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Global Irrigation Characteristics and Effects Simulated by Fully Coupled Land Surface, River, and Water Management Models in E3SM
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Electromagnetic analysis of the plasma chamber of an ECR-based charge breeder
The optimization of the efficiency of an ECR-based charge breeder is a twofold task: efforts must be paid to maximize the capture of the injected 1+ ions by the confined plasma and to produce high charge states to allow post-acceleration at high energies. Both tasks must be faced by studying in detail the electrons heating dynamics, influenced by the microwave-to-plasma coupling mechanism. Numerical simulations are a powerful tools for obtaining quantitative information about the wave-to-plasma interaction process: this paper presents a numerical study of the microwaves propagation and absorption inside the plasma chamber of the PHOENIX charge breeder, which the selective production of exotic species project, under construction at Legnaro National Laboratories, will adopt as charge breeder. Calculations were carried out with a commercial 3D FEM solver: first, all the resonant frequencies were determined by considering a simplified plasma chamber; then, the realistic geometry was taken into account, including a cold plasma model of increasing complexity. The results gave important information about the power absorption and losses and will allow the improvement of the plasma model to be used in a refined step of calculation reproducing the breeding process itself.
Coupling 1D xRAGE simulations with machine learning for graded inner shell design optimization in double shell capsules
Advances in machine learning provide the ability to leverage data from expensive simulations of high-energy-density experiments to significantly cut down on computational time and costs associated with the search for optimal target designs. This study presents an application of cutting-edge Bayesian optimization methods to the one-dimensional (1D) design optimization of double shell graded layer targets for inertial confinement fusion experiments. This investigation attempts to reduce hydrodynamic instabilities while retaining high yields for future NIF experiments. Machine learning methods can use predictive physics simulations to identify graded layer designs from within the vast design space that demonstrate high predicted performance, including novel designs with high uncertainty in performance that may hold unexpected promise. By applying machine learning tools to the simulation design, we map the trade-off between 1D yield and instability, specifically isolating parameter ranges, which maintain high performance while showing significantly improved Rayleigh–Taylor stability over the point design. Furthermore, the groundwork laid in this study will be a useful design tool for future NIF experiments with graded layer targets.
Neutral gas pressure dependence of ion–ion mutual neutralization rate constants using Landau–Zener theory coupled with trajectory simulations
In this computational study, we describe a self-consistent trajectory simulation approach to capture the effect of neutral gas pressure on ion–ion mutual neutralization (MN) reactions. The electron transfer probability estimated using Landau–Zener (LZ) transition state theory is incorporated into classical trajectory simulations to elicit predictions of MN cross sections in vacuum and rate constants at finite neutral gas pressures. Electronic structure calculations with multireference configuration interaction and large correlation consistent basis sets are used to derive inputs to the LZ theory. The key advance of our trajectory simulation approach is the inclusion of the effect of ion-neutral interactions on MN using a Langevin representation of the effect of background gas on ion transport. For H + – H – and Li + – H(D) – , our approach quantitatively agrees with measured speed-dependent cross sections for up to ~10 5 m/s. For the ion pair Ne + – Cl – , our predictions of the MN rate constant at ~1 Torr are a factor of ~2 to 3 higher than the experimentally measured value. Similarly, for Xe + – F – in the pressure range of ~20 000–80 000 Pa, our predictions of the MN rate constant are ~20% lower but are in excellent qualitative agreement with experimental data. Here, the paradigm of using trajectory simulations to self-consistently capture the effect of gas pressure on MN reactions advanced here provides avenues for the inclusion of additional nonclassical effects in future work.
Reconstruction and interpretation of ionization asymmetry in magnetic confinement via synthetic diagnostics
Abstract Strong poloidal refueling asymmetry in the DIII-D tokamak is inferred from line radiation measurements. Synthetic diagnostics in neutral transport modeling coupled to gyrokinetic simulations illuminate implications for the plasma flow profile in the scrape-off layer of single-null beam-driven discharges. Recycling occurs primarily either on the inner or outer divertor legs, depending on the toroidal magnetic field direction. By reversing the toroidal magnetic field, the observed line radiation asymmetry is nearly eliminated or reversed. It is determined that, while relatively simple physics can describe the observed ionization asymmetry, predicting the overall brightness of the hydrogenic Lyman- α signal requires detailed simulation of the plasma and resulting turbulence. To this end, kinetic plasma simulations fully coupled to comprehensive neutral transport calculations—a novel capability—provide first-principles reproduction of Lyman- α observations on DIII-D.
Sensitivity analysis in coupled radiation transport simulations.
Abstract not provided.
Phenomena-based Uncertainty Quantification in Predictive Coupled- Physics Reactor Simulations
This project has sought to develop methodologies, tailored to phenomena that govern nuclearreactor behavior, to produce predictions (including uncertainties) for quantities of interest (QOIs) in the simulation of steady-state and transient reactor behavior. Examples of such predictions include, for each QOI, an expected value as well as a distribution around this value and an assessment of how much of the distribution stems from each major source of uncertainty. The project has sought to test its methodologies by comparing against measured experimental outcomes. The main experimental platform has been a 1-MW TRIGA reactor. This is a flexible platform for a wide range of experiments, including steady state with and without temperature feedback, slow transients with and without feedback, and rapid transients with strong feedback. The original plan was for the primary experimental data to come from in-core neutron detectors. We made considerable progress toward this goal but did not get as far along as we had planned. We have designed, developed, installed, and tested vertical guide tubes, each able to accept a detector or stack of detectors that can be moved axially inside the tube, and we have tested several new detector designs. One of these shows considerable promise.
A Coupled Experimental and Simulation Approach to Investigate the Impact of Grain Growth, Amorphization, and Grain Subdivision in Accident Tolerant U 3 Si 2 Light Water Reactor Fuel
Triuranium disilicide (U 3 Si 2 ) is being considered as an alternative accident tolerant fuel (ATF) due to its higher thermal conductivity. However, there is uncertainty in its use due to a lack of irradiation data at light water reactor (LWR) conditions. In this project, we used an integrated experimental and simulation approach to answer two significant questions pertaining to U 3 Si 2 that were not investigated by the Fuel Cycle Research and Development (FCRD) and Nuclear Energy Advanced Modeling and Simulation (NEAMS) programs: (1) Will grain growth in the hotter portions of the fuel significantly impact U 3 Si 2 LWR fuel behavior? (2) Under what conditions do grain subdivision and amorphization occur in U 3 Si 2 and will either occur at LWR conditions? Our approach to answer these questions used in situ ion irradiation and annealing to investigate grain growth, grain subdivision, and amorphization, along with mesoscale simulations using the MARMOT tool. We found that while the grain boundary mobility of U 3 Si 2 is larger than that of UO 2 , grain growth in U 3 Si 2 fuel pellets will be less than in UO 2 and may be neglected due to the lower thermal conductivity and thus lower centerline temperature. We also found that amorphization will not occur in U 3 Si 2 above 600 K, such that it is not likely to occur at typical LWR operating conditions. Grain subdivision will occur at LWR conditions and will likely occur at lower burnups than in UO 2 .
Sensitivity Analysis in Coupled Radiation Transport Simulations.
Abstract not provided.
3D PIC-DSMC Simulation of Strongly Coupled Cathode Spot Plasma Dynamics during Vacuum Arc Initiation: A Cautionary Tale
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Data set of fully kinetic simulations of capacitively coupled plasma discharges in argon for development of surrogate models
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Role of the Indian Ocean salinity in monsoon and ENSO variability as simulated by a coupled ocean-atmosphere system
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Consistency of 20th century sea level pressure trends as simulated by a coupled and uncoupled GCM
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Coupled Fluid Structure Simulations of the Captive Carriage Environment.
Abstract not provided.
Effective mass theory simulations of exchange coupled donors in silicon.
Abstract not provided.
Full configuration interaction simulations of exchange coupled donors in silicon in an effective mass theory framework.
Abstract not provided.