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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 433 records · Page 24

Numerical simulation of terahertz radiation by laser-driven plasma dipole oscillation

Laser-plasma interactions have many theoretical and technological applications. One is the use of coherently accelerated electrons to provide novel sources of THz radiation. Our research focuses on simulating the cross/self-interactions between two high intensity, ultra-short, counter propagating and detuned laser pulses and an initial neutral target for controlled ionization. Unlike our previous studies of laser-matter interaction over preformed plasma, we explore the injection and collision of laser pulses to induce background plasma driven by the self-guided laser wakefield mechanism, which is then used to perturb the plasma resulting in induced dipole oscillations leading to transverse radiation. Inducing a cylindrical spatial plasma column within the laser beam radius regime provides a stable, spatially localized plasma channel. The emitted radiation from the plasma dipole oscillation (PDO) will not be affected by surrounding plasma absorption, resulting in effective radiation distribution. Finally, results include 3D EM-PIC simulations and a comparison of the self- ionizing plasma against the preformed plasma to assess the efficiency of the mechanisms.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Emu v1.1

Emu is a particle-in-cell code for solving the neutrino quantum kinetic equations in 1, 2, or 3 spatial dimensions with arbitrary angular resolution in order to simulate neutrino flavor transformation in neutron star merger and core collapse supernova environments. Emu represents the neutrino distribution function as a set of particles, each of which represent a collection of neutrinos and antineutrinos with unique position and momentum. Each particle carries two density matrices to define the flavor state of the neutrinos and antineutrinos it represents. Emu includes the vacuum, matter, and neutrino self-interaction potentials. Emu calculates the self-interaction potential using PIC deposition and interpolation algorithms that efficiently compute the local number density and flux at particle locations. Emu is implemented in C++ and is based on the AMReX library for high-performance, block-structured adaptive mesh refinement. Emu is parallelized with MPI + OpenMP for CPUs and MPI + CUDA for GPUs.

Willcox, Donald↗

VPIC-Kokkos

VPIC is a particle-in-cell (PIC) code that solves the Maxwell-Boltzmann system of equations and can be used to simulate a wide variety of plasmas, including those that are fully kinetic and relativistic. Utilizing the Kokkos performance-portable framework, VPIC achieves high performance on multiple CPU and GPU architectures and is adaptable to future platforms with minimal developer effort. VPIC features very powerful input decks, allowing insertion of arbitrary C++ code for custom diagnostics, boundary conditions, and additional physics models.

Luedtke, Scott↗

HELIX

HELIX — Hybrid Envelope-multiparticle LInac eXplorer: TraceWin-compatible linac simulation with 3-D PIC space charge, matching, a PyQt6 workbench, and a voice-driven AI copilot. Built at Fermilab for PIP-II.

Pathak, Abhishek [Fermi National Accelerator Labor↗

Enabling particle applications for exascale computing platforms

The Exascale Computing Project (ECP) is invested in co-design to assure that key applications are ready for exascale computing. Within ECP, the Co-design Center for Particle Applications (CoPA) is addressing challenges faced by particle-based applications across four “sub-motifs”: short-range particle–particle interactions (e.g., those which often dominate molecular dynamics (MD) and smoothed particle hydrodynamics (SPH) methods), long-range particle–particle interactions (e.g., electrostatic MD and gravitational N-body), particle-in-cell (PIC) methods, and linear-scaling electronic structure and quantum molecular dynamics (QMD) algorithms. Our crosscutting co-designed technologies fall into two categories: proxy applications (or “apps”) and libraries. Proxy apps are vehicles used to evaluate the viability of incorporating various types of algorithms, data structures, and architecture-specific optimizations and the associated trade-offs; examples include ExaMiniMD, CabanaMD, CabanaPIC, and ExaSP2. Libraries are modular instantiations that multiple applications can utilize or be built upon; CoPA has developed the Cabana particle library, PROGRESS/BML libraries for QMD, and the SWFFT and fftMPI parallel FFT libraries. Success is measured by identifiable “lessons learned” that are translated either directly into parent production application codes or into libraries, with demonstrated performance and/or productivity improvement. The libraries and their use in CoPA’s ECP application partner codes are also addressed.

97 MATHEMATICS AND COMPUTING↗

Cryogenic C-band wavelength division multiplexing system using an AIM Photonics Foundry process design kit

Cryogenic environments make superconducting computing possible by reducing thermal noise, electrical resistance and heat dissipation. Heat generated by the electronics and thermal conductivity of electrical transmission lines to the outside world constitute two main sources of thermal load in such systems. As a result, higher data rates require additional transmission lines which come at an increasingly higher cooling power cost. Hybrid or monolithic integration of silicon photonics with the electronics can be the key to higher data rates and lower power costs in these systems. We present a 4-channel wavelength division multiplexing photonic integrated circuit (PIC) built from modulators in the AIM Photonics process development kit (PDK) that operate at 25 Gbps at room temperature and 10 Gbps at 40 K. We further demonstrate 2-channel operation for 20 Gbps aggregate data rate at 40 K using two different modulators/wavelengths, with the potential for higher aggregate bit rates by utilizing additional channels.

42 ENGINEERING↗

Optimization of a cyclone using MFIX and Nodeworks

Video depicting the optimization process of a cyclone on NETL's chemical looping reactor (CLR) using MFIX and Nodeworks. MFIX is used to model the cyclone using PIC. Nodeworks is then used to generate proposed geometry changes using a Latin hypercube. Each design is simulated, with an objective value being computed based on the cyclone efficiency and pressure drop. A Gaussian Process surrogate model is then constructed from the objective values. This surrogate model is then used by a differential evolution optimization algorithm to identify the optimal cyclone design. Details published here: Weber, J., Fullmer, W., Gel, A., and Musser, J. (February 4, 2020). "Optimization of a Cyclone Using Multiphase Flow Computational Fluid Dynamics." ASME. J. Fluids Eng. March 2020; 142(3): 031111. https://doi.org/10.1115/1.4045952 OSTI: https://www.osti.gov/pages/servlets/purl/1763893

cyclone↗

Using a particle-in-cell model for accelerator control room applications

Many accelerator control rooms rely on envelope models to simulate beam dynamics because they are fast and accurate at tracking the beam core. Particle-in-Cell (PIC) models, however, can track particles inside and outside the core and, with the improvements of computers, are now fast enough to be used in control rooms. The Spallation Neutron Source (SNS) at Oak Ridge National Laboratory is currently developing a tool to use a Particle-in-Cell model for control room applications. This report covers the progress so far and the future goals of using PyORBIT, a Particle-in-Cell simulation model, in the SNS control room.

Cathey, Brandon↗

Theoretical Review of the MFIX Fluid and Two-Fluid Models

MFIX (Multiphase Flow with Interphase eXchanges) is a general purpose code that can be used for describing the hydrodynamics, chemical reactions, and heat transfer of dense or dilute multiphase fluid flows. MFIX calculations give detailed information on pressure, temperature, composition, and velocity distributions in the defined system. This report provides an overview of MFIX’s expressions for single phase flow and continuous dispersed multiphase flow (i.e., the two-fluid model). In addition to the two fluid model (MFIX-TFM), MFIX contains a discrete element model (MFIX-DEM) and a multi-phase particle in cell model (MFIX-PIC) that are not reviewed within this document.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Spherical Aberrations - Final Focus and Solenoid Scans

Conclusions: Spherical aberrations in solenoids are unavoidable and problematic whenever the beam is focused; It may be possible to include a spherical aberration correction to the analysis of a solenoid scan in the manner described above although more accurate 2D PIC models should be studied to determine the accuracy of the very simple model used above. This correction would have to be iterated as the beam size in the solenoid is iterated; A quadrupole triplet final focus would not have aberrations (preliminary analysis shows improvement in spot size, very difficult to tune).

43 PARTICLE ACCELERATORS↗

Laser Plasma Interaction in the MG Magnetic Field (Final Report)

Strong magnetic fields change properties of plasma. Employment of the magnetic fields can improve conditions for inertial confinement fusion. Compression and heating of the magnetized plasma is a base of the MagLIF pulsed power approach to the controlled fusion. Study of expansion and heating of plasma in the external magnetic fields, development of plasma instabilities, parametric and other effects are important for basic physics and applications. The main goal of the research for the grant was experimental investigation of laser produced plasma in the well characterized and controlled MG magnetic fields. We developed a platform for investigation of high intensity laser-plasma interaction (LPI) in the MG fields using a university-scale pulsed power machine. A Zebra machine at UNR generated transverse magnetic fields of 3 MG on the surface of the rod load and longitudinal fields of 1.4 MG in the coil loads. The magnetic fields were characterized with two-color Faraday rotation diagnostics. The pulsed power machine provided almost static magnetic fields for LPI compared to the much faster laser driven magnetic fields. We found that eddy currents in the rising magnetic field generate plasma on the metal targets. Eddy currents did not impact Si and CH dielectric targets. A Leopard laser with intensity in the focus up to 10 19 W/cm 2 produced plasma in the MG magnetic fields. The modified reflected Faraday diagnostics was used to study laser driven B-field at the MTW laser at Laboratory for Laser Energetics, UR. We demonstrated a slow dependence of the magnetic field in the coil on the applied laser intensity. The magnetic field increased by a factor of 2 if laser intensity increased by a factor of 30. This scaling is important for comparison of experiments at different laser facilities. Expansion of the plasma in the 2-3 MG external B-field was studied. Laser-produced plasma in the azimuthal magnetic field took the unique form of a thin disc expanding radially with a velocity of 250 km/s and confined in the vertical direction. A HYDRA MHD program at the University of Rochester was applied for simulations of LPI in the magnetic field B >3 MG. Simulations for the plasma disc parameters and the expansion dynamics were in a good agreement with experiments. Generation of narrow dense plasma jets in the longitudinal magnetic field of 0.6-0.8 MG was studied. Narrow plasma jets reached a length of 3-4 mm with the electron plasma density of (0.2-1.2)x10 20 cm -3 . A jet tip propagated with the velocity of 160-200 km/s. MHD simulations showed a good agreement of the dynamics of the formation of plasma jets with experiments. These jets are relevant to astrophysical jets. Simulations of K-shell spectra of Si plasma was performed for LPI in the B-field. The laser prepulse generated plasma near the laser target. A PrismSPECT model with a MeV electron beam produced by the laser was used. The spectral modelling showed the increased plasma density by a factor by 2-3 in the magnetic field. This was in agreement with the observed dynamics of the plasma plume confined by the axial magnetic field. The two-plasmon decay was studied in the 2.5-3 MG transversal magnetic fields. Strong 2-3.5 nm spectral widening and a 2-4 nm shifts of “red” and “blue” 3/2ω 0 spectral components were observed. The large shift and widening exceed the expected temperature and magnetic shift. PIC simulations are performing to clarify physics of this effect. The experimental research program for the grant is completed. New plasma effects in the MG fields were studied at the university-scale pulsed power generator. Two graduate and two undergraduate UNR and UR students carried experiments at the Zebra generator, supported and developed plasma diagnostics, provided data processing, and performed MHD simulations of LPI in the strong magnetic field. Research results are published in 9 referred papers and presented in 12 conferences. Program manager: Kramer U. Akli; Collaborators: R. C. Mancini and H. Sawada, University of Nevada, Reno (UNR); R. Betti and A. V. Maximov, University of Rochester (UR).

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Summary of Assessments Performed in FY 20 by SNL QA POC for FY 19 SNL SFWD Milestone Deliverables

The Sandia National Laboratories (SNL) staff is meeting the requirements of the Nuclear Fuel Cycle and Supply Chain (NFCSC) Quality Assurance Program Document (QAPD)1. Each of the 46 SFWD FY 19 packages for SNL were reviewed. Six of the 46 packages had incorrect QRL categories, but technical reviews were always found to be appropriate. No major corrective actions are assigned, but recommendations have been made to adjust the identified QRL items. Additional and minor PICS:NE checkbox errors are recognized. Future training will be geared to ensure proper QRL categorizations and other check box entries in future cases

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

A Novel use of Direct Simulation Monte-Carlo to Model Dynamics of COVID-19 Pandemic Spread

In this report, we evaluate a novel method for modeling the spread of COVID-19 pandemic. In this new approach we leverage methods and algorithms developed for fully-kinetic plasma physics simulations using Particle-In-Cell (PIC) Direct Simulation Monte-Carlo (DSMC) models. This approach then leverages Sandia-unique simulation capabilities, and High-Performance Computer (HPC) resources and expertise in particle-particle interactions using stochastic processes. Our hypothesis is that this approach would provide a more efficient platform with assumptions based on physical data that would then enable the user to assess the impact of mitigation strategies and forecast different phases of infection. This work addresses key scientific questions related to the assumptions this new approach must make to model the interactions of people using algorithms typically used for modeling particle interactions in physics codes (kinetic plasma, gas dynamics). The model developed uses rational/physical inputs while also providing critical insight; the results could serve as inputs to, or alternatives for, existing models. The model work presented was developed over a four-week time frame, thus far showing promising results and many ways in which this model/approach could be improved. This work is aimed at providing a proof-of-concept for this new pandemic modeling approach, which could have an immediate impact on the COVID-19 pandemic modeling, while laying a basis to model future pandemic scenarios in a manner that is timely and efficient. Additionally, this new approach provides new visualization tools to help epidemiologists comprehend and articulate the spread of this and other pandemics as well as a more general tool to determine key parameters needed in order to better predict pandemic modeling in the future. In the report we describe our model for pandemic modeling, apply this model to COVID-19 data for New York City (NYC), assess model sensitivities to different inputs and parameters and , finally, propagate the model forward under different conditions to assess the effects of mitigation and associated timing. Finally, our approach will help understand the role of asymptomatic cases, and could be extended to elucidate the role of recovered individuals in the second round of the infection, which is currently being ignored.

59 BASIC BIOLOGICAL SCIENCES↗

Plasma Photonics for the Control of Kilojoule Lasers

The main goal of this project was to develop plasma photonic devices (plasma lenses or ellipsoidal plasma mirrors (EPMs)) for controlling the focus of high-energy (kJ-class) laser systems. In order to defocus a kJclass laser beam, a plasma optic must produce a very specific plasma density profile. For a plasma lens, this profile must be peaked on axis and fall off parabolicly with radius. We developed four plasma-lens target designs that were predicted to yield the ideal plasma profile required for defocusing kJ-class laser beams. Particle-in-cell (PIC) simulations using the code OSIRIS were used to explore the design. The resulting plasma lens must also be underdense, which sets an upper limit on the solid density of the plasma-lens targets to ~ 1 mg/cm 3 or less. This low of a density is highly challenging to fabricate.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Dense Pair and Gamma-Ray Creation Using Ultra-Intense Lasers (Final Technical Report)

Lasers with intensity >1.4x10 18 W.cm -2 irradiating solid targets couple 10-50% of its energy to “hot electrons” near the critical surface, with temperature kT > mc 2 . When these hot electrons impact high-Z target ions (e.g. Au, Pt), they emit copious bremsstrahlung gamma-rays and create e + e - pairs via the Trident process. For targets thicker than ~0.1mm, the gamma-rays create secondary pairs via the Bethe-Heitler processes. The concept of using lasers to create pairs was first studied by Shearer et al (1973). Motivated by the rapid advance of short-pulse ultra-intense lasers based on chirped-pulse amplification, Liang (1994) first proposed irradiating solid Au targets with laser intensity ≥10 20 W.cm -2 to create dense e + e - pairs. Using particle-in-cell (PIC, Birdsall and Langdon, 1991) simulations, Liang et al (1998, 2002) estimated that high-energy PW lasers can in principle achieve ultra-high in-situ pair densities. Subsequent studies supported this idea and found that for gold foils thicker than ~50 μm, the pair yield is dominated by the Bethe-Heitler (BH, Heitler 1954) process. Cowan et al (1999, 2000) using the LLNL Nova PW-laser to irradiate 125μm gold foils first observed pair creation, followed by Chen et al (2009) who demonstrated copious BH pair creation using the Titan, Omega-EP and Orion lasers. However, the emerging e + /e - ratio of these experiments was ≤ few %, and the pair density was only 10 13 /cc so that the pair jet transverse size R(~mm) was < pair skin depth c/ω + (=8πn+e 2 /m) 1/2 ). This was insufficient to qualify as a bona fide ”pair plasma”.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Initial conditions for simulations of beam physics in linear induction accelerators

Flash radiography of hydrodynamic experiments driven by high explosives is a well-known diagnostic technique in use at many laboratories. At Los Alamos, the DualAxis Radiographic Hydrodynamic Test (DARHT) facility two linear induction electron accelerators (LIAs) make the bremsstrahlung radiographic source spots for point projection radiographs from orthogonal views. A new LIA, called Scorpius, is presently under development to advance this technology. To better understand electron-beam physics in these LIAs, numerical simulations are frequently performed with the objective of improving the radiography. At Los Alamos we frequently use the TRAK ray-trace and LSP particle-in-cell (PIC) codes to simulate the injector, and the XTR and LAMDA envelope/centroid codes along with LSP to simulate transport of the accelerated beam through the LIAs. The LIA simulations need the injected beam parameters as initial conditions for calculating beam transport and stability. The determination of these initial conditions is the topic of this note.

43 PARTICLE ACCELERATORS↗

Cathode to Target Simulations for Scorpius: I. Simulation Codes and Models

The new Scorpius linear induction electron accelerator is under development for multi-pulse flash radiography of large, explosively-driven hydrodynamic experiments. Beam physics from the cathode to the target was examined with computer simulations, including envelope, ray-trace, and particle-in cell (PIC) codes. Beam instabilities investigated included beam breakup (BBU), image displacement, diocotron, parametric envelope, ion hose, and the resistive wall instability. Beam corkscrew motion and emittance growth from beam mismatch were also studied. The results of these simulations is documented in a series of reports. In this report the computer codes and physical models used for these simulations are described. The conclusion of this study is that Scorpius will produce and accelerate a beam with radiographic quality equivalent to the present accelerators at Los Alamos National Laboratory if the same engineering standards and construction details are upheld.

43 PARTICLE ACCELERATORS↗

Simulating Boundary Region Plasma Instabilities

The boundary regions of low-temperature plasmas are known to be susceptible to kinetic instabilities, which can affect the energies and fluxes of particles directed at the material boundary. For example, both the ion acoustic instability as well as an instability near the electron plasma frequency have been observed. Particle-in-cell (PIC) simulation is a tool that, alongside experiments, can capture the effects these instabilities have on the particle distribution functions. Ultimately, simulations can determine under what conditions these effects are significant by comparing to theoretical predictions and explore conditions unamenable to experiments.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗