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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 487 records · Page 27
All sourcesNASA NTRSDOE OSTI
DOE OSTI2021

Charge Transport and Space-Charge Formation in Cd 1 - x Zn x Te 1 - y Se y Radiation Detectors

The electron- and hole-transport properties in cadmium zinc telluride selenide (CZTS) crystals are studied using a laser-induced transient-current technique with pulsed and dc bias. The internal electric field profile and velocity of surface recombination are determined by Monte Carlo simulations of electron and hole transient currents combined with a numerical solution of the drift-diffusion equation coupled with Poisson’s equation. Electron and hole drift mobilities of μe = 830 cm 2 /Vs and μh = 40 cm 2 /Vs, respectively, are determined. We also develop a simple technique for evaluating surface recombination directly from measured current waveforms without the need for numerical simulation. The good quality of the prepared detector at pulsed bias, with electron- and hole-mobility-lifetime products of (μτ)e = 1.9 × 10 -3 cm 2 /V and (μτ)h = 1.4 × 10 -4 cm 2 /V, respectively, are observed. The formation of a positive space charge, originating from hole injection combined with a recombination level, is found. We observe a significant position dependence of the lifetime of electrons and holes in dc bias due to hole injection. The experiment is successfully fitted by a simple model dominated by a single deep recombination level with an energy of E t =E C -0.73eV; concentration of 7.3 × 10 11 cm -3 ; and electron- and hole-capture cross sections of 3.5 × 10 -14 cm 2 and 6.5 × 10 -14 cm 2 , respectively.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2019

Perturbative transport modeling of cold-pulse dynamics in Alcator C-Mod Ohmic plasmas

Perturbative transport experiments in magnetically confined plasmas have shown, for more than 20 years, that the injection of cold pulses at the plasma edge can trigger the increase of core temperature. Predictive heat transport simulations with the trapped gyro Landau fluid (TGLF) quasilinear transport model demonstrate that the increase of core temperature in some regimes, and lack thereof in other regimes, can be explained by a change in dominant linear micro-instability in Alcator C-Mod. The effect of density and plasma current on the cold pulse are well captured by TGLF, including the relative change in position of the temperature flex point as current density changes. Linear stability analysis of simulated density and current scans reveals a competition between trapped electron and ion temperature gradient modes as the main driver of the core transient response. Here these results further demonstrate that cold-pulse propagation and associated phenomenology in the cases studied are well explained within the local transport paradigm, without resorting to non-local effects.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2019

Closed-loop simulation with Grad-Shafranov equilibrium evolution for plasma control system development

Plasma control design increasingly depends on fast simulations able to connect to operational plasma control system (PCS) software for iterative development. GSevolve is a nonlinear free-boundary simulation that evolves the Grad-Shafranov equilibrium including current and pressure profiles, and can connect to all versions of the DIII-D PCS operational on devices around the world. Its ability to simulate the evolution of current continuously from open to closed field lines enables GSevolve to simulate full-discharge control from breakdown through plasma termination. GSevolve is compliant with the Plasma Control System Simulation Platform (PCSSP), a Matlab/Simulink®-based environment that serves as the primary framework for development of the ITER Plasma Control System (PCS). The code employs a novel response function-updating scheme to achieve fast simulations. The plasma evolves linearly until a significant shape change triggers a nonlinear update of the response while enforcing a prescribed accuracy. Old responses are recalled if the plasma changes back to an old shape. The equilibrium is a function of a state vector containing axisymmetric conductor currents and parameters related to parallel and perpendicular currents, which evolves according to an efficient state space circuit formulation. Control design and validation results are presented for simulations of DIII-D and EAST, connected to their corresponding versions of the DIII-D PCS.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2022

Conservation of angular momentum in ultrafast spin dynamics

The total angular momentum of a closed system is a conserved quantity, which should remain constant in time for any excitation experiment once the pumping signal has been extinguished. Such conservation, however, is never satisfied in practice in any real-time first-principles description of the demagnetization process. Furthermore, there is growing experimental evidence that the same takes place in experiments. The missing angular momentum is usually associated to lattice vibrations, which are not measured experimentally and are never considered in real-time simulations. Here, in this study, we critically analyze the issue and conclude that current state-of-the-art simulations violate angular momentum conservation already at the electronic level of description. This shortcoming originates from an oversimplified description of the spin-orbit coupling, which includes atomic contributions but neglects completely that of itinerant electrons. We corroborate our findings with time-dependent simulations using model tight-binding Hamiltonians, and show that indeed such conservation can be reintroduced by an appropriate choice of spin-orbit coupling. The consequences of our findings on recent experiments are also discussed.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2022

Pair production of charged IDM scalars at high energy CLIC

The Compact Linear Collider (CLIC) was proposed as the next energy-frontier infrastructure at CERN, to study e ^+ + e ^- − collisions at three centre-of-mass energy stages: 380,GeV, 1.5,TeV and 3,TeV. The main goal of its high-energy stages is to search for the new physics beyond the Standard Model (SM). The Inert Doublet Model (IDM) is one of the simplest SM extensions and introduces four new scalar particles: H ^\pm ± , A and H; the lightest, H, is stable and hence a natural dark matter (DM) candidate. A set of benchmark points is considered, which are consistent with current theoretical and experimental constraints and promise detectable signals at future colliders. Prospects for observing pair-production of the IDM scalars at CLIC were previously studied using signatures with two leptons in the final state. In the current study, discovery reach for the IDM charged scalar pair-production is considered for the semi-leptonic final state at the two high-energy CLIC stages. Full simulation analysis, based on the current CLIC detector model, is presented for five selected IDM scenarios. Results are then extended to the larger set of benchmarks using the Delphes fast simulation framework. The CLIC detector model for Delphes has been modified to take pile-up contribution from the beam-induced \gamma\gamma γ γ interactions into account, which is crucial for the presented analysis. Results of the study indicate that heavy, charged IDM scalars can be discovered at CLIC for most of the proposed benchmark scenarios, with very high statistical significance.

Klamka, Jan↗
DOE OSTI2025

Modeling the impact of extreme weather events and future climate on the radiologically contaminated sites of Enewetak Atoll

Enewetak Atoll underwent 43 historical nuclear tests from 1948 to 1958, including the first hydrogen bomb test, resulting in a substantial nuclear material fallout contaminating the Atoll and the lagoon waters. The radionuclide fallout material deposited in lagoon sediments and land soil will remain for decades to come. With intensifying climate and extreme weather events, the possibility of redistribution of deposited radionuclide material has become a great concern. This study uses a numerical modeling approach to estimate the potential elevated radionuclide concentrations that can be distributed during storm events under current and future climates. We simulated three historical storm scenarios that are most likely to impact Atoll’s environment and remobilize the radionuclide-bound sediments. WRF-ARW was used to reconstruct these storm scenarios under current year (2015) and future year (2090) climates. Storm-induced ocean hydrodynamics conditions were generated using FVCOM. FVCOM-ICM was externally coupled to simulate the fate and transport of radionuclides. Given that the 239 Pu is the largest inventory of the lagoon and Atoll islands, the model results show the highest average 239 Pu concentration that an island may be exposed to is 3.25E-4 Bq/m 3 (becquerel per cubic meters), which is an increase of 84 times the average baseline/existing 239 Pu concentration without the storm conditions. The overall increase in 239 Pu average over all the islands of Atoll is about 20 folds relative to the baseline concentration. Despite the high relative increase ratios, the significantly low activity concentrations may not pose an immediate exposure risk. However, due to the limitations of the study and uncertainties/biases in the historical data used, further research supported by field surveys to better characterize the current contamination level may be needed to make more accurate predictions.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2023

Evaluation of ITER divertor shunts as a synthetic diagnostic for detachment control

Reliable diagnostics that measure the detached state of the ITER divertor plasma will be necessary to control heat flux to the divertor targets during steady state, burning plasma operation. This paper conducts an initial exploration into the feasibility of the divertor shunt diagnostic as a lightweight, robust, and real-time detachment sensor. This diagnostic is a set of shunt lead pairs that measure the voltage drop along the divertor cassette body, from which the plasma scrape-off layer (SOL) current is calculated. Using SOLPS-ITER simulations for control-relevant ITER plasma scenarios, the thermoelectric current magnitude along the SOL is shown to decrease significantly with the onset of partial detachment at the outer divertor target. Electromagnetic modelling of a simplified divertor cassette is used to develop a control-oriented inductance-resistance circuit model, from which SOL currents can be calculated from shunt pair voltage measurements. The sensitivity and frequency-response of the resulting system indicates that the diagnostic will accurately measure SOL thermoelectric currents during ITER operation. These currents will be a good measure of the detached state of the divertor plasma, making the divertor shunt diagnostic a potentially extremely valuable and physically robust sensor for real-time detachment control.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2026

Closure models for the feedback of energetic particles on plasma turbulence

Energetic particles interact with the plasma surrounding them, resonating with certain types of plasma waves to stabilize them while destabilizing others, and changing the character of the background turbulence in ways that have not been fully quantified or understood. Interaction with the turbulent background plasma is key to the acceleration of many types of energetic particles including high-energy cosmic rays, solar energetic particles, and pick-up ions. The acceleration of particles is a process that would ideally be described by a kinetic model, a type of model that follows a probability distribution function (PDF) for all particles in 7-dimensional (x, y, z, v x , v y , v z , t) space. Because of the high dimensionality of a kinetic model, simulations that solve kinetic equations use the largest computational resources currently available, and are yet unable to simulate a realistic number of particles, reach the large scales necessary for astrophysical problems, and use high-precision numerical methods. Two available alternatives to kinetic plasma models have been explored for this problem, with limited success. One is a multi-fluid model produced by a cumulant discarding closure, which evolves coupled equations for the velocity, magnetic field, and internal energy for both the background plasma and the fluid of energetic particles. However, simulations that solve multi-fluid magnetohydrodynamic (MHD) equations are able to include the interaction with energetic particles only in crude ways, typically as an add-on pressure term. The second alternative is to use a hybrid method to couple a fluid description of the background plasma to a kinetic model or a Fokker–Planck model for the energetic particles. These methods are hampered by the physical modeling of the coupling. In this work, we develop a new model, which follows the PDF for all particles; this can be viewed as a step toward physical realism above a multi-fluid MHD model, while also being more computationally efficient than a kinetic model. The equations we develop model both the background plasma and the energetic particles self-consistently. Over the last decade, similar PDF methods have been developed to a high level of sophistication to model reactive flows and turbulent combustion for engineering applications. For treatment of the feedback of the energetic particles on a background plasma, a PDF closure approach should evaluate the mean characteristics, including the density, with better statistical quality than will particle-sampling procedures.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2026

Current-Driven Symmetry Breaking and Spin–Orbit Polarization in Chiral Wires

The spin dynamics of electrons in chiral molecular systems remains a topic of intense interest, particularly regarding whether geometric chirality inherently induces spin polarization in current-carrying electrons. In this work, we employ ab initio real-time time-dependent density functional theory (rt-TDDFT) to directly simulate the interplay among charge current, spin, and orbital. This realtime tracking extends beyond perturbative treatments, and we analyze how nonequilibrium currents effectively lift the symmetry constraints of screw rotation and time-reversal symmetry. We find that the emergence of spin and orbital angular momenta is dynamically correlated with a concomitant loss of translational (linear) momentum, which we interpret as an intrinsic consequence of current-driven symmetry lowering. The implications of this mechanism for chirality-induced spin selectivity and spintronics device design are discussed.

chiral wire↗
DOE OSTI2024

Simulating Z 2 lattice gauge theory on a quantum computer

The utility of quantum computers for simulating lattice gauge theories is currently limited by the noisiness of the physical hardware. Various quantum error mitigation strategies exist to reduce the statistical and systematic uncertainties in quantum simulations via improved algorithms and analysis strategies. We perform quantum simulations of Z 2 gauge theory with matter to study the efficacy and interplay of different error mitigation methods: readout error mitigation, randomized compiling, rescaling, and dynamical decoupling. We compute Minkowski correlation functions in this confining gauge theory and extract the mass of the lightest spin-1 state from fits to their time dependence. Quantum error mitigation extends the range of times over which our correlation function calculations are accurate by a factor of 6 and is therefore essential for obtaining reliable masses.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2025

The ePIC Simulation Campaign Workflow on the Open Science Grid

The ePIC collaboration is realizing the first experiment of the future Electron-Ion Collider (EIC) at the Brookhaven National Laboratory that will allow for a precision study of the nucleons and the nucleus at the scale of sea quarks and gluons through the study of electron-proton/ion collisions. This paper will discuss the current workflow for running centralized simulation campaigns for ePIC on the Open Science Grid (OSG) infrastructure. This involves monthly releases of ePIC software and container deployments to CVMFS, generation of input datasets in HepMC format according to collaboration-defined policy, using Snakemake in CI/CD for validation and benchmarking, and submitting jobs to the OSG condor scheduler for opportunistic running on available resources. File transfers utilize XrootD, and Rucio is used for data management. The workflow is continuously refined to improve daily throughput (currently 50-100k core hours per day) and minimize job failures. Since May 2023, monthly simulation campaigns employing the workflow have cumulatively used over 20 million core hours on the OSG and produced over 350 TB of simulation data. The campaigns incorporate simulations for the broad science program of the EIC and are actively used for the detector and physics studies in preparation of the Technical Design Report (TDR).

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2025

Simulation of a High-Confinement Tidal Energy Array (Abstract)

When the projected area of a current turbine array occupies a substantial fraction of a tidal or river channel cross-sectional area, the confinement associated with the channel boundaries substantially increases turbine efficiency. This effect can be exploited to substantially reduce the levelized cost of energy for current turbine arrays. However, the presence of such an array will affect inflow velocity, water depth, and circulation in the surrounding area. This has implications for array performance and environmental impacts. This project combines existing numerical modeling capability from PNNL with an understanding of confined array performance from UW. The work will 1) Simulate tidal currents and water surface elevation in a regional circulation model that includes the Knik Arm site at appropriate resolution; 2) Incorporate a varying thrust coefficient into this model that reflects the outcomes of tidal hydrodynamic simulations of confined turbine arrays; 3) Use the model to determine the effects of array operation on water levels and inflow conditions as a function of different blockage ratios and control strategies; and 4) Identify the “far field” environmental implications of operating an array of this type. UW will use the outputs from this model to evaluate the implications of “feedback effects” and variable inflow conditions on levelized cost of energy estimates for a confinement exploiting array of cross-flow turbines.

16 TIDAL AND WAVE POWER↗
DOE OSTI2022

Velocity-dependent annihilation radiation from dark matter subhalos in cosmological simulations

Here, we use the suite of Milky Way-like galaxies in the Auriga simulations to determine the contribution to annihilation radiation from dark matter subhalos in three velocity-dependent dark matter annihilation models: Sommerfeld, p-wave, and d-wave models. We compare these to the corresponding distribution in the velocity-independent s-wave annihilation model. For both the hydrodynamical and dark-matter-only simulations, only in the case of the Sommerfeld-enhanced annihilation does the total annihilation flux from subhalos exceed the total annihilation flux from the smooth halo component within the virial radius of the halo. Progressing from Sommerfeld to the s, p, and d-wave models, the contribution from the smooth component of the halo becomes more dominant, implying that for the p-wave and d-wave models the smooth component is by far the dominant contribution to the radiation. Comparing to the Galactic center excess observed by Fermi-LAT, for all simulated halos the emission is dominated by the smooth halo contribution. However, it is possible that for Sommerfeld models, extrapolation down to mass scales below the current resolution limit of the simulation would imply a non-negligible contribution to the gamma-ray emission from the Galactic Center region.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2019

Identification of Plasma Current Center by Neural Network Inference in EAST

For the efficient and safe operation of experimental advanced superconducting tokamak (EAST), it is necessary to accurately identify and control the plasma current and its central position. In this article, neural network is used to identify the position of the plasma current center. The model trained by the basic back-propagation neural network can well match the relationship between the electromagnetic diagnostic signals and plasma current center positions. Both noisy simulation data and experimental data are applied to train and test the neural network inference model. Adding 0.1% noise to the training data is proven to improve the noise immunity of the inference model. Basic neural networks trained with both noisy simulation data and actual experimental data show good results with sufficient inputs; however, in both cases, the performance degrades significantly when only the poloidal field coil currents are given as inputs. For this kind of time-series problem, the dynamic neural network containing delay and feedback architecture is introduced, and an improved model requiring much fewer inputs is trained and tested for current center inference. Furthermore, some parameters of this model are compared and analyzed in this article. With suitable neural network architecture, the mapping between the controlled variables (poloidal field coil currents) and response variables (plasma current center) can be well-established.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2023

Data-Driven Validation of NOvA's Convolutional Neural Network for Electron (Anti)Neutrino Selection

NOvA is a long-baseline neutrino oscillation experiment, designed to make measurements of several oscillation parameters using muon neutrino disappearance and electron neutrino appearance. It consists of two functionally equivalent detectors and utilizes the Fermilab NuMI neutrino beam. NOvA uses a convolutional neural network for particle identification of electron neutrino events with a validation process that includes several data-driven techniques. These Muon Removed studies ensure that our classifier performs the same on data as it does on simulation. In particular, Muon Removed Electron-Added studies involve selecting muon neutrino charged current events from both data and simulation and replacing the muon with a simulated electron of similar energy. For Muon Removed Bremsstrahlung and Muon Removed Decay-in-Flight studies, we remove muonic hits from cosmic muons that have either experienced Bremsstrahlung radiation or decayed in flight, producing samples of pure electromagnetic showers. Each of these electron neutrino-like samples are then evaluated by our classifier to obtain selection efficiencies. Our most recent analysis showed good agreement in the electron selection efficiency between data and simulation using these techniques. Furthermore, these cross-checks can be extended to corrections to our predicted electron neutrino signal. The impact of one such set of corrections on the overall analysis results were also evaluated in thesis.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗
DOE OSTI2022

An improved pressure drop correlation for modeling localized effects in a pebble bed reactor

Advances in the development of pebble bed reactors (PBRs) has created a desire for accurate and cost-effective simulation tools for design scoping studies and safety analysis. The current state-of-the-art for these simulations is the use of porous media models, although these models rely on correlations to capture the effects of flow features that are not explicitly modeled. One of the areas where correlation accuracy is currently lacking is in the near-wall region of the bed. In this region, the presence of the wall causes the pebbles to pack more orderly, drastically changing the geometry and flow behavior in this region. This work presents a new generalized pressure drop correlation for PBRs based on the KTA equation. A high-to-low methodology is applied, where large eddy simulation (LES) is performed on two beds of 1568 and 1700 pebbles to generate a high-fidelity dataset. The flow fields are then averaged in time and separated into concentric rings of 0.05 D peb width. Average porosity, velocity, and pressure drop are extracted for each ring and the friction and form losses are calculated. The Reynolds number range for this study is 625–10,000, and thus the form losses are dominant over the friction losses. The form losses across the rings are investigated, and a correction term for the form loss calculation is determined and applied to the KTA equation to drastically improve the capability of modeling localized porosity effects in a porous media code. Finally, the improved correlation reduces near-wall velocity prediction error from over 50% with the KTA correlation to around 5%. Agreement in pressure drop prediction between LES and porous media simulations is also improved.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗
DOE OSTI2025

Packaging a 650V/400A GaN Half-bridge Power Module with Ultra-low Parasitics for Electric Vehicle Drive Applications

This paper proposes a compact and efficient half-bridge power module with three 650 V / 150 A GaN dies in parallel. The power module incorporates a main power printed circuit board (PCB), an interface PCB, and a flex PCB to achieve low parasitics in both power loop and gate-side connection, resolving the issue of high parasitics typically encountered with wire bonding in high-current applications. Additionally, the interface PCB decouples the design constraints between the power loop and the gate loops. The proposed design is optimized with a vertical loop configuration to reduce power loop inductance through magnetic flux cancellation. Finite element analysis indicates that the power loop inductance is 0.58 nH at 100 MHz, while the maximum die junction temperature reaches 131 °C under an ambient temperature of 65 °C and a load current of 385 A. The proposed multi-piece PCB structure reduces the inductance of the drive circuit to minimize EMI and to mitigate false triggering. At the same time, it reduces impedance mismatches across different driver circuits, thereby achieving dynamic current sharing in multi-chip parallel configurations. Under simulation conditions of 400 V / 385 A, the current imbalance among chips was limited to 5 A. A 400 V / 385 A double-pulse test was conducted to experimentally validate the performance of the proposed power module.

30 DIRECT ENERGY CONVERSION↗
DOE OSTI2023

WEC-GRID

WEC-GRID is an open-source Python library crafted to simulate the integration of Wave Energy Converters (WECs) and Current Energy Converters (CECs) into renowned power grid simulators like PSS®E & PyPSA.

Barajas-Ritchie, Alexander↗