Fast three-dimensional rules-based simulation of thermal-sprayed microstructures
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36 MATERIALS SCIENCE↗
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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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Numerical thermalization in 2D PIC simulations: Practical estimates for low-temperature plasma simulations
The process of numerical thermalization in particle-in-cell (PIC) simulations has been studied extensively. It is analogous to Coulomb collisions in real plasmas, causing particle velocity distributions (VDFs) to evolve toward a Maxwellian as macroparticles experience polarization drag and resonantly interact with the fluctuation spectrum. This paper presents a practical tutorial on the effects of numerical thermalization in 2D PIC applications. Scenarios of interest include simulations, which must be run for many thousands of plasma periods and contain a population of cold electrons that leave the simulation space very slowly. This is particularly relevant to many low-temperature plasma discharges and materials processing applications. We present numerical drag and diffusion coefficients and their associated timescales for a variety of grid resolutions, discussing the circumstances under which the electron VDF is modified by numerical thermalization. Though the effects described here have been known for many decades, direct comparison of analytically derived, velocity-dependent numerical relaxation timescales to those of other relevant processes has not often been applied in practice due to complications that arise in calculating thermalization rates in 1D simulations. Using these comparisons, we estimate the impact of numerical thermalization in several examples of low-temperature plasma applications including capacitively coupled plasma discharges, inductively coupled plasma discharges, beam plasmas, and hollow cathode discharges. Finally, we discuss possible strategies for mitigating numerical relaxation effects in 2D PIC simulations.
70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
NPP Simulators for Coupled Thermal and Electric Power Dispatch
The Light Water Reactor Sustainability (LWRS) program within the United States Department of Energy supports extending the operation of the U.S. commercial nuclear power plant (NPP) fleet. Within the LWRS program, the Flexible Plant Operation and Generation (FPOG) Pathway works to diversify the revenue streams of light water reactors (LWRs) by opening opportunities for the co-generation of non-electric products in addition to supplying electrical power to the grid. Recent events have added greater motivation to these efforts. For example, the recent Inflation Reduction Act (IRA) passed by the U.S. federal government offers substantial tax incentives for producing clean hydrogen, the technology readiness level of dispatchable and high-efficiency hydrogen production has dramatically increased in a short time, and societal response to world climate change is driving a transition away from fossil fuels. Producing hydrogen with maximum efficiency using nuclear power requires dispatching both electrical and thermal power from the nuclear plant to the hydrogen plant, so testing concepts of operations for combined electrical and thermal power dispatch (TPD) from an NNP to a hydrogen plant is of interest. This report documents achievement of the Light Water Reactor Sustainability (LWRS) program milestone “Install and demonstrate a vendor-developed simulator on the Human Systems Simulation Laboratory (HSS) for dispatch of LWR electrical power to a close-coupled electrolysis plant” with a due date of Dec. 22, 2022. Several factors provide motivation for this effort. Coupling the power generation deck of a nuclear power plant to a hydrogen production facility introduces new possibilities for operational transients that must be addressed. In particular, the performance of the integrated system during startup and shutdown of the hydrogen production facility, as well as offnormal conditions, need to be evaluated to ensure there are no adverse effects on the operation of the existing NPP. The concept of operations involving the NPP, the hydrogen plant, and the electric power grid must be tested using NPP simulators and operating procedures that have been modified for TPD operations. These tests must also include dynamic simulations of the coupled tertiary thermal and electric loads as well as coordinated activities with NPP operators, tertiary load operators and grid power coordinators. The report summarizes progress in developing and testing full-scope NPP simulators at the HSSL, including a generic BWR simulator from GSE Systems, Inc. and generic PWR simulator from Westinghouse. In the case of the TPD-GBWR Simulator from GSE Systems, Inc., a BWR is thermally coupled to a high temperature electrolysis (HTE) plant that produces hydrogen and oxygen from de-ionized water. The hydrogen plant is not explicitly simulated but only included as a transient heat sink. A thermal power dispatch (TPD) system transfers heat between the steam systems at the BWR and the hydrogen plant. Operational results from two versions of the modified simulator are presented. The first version uses synthetic oil as a heat transfer fluid in a closed delivery heat loop (DHL) that generates steam at the hydrogen plant. The second version uses steam as the heat transfer fluid in a delivery steam line (DSL) to provide steam to the hydrogen plant. For both versions, the estimated thermal power delivery distance is approximately one kilometer. The amount of thermal power dispatched in the simulators is 15% of the total reactor thermal power such that the simulators provide a tool to study the feasibility of coupling a BWR to industrial processes that benefit from a combination electrical and thermal power dispatch. Ongoing work within a CRADA is also developing a full-scope PWR simulator provided by Westinghouse for both thermal and electric power coupling. This simulator is based on a PWR plant with two three-loop Westinghouse reactors. Westinghouse PWRs are sufficiently similar that a simulator of a three-loop reactor is an appropriate representation for two-loop and four-loop PWR reactors. The three-loop simulator will initially be modified for close-coupling to a 100 MW HTE hydrogen production plant that will require approximately 25 MW of thermal power while operating at its maximum rated capacity. The simulator testing will include full coupling to dynamic simulations of a hydrogen production plant and a representative bulk electric grid. The simulator provided by Westinghouse is similar to the GPWR simulator that INL has already obtained from GSE Systems but has a few important added benefits. First, the Westinghouse simulator is based on digital controls and has additional screens that can be called up to show parameter trends to assist operators in decision-making. The Westinghouse simulator also has upgrades to the controls and hardware representations, such as valve actuators, that make it more realistic and flexible in terms of accurately sim
99 GENERAL AND MISCELLANEOUS↗
A scalable framework for efficient coupling of thermal and microstructural simulations in additive manufacturing
Predicting microstructure evolution in metal additive manufacturing (AM) is important for process optimization, but spatiotemporal scale disparities between thermal transport and microstructure evolution create significant challenges for efficient data transfer between simulation codes. To address this, we present Stork, a scalable framework for coupling thermal and microstructural simulations. Stork uses a sparse data representation to identify and store active solidification sub-volumes, enabling highly parallel quad-linear interpolation from coarse thermal grids to fine microstructure grids without large intermediate storage. We demonstrate the framework by coupling the semi-analytic heat transfer code 3DThesis with the time-parallel cellular automata code Toucan. This approach achieves over two orders of magnitude reduction in data generation time and file size compared to prior workflows. Numerical studies show that quad-linear interpolation preserves grain morphology and crystallographic texture in laser powder bed fusion (LPBF) simulations for coarsening ratios up to 16. Overall, Stork provides a scalable pathway for high-throughput, component-scale AM simulations on modern high-performance computing systems.
36 MATERIALS SCIENCE↗
Early-stage Testing of Thermal Power Dispatch Simulator for Subjective Mental Workload and Evolution Time
The excess thermal energy produced by nuclear power plants (NPPs) during low electricity demands can be utilized in industrial processes, such as hydrogen production, through a thermal power dispatch (TPD) system. Initial testing of the first iteration of a single-train TPD design with a manual control mode at the Idaho National Lab (INL) revealed a high operator workload and degraded control capability. The current study evaluated the impact of an enhanced dual-train TPD design on operators’ subjective mental workload and evolution task-time while completing two operating scenarios in manual and automatic control modes. The results showed no statistically significant difference between participants’ mental workload using both control modes. Evolution time in automatic control mode took a shorter time than in manual control, with participants completing all evolutions in less than the 10-min set as the design specification limit. The shorter evolution time is discussed within the context of plant safety and operational efficiency.
Gideon, Olugbenga↗
The effect of solar simulator operating characteristics on spacecraft thermal tests
Solar simulator performance characteristics effects on spacecraft heat test
PERFORMANCE CHARACTERISTICS↗
Results of transient thermal modeling in a simulated space environment.
Steady state and transient full-scale, half-scale and quarter-scale thermal models in simulated space environment
TRANSIENT HEATING↗
Atomistic simulations of the thermal conductivity of liquids
We present a method based on sinusoidal approach to equilibrium molecular dynamics (SAEMD) to compute the thermal conductivity of liquids Similar to nonequilibrium molecular dynamics, and unlike equilibrium simulations based on the Green-Kubo formalism, the method only requires the calculation of forces and total energies. The evaluation of heat fluxes and energy densities is not necessary, thus offering the promise of efficiently implementing first principles simulations based on density functional theory or deep molecular dynamics. Our approach is a generalization of SAEMD for solids, where the thermal conductivity is computed in the steady state, instead of a transient regime, thus properly taking into account diffusive terms in the heat equation. We present results for liquid water at ambient conditions and under pressure and discuss simulation requirements to obtain converged values of the thermal conductivity as a function of size and simulation time.
36 MATERIALS SCIENCE↗
Thermal enclosure system functional simulation user's manual
A form and function simulation of the thermal enclosure system (TES) for a microgravity protein crystal growth experiment has been developed as part of an investigation of the benefits and limitations of intravehicular telerobotics to aid in microgravity science and production. A user can specify the time, temperature, and sample rate profile for a given experiment, and menu options and status are presented on an LCD display. This report describes the features and operational procedures for the functional simulation.
Morris, A. Terry↗
TERRA Battery Thermal Control Anomaly - Simulation and Corrective Actions
The TERRA spacecraft was launched in December 1999 from Vandenberg Air Force Base, becoming the flagship of NASA's Earth Observing System program to gather data on how the planet's processes create climate. Originally planned as a 5 year mission, it still provides valuable science data after nearly 10 years on orbit. On October 13th, 2009 at 16:23z following a routine inclination maneuver, TERRA experienced a battery cell failure and a simultaneous failure of several battery heater control circuits used to maintain cell temperatures and gradients within the battery. With several cells nearing the minimum survival temperature, preventing the electrolyte from freezing was the first priority. After several reset attempts and power cycling of the control electronics failed to reestablish control authority on the primary side of the controller, it was switched to the redundant side, but anomalous performance again prevented full heater control of the battery cells. As the investigation into the cause of the anomaly and corrective action continued, a battery thermal model was developed to be used in determining the control ability remaining and to simulate and assess corrective actions. Although no thermal model or detailed reference data of the battery was available, sufficient information was found to allow a simplified model to be constructed, correlated against pre-anomaly telemetry, and used to simulate the thermal behavior at several points after the anomaly. It was then used to simulate subsequent corrective actions to assess their impact on cell temperatures. This paper describes the rapid development of this thermal model, including correlation to flight data before and after the anomaly., along with a comparative assessment of the analysis results used to interpret the telemetry to determine the extent of damage to the thermal control hardware, with near-term corrective actions and long-term operations plan to overcome the anomaly.
Grob, Eric W.↗
Characterization of a Pressure-Fed LOX/LCH4 Reaction Control System Under Simulated Altitude and Thermal Vacuum Conditions
A liquid oxygen, liquid methane (LOX/LCH4) reaction control system (RCS) was tested at NASA Glenn Research Center's Plum Brook Station in the Spacecraft Propulsion Research Facility (B-2) under simulated altitude and thermal vacuum conditions. The RCS is a subsystem of the Integrated Cryogenic Propulsion Test Article (ICPTA) and was initially developed under Project Morpheus. Composed of two 28 lbf-thrust and two 7 lbf-thrust engines, the RCS is fed in parallel with the ICPTA main engine from four propellant tanks. 40 tests consisting of 1,010 individual thruster pulses were performed across 6 different test days. Major test objectives were focused on system dynamics, and included characterization of fluid transients, manifold priming, manifold thermal conditioning, thermodynamic vent system (TVS) performance, and main engine/RCS interaction. Peak surge pressures from valve opening and closing events were examined. It was determined that these events were impacted significantly by vapor cavity formation and collapse. In most cases the valve opening transient was more severe than the valve closing. Under thermal vacuum conditions it was shown that TVS operation is unnecessary to maintain liquid conditions at the thruster inlets. However, under higher heat leak environments the RCS can still be operated in a self-conditioning mode without overboard TVS venting, contingent upon the engines managing a range of potentially severe thermal transients. Lastly, during testing under cold thermal conditions the engines experienced significant ignition problems. Only after warming the thruster bodies with a gaseous nitrogen purge to an intermediate temperature was successful ignition demonstrated.
Atwell, Matthew J.↗
Experiments for simulating the absorption of thermal radiation in the propellant duct of a nuclear light bulb reactor
Nuclear light bulb reactor propellant duct absorption of thermal radiation and simulation experiments
Klein, J. F.↗
Thermal fatigue testing of simulated turbine blades
Simulated turbine blade thermal fatigue testing under transient and steady state heating and spanwise loading, obtaining crack initiation and propagation data
Bizon, P. T.↗
Comparing the Electrical Modeling and Thermal Analysis Toolbox Simulation Data to Electrified Aircraft Propulsion Test Hardware Data
The Electrical Modeling and Thermal Analysis Toolbox (EMTAT), a National Aeronautics and Space Administration (NASA)-developed Simulink™ model block library of electrical components developed with the goal of facilitating system-level control design and analysis, has two levels of fidelity depending on the test needs. The Physics Based model blocks are designed to use physical component characteristics to more accurately model real hardware, including power losses, efficiency, thermal effects, electromagnetic losses, voltage drops and current requirements. These blocks model electrical dynamics that occur at the millisecond turbomachinery time scale which allows for faster-than-real-time electrified turbomachinery simulations. A model was developed to mirror the Hybrid Propulsion Emulation Rig (HyPER) hardware, a laboratory focused on Electrified Aircraft Propulsion (EAP) hardware tests. The present hardware setup supports Turbine Electrified Energy Management (TEEM) testing. The outputs of the model were compared to the results of several tests on the HyPER laboratory motor-generator setup with the goal of matching the steady state simulation data to steady state hardware data within 5% of full scale. The objective of this paper is to present the background, setup, testing and results of this comparison. It will describe some of the adjustments that were necessary to match the system hardware, as well as next steps in verification and validation.
Hyper↗
A molecular dynamics simulation study of thermal conductivity anisotropy in β-octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine (β-HMX)
Molecular dynamics (MD) simulations were used to predict the thermal conductivity of β-octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine (β-HMX) along directions normal to the (011), (110), and (010) crystal planes. These directions were selected based on the measured morphological importance of the corresponding crystal surfaces. A reverse non-equilibrium MD approach was used wherein a constant heat flux is imposed along a prescribed direction and the resulting steady-state temperature gradient determined. The coefficient of thermal conductivity λ is the quotient of heat flux and temperature gradient (i.e. Fourier's law). Finite-size effects and sensitivity to imposed heat flux were investigated. The results reveal a modest dependence of the conductivity on crystal orientation, significant finite-size effects, and low sensitivity to imposed flux so long as the Fourier's law analysis is limited to the spatial interval in the simulation cell for which the temperature gradient is constant. Infinite-length thermal conductivities were estimated by linear regression of λ -1 (L) versus reciprocal cell length L -1 for each direction. The predicted values are systematically larger, but within a factor of two, than most published experimental determinations, the latter of which were obtained for pressed-powder or composite samples rather than oriented single crystals.
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
Comparing the Electrical Modeling and Thermal Analysis Toolbox Simulation Data to Electrified Aircraft Propulsion Test Hardware Data
A model using the Electrical Modeling and Thermal Analysis Toolbox (EMTAT), a National Aeronautics and Space Administration (NASA)-developed Simulink® model block library of electrical components, was developed to mirror the Hybrid Propulsion Emulation Rig (HyPER) hardware, a laboratory focused on Electrified Aircraft Propulsion (EAP) hardware tests. The goal of the model was to demonstrate the utility of the library by comparing the accuracy of the library models to the performance of real hardware, with the primary metrics being the simulation outputs matching physical test hardware data within 5% of full scale.The objective of this paper is to present the background, setup, testing and results of this comparison. It describes some of the adjustments that were necessary to match the system hardware, as well as next steps in verification and validation. The outputs of the model were compared to the results of several tests in HyPER, and in the process captured an additional torque loss that is still being analyzed for the root cause but has been confirmed in the hardware. Across all the test series, only one key model parameter was outside the target 5% full scale matching, and nearly 70% were within 1%.
Mark E Bell↗
Comparing the Electrical Modeling and Thermal Analysis Toolbox Simulation Data to Electrified Aircraft Propulsion Test Hardware Data
A model using the Electrical Modeling and Thermal Analysis Toolbox (EMTAT), a National Aeronautics and Space Administration (NASA)-developed Simulink® model block library of electrical components, was developed to mirror the Hybrid Propulsion Emulation Rig (HyPER) hardware, a laboratory focused on Electrified Aircraft Propulsion (EAP) hardware tests. The goal of the model was to demonstrate the utility of the library by comparing the accuracy of the library models to the performance of real hardware, with the primary metrics being the simulation outputs matching physical test hardware data within 5 percent of full scale. The objective of this paper is to present the background, setup, testing and results of this comparison. It describes some of the adjustments that were necessary to match the system hardware, as well as next steps in verification and validation. The outputs of the model were compared to the results of several tests in HyPER, and in the process captured an additional torque loss that is still being analyzed for the root cause but has been confirmed in the hardware. Across all the test series, only one key model parameter was outside the target 5 percent full scale matching, and nearly 70 percent were within 1 percent.
Mark E. Bell↗