amount per MPI rank computation per MPI rank decreases and the communication latency increases. This idea was demonstrated in a strong scaling study of our low-resolution baseline model (29M DOF) with the Trilinos-HYPRE configuration. While MPI-only results showed scaling improvement out to about 1536 cores, engaging threading carried scaling improvements out to 4128 cores — roughly 7000 DOF per core. This is an important result as improved strong scaling is needed for simulations to be executed over sufficiently long simulated durations (i.e., for many timesteps). In addition to threading work described above, the team examined solver-performance improvements by exploring communication-overhead in the HYPRE-GMRES implementation through a communicationoptimal- GMRE algorithm (CO-GMRES), and offloading compute-intensive solver actions to GPUs. To those ends, a HYPRE mini-app was allow us to easily test different solver approaches and HYPRE parameter settings without running the entire Nalu code. With GPU acceleration on the Summitdev supercomputer, a 20x speedup was achieved for the overall preconditioner and solver execution time for the mini-app. A study on Haswell processors showed that CO-GMRES provides benefits as one increases MPI ranks.

17 WIND ENERGY↗

Investigation of vortex breakdown on a delta wing using Euler and Navier-Stokes equations

A numerical investigation of leading-edge vortex breakdown on a delta wing at high angles of attack is presented. The analysis has been restricted to low speed flows on a flat plate wing with sharp leading edges. Both Euler and Navier-Stokes (assuming fully laminar and fully turbulent flows) equations have been used in this study and the results are compared against experimental data. Predictions of vortex breakdown progression with angle of attack with both Euler and Navier-Stokes equations are shown to be consistent with the experimental data. However, the Navier-Stokes predictions show significant improvements in breakdown location at angles of attack where the vortex breakdown approaches the wing apex. The location of the primary vortex and the level of vorticity in the pre-breakdown regions in these flowfield solutions are affected very little by the viscous effects, even though the Navier-Stokes solutions exhibit viscous phenomena such as secondary and tertiary vortices which are not present in the Euler solutions. In the post-breakdown regions, however, the levels of vorticity in the primary vortex have increased differences between the Euler and Navier-Stokes solutions at comparable locations. Navier-Stokes indicates the presence of a secondary vortex even after the primary vortex is burst. The predicted trajectories of the primary vortex are in very good agreement with the test data, the laminar solutions providing the overall best comparison. The Euler shows a small displacement of the primary vortex, relative to experiment, due to the lack of secondary vortices. The turbulent Navier-Stokes, in general, fall between the Euler and laminar solutions. These findings are based on solutions from meshes that are not usually considered fine enough for resolving vortical flows. To further understand the vortex breakdown phenomenon and the fine details of the vortical flow structure, further calculations with the finer meshes and improved turbulence models are necessary.

S. Agrawal↗

Spatial adaptation procedures on tetrahedral meshes for unsteady aerodynamic flow calculations

Spatial adaptation procedures for the accurate and efficient solution of steady and unsteady inviscid flow problems are described. The adaptation procedures were developed and implemented within a three-dimensional, unstructured-grid, upwind-type Euler code. These procedures involve mesh enrichment and mesh coarsening to either add points in high gradient regions of the flow or remove points where they are not needed, respectively, to produce solutions of high spatial accuracy at minimal computational cost. The paper gives a detailed description of the enrichment and coarsening procedures and presents comparisons with experimental data for an ONERA M6 wing and an exact solution for a shock-tube problem to provide an assessment of the accuracy and efficiency of the capability. Steady and unsteady results, obtained using spatial adaptation procedures, are shown to be of high spatial accuracy, primarily in that discontinuities such as shock waves are captured very sharply.

Rausch, Russ D.↗

Parallel Tetrahedral Mesh Adaptation with Dynamic Load Balancing

The ability to dynamically adapt an unstructured grid is a powerful tool for efficiently solving computational problems with evolving physical features. In this paper, we report on our experience parallelizing an edge-based adaptation scheme, called 3D_TAG. using message passing. Results show excellent speedup when a realistic helicopter rotor mesh is randomly refined. However. performance deteriorates when the mesh is refined using a solution-based error indicator since mesh adaptation for practical problems occurs in a localized region., creating a severe load imbalance. To address this problem, we have developed PLUM, a global dynamic load balancing framework for adaptive numerical computations. Even though PLUM primarily balances processor workloads for the solution phase, it reduces the load imbalance problem within mesh adaptation by repartitioning the mesh after targeting edges for refinement but before the actual subdivision. This dramatically improves the performance of parallel 3D_TAG since refinement occurs in a more load balanced fashion. We also present optimal and heuristic algorithms that, when applied to the default mapping of a parallel repartitioner, significantly reduce the data redistribution overhead. Finally, portability is examined by comparing performance on three state-of-the-art parallel machines.

Oliker, Leonid↗

Experimental Study of the Influence of Speed and Load on Thermal Behavior of High-Speed Helical Gear Trains

An experimental effort has been conducted on an aerospace-quality helical gear train to investigate the thermal behavior of the gear system as speed, load, and lubricant flow rate were varied. Temperature test data from a helical gear train at varying speeds and loads (to 5000 hp and 15000 rpm) was collected using thermocouple rakes and axial arrays. The instrumentation was able to capture the radial and axial expelled lubricant-air environment (fling-off lubricant) that is expelled during the gear meshing process. Effects of operational characteristics are presented.

Handschuh, R.↗

Establishing Best Practices for X-57 Maxwell CFD Database Generation

The X-57 Maxwell is NASA’s latest electric airplane concept that has been simulated for aerodynamic performance using the structured overset and unstructured grid solvers within the Launch Ascent and Vehicle Aerodynamics (LAVA) solver framework as well as the unstructured polyhedral grid solver in Star-CCM+ for code-to-code comparison. In order to validate the predictions, comparisons were made between the CFD solutions and experimental data collected in the 12-foot Low-Speed Wind Tunnel at NASA Langley Research Center. The simulations are in preparation for the development of a comprehensive aerodynamic database which will assess aircraft performance at a variety of conditions. The findings from these simulations will establish the best practices for mesh resolution, numerical discretization, and turbulence modeling to be used for this database. Preliminary database results have shown that best-practices learned from the initial validation simulations will potentially reduce error in X-57 aerodynamic loads and moments relative to experiment by up to 14%.

Duensing, Jared C.↗

Parabolic Deployable Antenna

A deployable antenna is described. The antenna comprises a mesh attached to foldable ribs, a hub and a sub-reflector. The antenna can be stowed in a tight space for launching in space, and later deployed by extending out of its container. The antenna is designed to work in the Ka band or other bands and can increase data rates and function as a radio antenna.

Thomson, Mark W.↗

A Conservative, Scalable, Space-Time Blade Element Rotor Model for Multi-Rotor Vehicles

The development of a parallel blade-element rotor model and its implementation into an adaptive Cartesian method is described. The unsteady version of the rotor model applies a body force to all cells contained in the swept space-time volume at each timestep and special care is taken to maintain axisymmetry on the Cartesian grid. Mesh convergence of rotor thrust and torque is obtained with around 10000 cells in the disk for the steady model. Parallelization is accomplished using OpenMP and the rotor force computation is distributed across all available nodes. Simulations of an isolated XV-15 rotor in hover show good correlation with experimental data and predictions of multi-rotor thrust variation closely match previous high fidelity simulations. The final paper will also include results from the unsteady rotor model and parallel scaling tests.

Conservative↗

Rotor Airloads Prediction Using Unstructured Meshes and Loose CFD/CSD Coupling

The FUN3D unsteady Reynolds-averaged Navier-Stokes solver for unstructured grids has been modified to allow prediction of trimmed rotorcraft airloads. The trim of the rotorcraft and the aeroelastic deformation of the rotor blades are accounted for via loose coupling with the CAMRAD II rotorcraft computational structural dynamics code. The set of codes is used to analyze the HART-II Baseline, Minimum Noise and Minimum Vibration test conditions. The loose coupling approach is found to be stable and convergent for the cases considered. Comparison of the resulting airloads and structural deformations with experimentally measured data is presented. The effect of grid resolution and temporal accuracy is examined. Rotorcraft airloads prediction presents a very substantial challenge for Computational Fluid Dynamics (CFD). Not only must the unsteady nature of the flow be accurately modeled, but since most rotorcraft blades are not structurally stiff, an accurate simulation must account for the blade structural dynamics. In addition, trim of the rotorcraft to desired thrust and moment targets depends on both aerodynamic loads and structural deformation, and vice versa. Further, interaction of the fuselage with the rotor flow field can be important, so that relative motion between the blades and the fuselage must be accommodated. Thus a complete simulation requires coupled aerodynamics, structures and trim, with the ability to model geometrically complex configurations. NASA has recently initiated a Subsonic Rotary Wing (SRW) Project under the overall Fundamental Aeronautics Program. Within the context of SRW are efforts aimed at furthering the state of the art of high-fidelity rotorcraft flow simulations, using both structured and unstructured meshes. Structured-mesh solvers have an advantage in computation speed, but even though remarkably complex configurations may be accommodated using the overset grid approach, generation of complex structured-mesh systems can require months to set up. As a result, many rotorcraft simulations using structured-grid CFD neglect the fuselage. On the other hand, unstructured-mesh solvers are easily able to handle complex geometries, but suffer from slower execution speed. However, advances in both computer hardware and CFD algorithms have made previously state-of-the-art computations routine for unstructured-mesh solvers, so that rotorcraft simulations using unstructured grids are now viable. The aim of the present work is to develop a first principles rotorcraft simulation tool based on an unstructured CFD solver.

Biedron, Robert T.↗

On the calculation of supersonic, separating, and reattaching flows

A method is developed for solving the laminar and turbulent compressible boundary-layer equations for separating and reattaching flows. Results of this method are compared with experimental data for two laminar and three turbulent boundary-layer, shock-wave interactions. Several Navier-Stokes solutions were obtained for each of the laminar boundary-layer, shock-wave interactions considered. Comparison of these solutions indicates a first-order sensitivity in C sub f to the computational mesh selected in both the viscous and inviscid portions of the flow.

Murphy, J. D.↗

Application of a numerical orthogonal coordinate generator to axisymmetric blunt bodies

An application of a simple numerical technique which allows for the rapid construction of orthogonal coordinate systems about axisymmetric blunt bodies is presented. This technique can generate orthogonal meshes which have unequally spaced points in two directions. Relations are given for the numerical generation of the metric coefficients. Body shapes ranging from simple analytical bodies to complex reverse curvature bodies are presented together with their orthogonal coordinate systems. The relatively good accuracy of the technique is shown in tabular data describing coordinate line slopes and metric coefficients. The predictor-corrector numerical method used to generate these results is both simple in concept and easy to program, so that the application of the technique should be broader than the results presented.

Graves, R. A., Jr.↗

Multichannel demultiplexer-demodulator

One of the critical satellite technologies in a meshed VSAT (very small aperture terminal) satellite communication networks utilizing FDMA (frequency division multiple access) uplinks is a multichannel demultiplexer/demodulator (MCDD). TRW Electronic Systems Group developed a proof-of-concept (POC) MCDD using advanced digital technologies. This POC model demonstrates the capability of demultiplexing and demodulating multiple low to medium data rate FDMA uplinks with potential for expansion to demultiplexing and demodulating hundreds to thousands of narrowband uplinks. The TRW approach uses baseband sampling followed by successive wideband and narrowband channelizers with each channelizer feeding into a multirate, time-shared demodulator. A full-scale MCDD would consist of an 8 bit A/D sampling at 92.16 MHz, four wideband channelizers capable of demultiplexing eight wideband channels, thirty-two narrowband channelizers capable of demultiplexing one wideband signal into 32 narrowband channels, and thirty-two multirate demodulators. The POC model consists of an 8 bit A/D sampling at 23.04 MHz, one wideband channelizer, 16 narrowband channelizers, and three multirate demodulators. The implementation loss of the wideband and narrowband channels is 0.3dB and 0.75dB at 10(exp -7) E(sub b)/N(sub o) respectively.

Courtois, Hector↗

Design of the SLAC RCE Platform: A General Purpose ATCA Based Data Acquisition System

The SLAC RCE platform is a general purpose clustered data acquisition system implemented on a custom ATCA compliant blade, called the Cluster On Board (COB). The core of the system is the Reconfigurable Cluster Element (RCE), which is a system-on-chip design based upon the Xilinx Zynq family of FPGAs, mounted on custom COB daughter-boards. The Zynq architecture couples a dual core ARM Cortex A9 based processor with a high performance 28nm FPGA. The RCE has 12 external general purpose bi-directional high speed links, each supporting serial rates of up to 12Gbps. 8 RCE nodes are included on a COB, each with a 10Gbps connection to an on-board 24-port Ethernet switch integrated circuit. The COB is designed to be used with a standard full-mesh ATCA backplane allowing multiple RCE nodes to be tightly interconnected with minimal interconnect latency. Multiple shelves can be clustered using the front panel 10-gbps connections. The COB also supports local and inter-blade timing and trigger distribution. An experiment specific Rear Transition Module adapts the 96 high speed serial links to specific experiments and allows an experiment-specific timing and busy feedback connection. This coupling of processors with a high performance FPGA fabric in a low latency, multiple node cluster allows high speed data processing that can be easily adapted to any physics experiment. RTEMS and Linux are both ported to the module. The RCE has been used or is the baseline for several current and proposed experiments (LCLS, HPS, LSST, ATLAS-CSC, LBNE, DarkSide, ILC-SiD, etc).

43 PARTICLE ACCELERATORS↗

A hybrid incremental projection method for thermal-hydraulics applications

In this paper, a new second-order accurate, hybrid, incremental projection method for time-dependent incompressible viscous flow is introduced in this paper. The hybrid finite-element/finite-volume discretization circumvents the well-known Ladyzhenskaya–Babuška–Brezzi conditions for stability, and does not require special treatment to filter pressure modes by either Rhie–Chow interpolation or by using a Petrov–Galerkin finite element formulation. The use of a co-velocity with a high-resolution advection method and a linearly consistent edge-based treatment of viscous/diffusive terms yields a robust algorithm for a broad spectrum of incompressible flows. The high-resolution advection method is shown to deliver second-order spatial convergence on mixed element topology meshes, and the implicit advective treatment significantly increases the stable time-step size. The algorithm is robust and extensible, permitting the incorporation of features such as porous media flow, RANS and LES turbulence models, and semi-/fully-implicit time stepping. A series of verification and validation problems are used to illustrate the convergence properties of the algorithm. The temporal stability properties are demonstrated on a range of problems with 2 ≤ CFL ≤ 100. The new flow solver is built using the Hydra multiphysics toolkit. The Hydra toolkit is written in C++ and provides a rich suite of extensible and fully-parallel components that permit rapid application development, supports multiple discretization techniques, provides I/O interfaces, dynamic run-time load balancing and data migration, and interfaces to scalable popular linear solvers, e.g., in open-source packages such as HYPRE, PETSc, and Trilinos.

97 MATHEMATICS AND COMPUTING↗

Simple rANDom wALk simulation

SANDAL is a particle-mesh simulation mini-app. The simple simulated physics propagates a set of particles in a constant, 2D wind field with Gaussian turbulence. SANDAL demonstrates the feasibility of formulating a computational physics problem using an alternative, modern design. Specifically, it is implemented using relational tables and queries, rather than array-based data model. It also is implemented with functional language design and cloud deployment, Scala and Apache Spark, rather than Fortran and MPI+X.

Lo, Li-Ta↗