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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 1,585 records · Page 88

Time-Disciplined Non-PLL Active Synchronization for Grid-Forming Inverters: Preprint

Grid Forming Inverters (GFMIs) are a critical component of the future Grid. One major challenge with GFMIs is synchronization. Currently, most research in GFMI synchronization is focused around specific transition types but this is only a subcategory of the possible events facing GFMIs. In this paper, we propose categorizing all possible synchronization events into four categories: (1) Initial Grid Synchronization, (2) Ride-Through, (3) Blackstart Coordination, (4) Grid Reconnection Coordination. By categorizing events, we can better compare and integrate different control strategies under specific test conditions as demonstrated in simulation. This paper’s framework helps guide GFMI primary-level control design to further research towards the 100% inverter-dominant Grid.

blackstart↗

Time Disciplined Non-PLL Active Synchronization for Grid Forming Inverters

Grid forming inverters (GFMIs) are a critical component of the future grid. One major challenge with GFMIs is synchronization. Currently, most research in GFMI synchronization is focused around specific transition types but this is only a subcategory of the possible events facing GFMIs. In this paper, we propose categorizing all possible synchronization events into four categories: (1) initial grid synchronization, (2) ride-through, (3) blackstart coordination, (4) grid reconnection coordination. By categorizing events, we can better compare and integrate different control strategies under specific test conditions as demonstrated in simulation. This paper's framework helps guide GFMI primary-level control design to further research towards the 100% inverter-dominant grid.

blackstart↗

Towards An Updated Simulation of the Booster Neutrino Beam

Precise, accurate neutrino flux predictions for neutrino beam experiments are crucial for physics results. Flux predictions for the Booster Neutrino Beam at Fermilab were first published in 2009 by the MiniBooNE collaboration. It is no longer possible to run the simulation used to create these predictions due to outdated software versions. In this exciting period for the Short-Baseline Neutrino Program at Fermilab, with both the far detector (ICARUS) and the near detector (SBND) operating, an updated flux model for the BNB is necessary. For the purpose of using a dynamic, up-to-date beam model, the SBN program has created a new simulation named G4BNB. This framework contains new features, such as a full neutrino ancestry to handle hadron production systematics with more precision, and the inclusion of neutral mesons from the proton-beryllium scatter to allow the study of exotic BSM scenarios.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

Petri Nets for Adversarial Models using Monte Carlo Simulation

We describe an object-oriented framework and user interface for developing models of adversarial scenarios, implemented as stochastic Petri nets. The framework is implemented using the statistical computing language R, and provides facilities for eliciting models from subject matter experts, displaying models graphically, simulating scenario execution, and presenting scenario outcomes and statistics.

97 MATHEMATICS AND COMPUTING↗

Optimizing district energy systems by integrating Borehole Thermal Energy Storage Using a Mixed-Integer Linear Programming g-function framework with a Multi-Timescale Rolling Horizon method

Shallow geothermal has gained increasing attention in recent years; however, a reliable framework for its accurate incorporation into large-scale energy system optimization remains lacking. This study proposes a Mixed-Integer Linear Programming (MILP) framework combined with the g-function approach to integrate Borehole Thermal Energy Storage (BTES) technology into energy system optimization. Validation against a Modelica-based reservoir network simulation demonstrates that the proposed framework effectively captures the ground thermal response under varying energy loads and accurately estimates the borefield energy supply. To enhance scalability, a Rolling Horizon with Multi-Timescale (RH-MTS) method is further introduced, reducing computational time by 73 % for the 1-year optimization model with only minor loss of optimality. The framework is demonstrated through the case study of the UC Berkeley campus. Results indicate that BTES is a cost-effective and low-carbon solution: two borefields comprising 382 boreholes can meet 8.0 % and 6.6 % of the total campus heating and cooling demand, respectively, at an average energy rate of 0.70–0.77 USD/kWh and carbon intensity of 0.54 kg-CO2/kWh. Short-term analysis reveals a 35%–65% decline in BTES energy flow after 3–6 months of continuous heating/cooling operation, while long-term simulation shows that annual energy production of BTES can vary by up to 12.0 % after four years before stabilizing. Overall, this study develops a novel optimization framework that couples physics-based g-function method with MILP optimization framework, thereby advancing methodological development for shallow-geothermal integration and providing actionable guidance for BTES deployment in district-energy systems.

Yang, Jiahui↗

Search for efficient formulations for Hamiltonian simulation of non-Abelian lattice gauge theories

Hamiltonian formulation of lattice gauge theories (LGTs) is the most natural framework for the purpose of quantum simulation, an area of research that is growing with advances in quantum-computing algorithms and hardware. It, therefore, remains an important task to identify the most accurate, while computationally economic, Hamiltonian formulation(s) in such theories, considering the necessary truncation imposed on the Hilbert space of gauge bosons with any finite computing resources. This paper is a first step toward addressing this question in the case of non-Abelian LGTs, which further require the imposition of non-Abelian Gauss’s laws on the Hilbert space, introducing additional computational complexity. Focusing on the case of SU(2) LGT in 1+1 dimensions coupled to one flavor of fermionic matter, a number of different formulations of the original Kogut-Susskind framework are analyzed with regard to the dependence of the dimension of the physical Hilbert space on boundary conditions, system’s size, and the cutoff on the excitations of gauge bosons. The impact of such dependencies on the accuracy of the spectrum and dynamics obtained from a Hamiltonian computation is examined, and the (classical) computational-resource requirements given these considerations are studied. Besides the well-known angular-momentum formulation of the theory, the cases of purely fermionic and purely bosonic formulations (with open boundary conditions), and the Loop-String-Hadron formulation are analyzed, along with a brief discussion of a Quantum-Link-Model formulation of the same theory. Clear advantages are found in working with the Loop-String-Hadron framework which implements non-Abelian Gauss’s laws a priori using a complete set of gauge-invariant operators. Although small lattices are studied in the numerical analysis of this work, and only the simplest algorithms are considered, a range of conclusions will be applicable to larger systems and potentially to higher dimensions. Future studies will extend this investigation to the analysis of resource requirements for quantum simulations of non-Abelian LGT, with the goal of shedding light on the most efficient Hamiltonian formulation of gauge theories of relevance in nature

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Structure and dynamics of aqueous solutions from PBE-based first-principles molecular dynamics simulations

Establishing an accurate and predictive computational framework for the description of complex aqueous solutions is an ongoing challenge for density functional theory based first-principles molecular dynamics (FPMD) simulations. In this context, important advances have been made in recent years, including the development of sophisticated exchange-correlation functionals. On the other hand, simulations based on simple generalized gradient approximation (GGA) functionals remain an active field, particularly in the study of complex aqueous solutions due to a good balance between the accuracy, computational expense, and the applicability to a wide range of systems. In such simulations we often perform them at elevated temperatures to artificially “correct” for GGA inaccuracies in the description of liquid water; however, a detailed understanding of how the choice of temperature affects the structure and dynamics of other components, such as solvated ions, is largely unknown. In order to address this question, we carried out a series of FPMD simulations at temperatures ranging from 300 to 460 K for liquid water and three representative aqueous solutions containing solvated Na + , K + , and Cl - ions. We show that simulations at 390–400 K with the Perdew-Burke-Ernzerhof (PBE) exchange-correlation functional yield water structure and dynamics in good agreement with experiments at ambient conditions. Simultaneously, this computational setup provides ion solvation structures and ion effects on water dynamics consistent with experiments. These results suggest that an elevated temperature around 390–400 K with the PBE functional can be used for the description of structural and dynamical properties of liquid water and complex solutions with solvated ions at ambient conditions.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Decision Manifold Approximation for Physics-Based Simulations

With the recent surge of success in big-data driven deep learning problems, many of these frameworks focus on the notion of architecture design and utilizing massive databases. However, in some scenarios massive sets of data may be difficult, and in some cases infeasible, to acquire. In this paper we discuss a trajectory-based framework that quickly learns the underlying decision manifold of binary simulation classifications while judiciously selecting exploratory target states to minimize the number of required simulations. Furthermore, we draw particular attention to the simulation prediction application idealized to the case where failures in simulations can be predicted and avoided, providing machine intelligence to novice analysts. We demonstrate this framework in various forms of simulations and discuss its efficacy.

Wong, Jay Ming↗

TU-H-CAMPUS-IeP1-05: A Framework for the Analytic Calculation of Patient-Specific Dose Distribution Due to CBCT Scan for IGRT

Purpose: To investigate the feasibility of an analytic framework to estimate patients’ absorbed dose distribution owing to daily cone-beam CT scan for image-guided radiation treatment. Methods: To compute total absorbed dose distribution, we separated the framework into primary and scattered dose calculations. Using the source parameters such as voltage, current, and bowtie filtration, for the primary dose calculation, we simulated the forward projection from the source to each voxel of an imaging object including some inhomogeneous inserts. Then we calculated the primary absorbed dose at each voxel based on the absorption probability deduced from the HU values and Beer’s law. In sequence, all voxels constructing the phantom were regarded as secondary sources to radiate scattered photons for scattered dose calculation. Details of forward projection were identical to that of the previous step. The secondary source intensities were given by using scatter-to- primary ratios provided by NIST. In addition, we compared the analytically calculated dose distribution with their Monte Carlo simulation results. Results: The suggested framework for absorbed dose estimation successfully provided the primary and secondary dose distributions of the phantom. Moreover, our analytic dose calculations and Monte Carlo calculations were well agreed each other even near the inhomogeneous inserts. Conclusion: This work indicated that our framework can be an effective monitor to estimate a patient’s exposure owing to cone-beam CT scan for image-guided radiation treatment. Therefore, we expected that the patient’s over-exposure during IGRT might be prevented by our framework.

60 APPLIED LIFE SCIENCES↗

Platform-Independence and Scheduling In a Multi-Threaded Real-Time Simulation

Aviation research often relies on real-time, pilot-in-the-loop flight simulation as a means to develop new flight software, flight hardware, or pilot procedures. Often these simulations become so complex that a single processor is incapable of performing the necessary computations within a fixed time-step. Threads are an elegant means to distribute the computational work-load when running on a symmetric multi-processor machine. However, programming with threads often requires operating system specific calls that reduce code portability and maintainability. While a multi-threaded simulation allows a significant increase in the simulation complexity, it also increases the workload of a simulation operator by requiring that the operator determine which models run on which thread. To address these concerns an object-oriented design was implemented in the NASA Langley Standard Real-Time Simulation in C++ (LaSRS++) application framework. The design provides a portable and maintainable means to use threads and also provides a mechanism to automatically load balance the simulation models.

Sugden, Paul P.↗

Integrated Neutronics Modeling for Inertial Fusion Energy Systems: Development and Application to LD-FIRST

Lawrence Livermore National Laboratory (LLNL) is proposing a new Laser Driven Fusion Integration Research and Science Test Facility (LD-FIRST) with the goal of providing an experimental testbed for future Inertial Fusion Energy (IFE) systems. However, IFE systems require detailed and accurate multiphysics modeling to quantify material damage, thermal loading, and tritium breeding within complex chamber environments. This article presents the first step in an integrated multiphysics framework that couples meshed CAD-based geometry within Monte Carlo neutronic simulations to enable high-fidelity analysis of IFE chamber concepts, with future coupling to external codes. The neutronics workflow utilizes OpenMC and its third-party capability to use CAD-based geometries through DAGMC and tally on unstructured meshes with Libmesh to evaluate neutron transport behavior, geometric fidelity, and material performance under reactor-relevant conditions. The use of tailored tallies on unstructured meshes in this framework allows direct transfer without interpolating to CFD simulation tools. Two IFE chambers were evaluated, both conceived by LLNL: HYLIFE-II and Laser IFE (LIFE). This work produced high-fidelity conformal surface and volumetric meshes of the HYLIFE-II and LIFE chambers with mapped spatial insight into material damage, thermal loading, and tritium breeding. The HYLIFE-II model was built utilizing available resources and used as a test case to verify that the neutronics framework can handle complex geometries. The LIFE chamber CAD was provided by LLNL and was the main focus of this work. This work analyzes multiple ternary alloy breeding materials for the LIFE chamber, across different 6 Li enrichments to produce data relevant to the LD-FIRST project. This work also investigates the level of model fidelity for the LIFE chamber, and results show that inclusion of detailed first wall and coolant structures increased the predicted tritium breeding ratio (TBR) by ~30%, highlighting the sensitivity of tritium breeding and the need for a high-fidelity simulation framework for IFE chambers. These developments provide a scalable toolset for the design and optimization of next-generation IFE chambers, forming a solid foundation for future coupled multiphysics analysis.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

SERGHEI (SERGHEI-SWE) v1.0: a performance-portable high-performance parallel-computing shallow-water solver for hydrology and environmental hydraulics

The Simulation EnviRonment for Geomorphology, Hydrodynamics, and Ecohydrology in Integrated form (SERGHEI) is a multi-dimensional, multi-domain, and multi-physics model framework for environmental and landscape simulation, designed with an outlook towards Earth system modelling. At the core of SERGHEI's innovation is its performance-portable high-performance parallel-computing (HPC) implementation, built from scratch on the Kokkos portability layer, allowing SERGHEI to be deployed, in a performance-portable fashion, in graphics processing unit (GPU)-based heterogeneous systems. In this work, we explore combinations of MPI and Kokkos using OpenMP and CUDA backends. In this contribution, we introduce the SERGHEI model framework and present with detail its first operational module for solving shallow-water equations (SERGHEI-SWE) and its HPC implementation. This module is designed to be applicable to hydrological and environmental problems including flooding and runoff generation, with an outlook towards Earth system modelling. Its applicability is demonstrated by testing several well-known benchmarks and large-scale problems, for which SERGHEI-SWE achieves excellent results for the different types of shallow-water problems. Finally, SERGHEI-SWE scalability and performance portability is demonstrated and evaluated on several TOP500 HPC systems, with very good scaling in the range of over 20 000 CPUs and up to 256 state-of-the art GPUs.

58 GEOSCIENCES↗

Methodology to Support Dynamic Function Allocation Policies Between Humans and Flight Deck Automation

Function allocation assigns work functions to all agents in a team, both human and automation. Efforts to guide function allocation systematically have been studied in many fields such as engineering, human factors, team and organization design, management science, cognitive systems engineering. Each field focuses on certain aspects of function allocation, but not all; thus, an independent discussion of each does not address all necessary aspects of function allocation. Four distinctive perspectives have emerged from this comprehensive review of literature on those fields: the technology-centered, human-centered, team-oriented, and work-oriented perspectives. Each perspective focuses on different aspects of function allocation: capabilities and characteristics of agents (automation or human), structure and strategy of a team, and work structure and environment. This report offers eight issues with function allocation that can be used to assess the extent to which each of issues exist on a given function allocation. A modeling framework using formal models and simulation was developed to model work as described by the environment, agents, their inherent dynamics, and relationships among them. Finally, to validate the framework and metrics, a case study modeled four different function allocations between a pilot and flight deck automation during the arrival and approach phases of flight.

Johnson, Eric N.↗

A framework to collect human reliability analysis data for nuclear power plants using a simplified simulator and student operators

Data scarcity in human reliability analysis (HRA) has been a major challenge in the quantification process. Many institutes have collected HRA data through experiments using full-scope simulators with actual operators. Nevertheless, there are still some limitations to relying solely on full-scope studies. This paper aims to propose how full-scope data collection studies can be supported through the Simplified Human Error Experimental Program (SHEEP). The SHEEP framework was developed by Idaho National Laboratory (INL) to collect HRA data through a simplified simulator and student operators. This paper introduces the major tasks in the SHEEP framework, with a particular focus on differences that arise due to participant type (i.e., student vs. actual operator), based on experiments using a simplified simulator (i.e., the Rancor Microworld). This paper also describes whether the data collected via this approach could support a representative full-scope data collection study (i.e., the HuREX study) based on the experimental data.

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗

Clouds and Convective Self-Aggregation in a Multi-Model Ensemble of Radiative-Convective Equilibrium Simulations

The Radiative-Convective Equilibrium Model Intercomparison Project (RCEMIP) is an intercomparison of multiple types of numerical models configured in radiative-convective56equilibrium (RCE). RCE is an idealization of the tropical atmosphere that has long been used to study basic questions in climate science. Here, we employ RCE to investigate the role that clouds and convective activity play in determining cloud feedbacks, climatecsensitivity, the state of convective aggregation, and the equilibrium climate. RCEMIP is unique amongst intercomparisons in its inclusion of a wide range of model types, including atmospheric general circulation models (GCMs), single column models (SCMs), cloud-resolving models (CRMs), large eddy simulations (LES), and global cloud-resolving models (GCRMs). The first results are presented from the RCEMIP ensemble of more than 30 models. While there are large differences across the RCEMIP ensemble in the representation of mean profiles of temperature, humidity, and cloudiness, in a majority of models anvil clouds rise, warm, and decrease in area coverage in response to an increase in sea surface temperature (SST). Nearly all models exhibit self-aggregation in large domains and agree that self-aggregation acts to dry and warm the troposphere, reduce high cloudiness, and increase cooling to space. The degree of self-aggregation exhibits no clear tendency with warming. There is a wide range of climate sensitivities, but models with parameterized convection tend to have lower climate sensitivities than models with explicit convection. In models with parameterized convection, aggregated simulations have lower climate sensitivities than un-aggregated simulations. Plain Language Summary This study investigates tropical clouds and climate using results from more than 30 different numerical models set up in a simplified framework. The dataset of model simulations is unique in that it includes a wide range of model types configured in a consistent manner. We address some of the biggest open questions in climate science, including how cloud properties change with warming and the role that the tendency of clouds to form clusters plays in determining the average climate and how climate changes. While there are large differences in how the different models simulate average temperature, humidity, and cloudiness, in a majority of models, the amount of high clouds decreases as climate warms. Nearly all models simulate a tendency for clouds to cluster together. There is agreement that when the clouds are clustered, the atmosphere is drier with fewer clouds overall. We don’t find a conclusive result for how cloud clustering changes as the climate warms.

Allison A. Wing↗

A seamless approach for evaluating climate models across spatial scales

In regions of the world where topography varies significantly with distance, most global climate models (GCMs) have spatial resolutions that are too coarse to accurately simulate key meteorological variables that are influenced by topography, such as clouds, precipitation, and surface temperatures. One approach to tackle this challenge is to run climate models of sufficiently high resolution in those topographically complex regions such as the North American Regionally Refined Model (NARRM) subset of the Department of Energy’s (DOE) Energy Exascale Earth System Model version 2 (E3SM v2). Although high-resolution simulations are expected to provide unprecedented details of atmospheric processes, running models at such high resolutions remains computationally expensive compared to lower-resolution models such as the E3SM Low Resolution (LR). Moreover, because regionally refined and high-resolution GCMs are relatively new, there are a limited number of observational datasets and frameworks available for evaluating climate models with regionally varying spatial resolutions. As such, we developed a new framework to quantify the added value of high spatial resolution in simulating precipitation over the contiguous United States (CONUS). To determine its viability, we applied the framework to two model simulations and an observational dataset. We first remapped all the data into Hierarchical Equal-Area Iso-Latitude Pixelization (HEALPix) pixels. HEALPix offers several mathematical properties that enable seamless evaluation of climate models across different spatial resolutions including its equal-area and partitioning properties. The remapped HEALPix-based data are used to show how the spatial variability of both observed and simulated precipitation changes with resolution increases. This study provides valuable insights into the requirements for achieving accurate simulations of precipitation patterns over the CONUS. It highlights the importance of allocating sufficient computational resources to run climate models at higher temporal and spatial resolutions to capture spatial patterns effectively. Furthermore, the study demonstrates the effectiveness of the HEALPix framework in evaluating precipitation simulations across different spatial resolutions. This framework offers a viable approach for comparing observed and simulated data when dealing with datasets of varying spatial resolutions. By employing this framework, researchers can extend its usage to other climate variables, datasets, and disciplines that require comparing datasets with different spatial resolutions.

54 ENVIRONMENTAL SCIENCES↗

A framework for quantifying the impact of occupant behavior on energy savings of energy conservation measures

To improve energy efficiency—during new buildings design or during a building retrofit—evaluating the energy savings potential of energy conservation measures (ECMs) is a critical task. In building retrofits, occupant behavior significantly impacts building energy use and is a leading factor in uncertainty when determining the effectiveness of retrofit ECMs. Current simulation-based assessment methods simplify the representation of occupant behavior by using a standard or representative set of static and homogeneous assumptions ignoring the dynamics, stochastics, and diversity of occupant's energy-related behavior in buildings. The simplification contributes to significant gaps between the simulated and measured actual energy performance of buildings. This paper presents a framework for quantifying the impact of occupant behaviors on ECM energy savings using building performance simulation. During the first step of the study, three occupant behavior styles (austerity, normal, and wasteful) were defined to represent different levels of energy consciousness of occupants regarding their interactions with building energy systems (HVAC, windows, lights and plug-in equipment). Next, a simulation workflow was introduced to determine a range of the ECM energy savings. Then, guidance was provided to interpret the range of ECM savings to support ECM decision making. Finally, a pilot study was performed in a real building to demonstrate the application of the framework. Simulation results show that the impact of occupant behaviors on ECM savings vary with the type of ECM. Occupant behavior minimally affects energy savings for ECMs that are technology-driven (the relative savings differ by less than 2%) and have little interaction with the occupants; for ECMs with strong occupant interaction, such as the use of zonal control variable refrigerant flow system and natural ventilation, energy savings are significantly affected by occupant behavior (the relative savings differ by up to 20%). Finally, the study framework provides a novel, holistic approach to assessing the uncertainty of ECM energy savings related to occupant behavior, enabling stakeholders to understand and assess the risk of adopting energy efficiency technologies for new and existing buildings.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗