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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 1,189 records · Page 66
All sourcesNASA NTRSDOE OSTI
DOE OSTI2018

Parallel Ellipsoidal Perfectly Matched Layers for Acoustic Helmholtz Problems on Exterior Domains

Exterior acoustic problems occur in a wide range of applications, making the finite element analysis of such problems a common practice in the engineering community. Various methods for truncating infinite exterior domains have been developed, including absorbing boundary conditions, infinite elements, and more recently, perfectly matched layers (PML). PML are gaining popularity due to their generality, ease of implementation, and effectiveness as an absorbing boundary condition. PML formulations have been developed in Cartesian, cylindrical, and spherical geometries, but not ellipsoidal. In addition, the parallel solution of PML formulations with iterative solvers for the solution of the Helmholtz equation, and how this compares with more traditional strategies such as infinite elements, has not been adequately investigated. In this study, we present a parallel, ellipsoidal PML formulation for acoustic Helmholtz problems. To faciliate the meshing process, the ellipsoidal PML layer is generated with an on-the-fly mesh extrusion. Though the complex stretching is defined along ellipsoidal contours, we modify the Jacobian to include an additional mapping back to Cartesian coordinates in the weak formulation of the finite element equations. This allows the equations to be solved in Cartesian coordinates, which is more compatible with existing finite element software, but without the necessity of dealing with corners in the PML formulation. Herein we also compare the conditioning and performance of the PML Helmholtz problem with infinite element approach that is based on high order basis functions. On a set of representative exterior acoustic examples, we show that high order infinite element basis functions lead to an increasing number of Helmholtz solver iterations, whereas for PML the number of iterations remains constant for the same level of accuracy. Finally, this provides an additional advantage of PML over the infinite element approach.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2026

Modeling Framework for Data Center

This chapter highlights the critical need for advanced modeling of data centers due to their rapidly increasing energy consumption and impact on grid reliability. Driven by the demand for AI applications, data centers are projected to consume a significant portion of US energy by 2028, putting stress on an already challenged power grid. The chapter emphasizes the importance of "fast" time-scale models to understand the dynamic interactions between data centers and the grid, especially given the rapid power fluctuations of AI workloads. It outlines a modeling framework that includes both offline and real-time EMT domain simulations, detailing the necessary representations for various components like utility interfaces, transformers, IT loads, UPS, cooling loads, Battery Energy Storage Systems (BESS), generators, protection systems, and higher-level control systems. While standard simulation tools like PSCAD offer basic models, custom development is often required to accurately capture the unique and fast-changing behaviors of modern data centers. The chapter also discusses key metrics and test cases for validating these models, focusing on transient load responses, protection relay coordination, and demand flexibility. Finally, it addresses the challenges of modeling large-scale data centers, such as computational complexity and the trade-off between model fidelity and practicality, suggesting hybrid modeling approaches as a solution. The overarching goal is to create a robust framework that helps assess data center impacts on grid stability, identify vulnerabilities, and inform the development of standards for reliable integration of these large loads into the bulk power system.

25 ENERGY STORAGE↗
DOE OSTI2024

Trebiskyite, the First Titanium-Decavanadate Mineral

Abstract Trebiskyite, Na3Mg2[TiV9O28]·22H2O, from the Pickett Corral mine, Bull Canyon, Montrose County, Colorado, USA, is the first mineral containing essential Ti as a component of a decavanadate polyanion. Crystals are thin prisms or needles up to ∼0.3 mm in length, occurring as individuals and in divergent sprays. Trebiskyite crystals are translucent yellow with vitreous luster and pale-yellow streak and are non-fluorescent under both longwave and shortwave ultraviolet illumination. The crystals exhibit elongation on [001] and are modified by several 0kl prism forms, possibly corresponding to {010}, {011}, and {012}. The Mohs hardness is ca. 2 based on scratch tests. Crystals have brittle tenacity with irregular fracture. No apparent cleavage, nor twinning, was evident, and the mineral is readily soluble in H2O. The density measured by flotation in methylene iodide-toluene mixture is 2.38(2) g/cm3. The calculated density is 2.352 g/cm3 for the empirical formula and 2.343 g/cm3 for the ideal formula. Electron microprobe analyses provided the empirical formula Na3.39Mg1.87V8.75Ti1.25O50H44.00, based on Ti + V = 10 apfu, O = 50 apfu, with the Na content having been determined from the refined crystal structure. Trebiskyite is monoclinic, space group P21/c, a = 9.478(4), b = 21.426(11), c = 11.267(5) Å, β = 114.572(7)°, V = 2080.8(13) Å3, Z = 2. The structure was refined from 6642 reflections to a final R1 = 0.0517 for reflections I > 2σ(I). The structural unit of trebiskyite, (TiV9O28)7−, is built from a Ti-substituted decavanadate polyanion, (V10O28)6−, found in other members of the pascoite family. Chemically, trebiskyite is closely related to lasalite, Na2Mg2[V10O28]·20H2O, and huemulite, Na4Mg[V10O28]·24H2O; however, trebiskyite contains a novel structural arrangement that is unique among the decavanadate minerals. The interstitial complex in trebiskyite has the ideal formula {[Na3Mg2(H2O)19](H2O)3} and consists of chains of distorted octahedrally coordinated Na+ and regular Mg[O(H2O)5] octahedra. The observed low incident bond valence to the V1 site (4.45 vu) and marked deviation in vanadyl and V–Oeq bond lengths indicate that this site is host to the essential Ti4+ identified during chemical analyses.

Mineralogy↗
NASA NTRS1978

A split-recoupled-semidirect computational technique applied to transonic flow over lifting airfoils

A new version of the semidirect iterative method eliminates significant restrictions of previous versions of the method. A semidirect method solves finite-difference equations by a rapid globally implicit iterative process driven by a fast direct elliptic solver. The new approach can treat complex systems of equations in an efficient 'correction form', and allows the use of general, nonorthogonal, boundary-fitted coordinate transformations. These features are expected to lead to significant practical applications with conservation-equation systems in either two or three dimensions. The present application to the full potential equations for steady transonic flow over an airfoil at angle of attack illustrates the utility of the technique.

Martin, E. D.↗
NASA NTRS1980

A calculation procedure for viscous flow in turbomachines, volume 2

Turbulent flow within turbomachines having arbitrary blade geometries is examined. Effects of turbulence are modeled using two equations, one expressing the development of the turbulence kinetic energy and the other its dissipation rate. To account for complicated blade geometries, the flow equations are formulated in terms of a nonorthogonal boundary fitted coordinate system. The analysis is applied to a radial inflow turbine. The solution obtained indicates the severity of the complex interaction mechanism that occurs between the different flow regimes (i.e., boundary layers, recirculating eddies, separation zones, etc.). Comparison with nonviscous flow solutions tend to justify strongly the inadequacy of using the latter with standard boundary layer techniques to obtain viscous flow details within turbomachine rotors. Capabilities and limitations of the present method of analysis are discussed.

Khalil, J.↗
NASA NTRS1981

The largest H II regions in M101

Coordinated millimeter, infrared, and ultraviolet observations of the five brightest H II regions in M101 are presented. A CO complex has been found to be associated with NGC 5461 which is much more massive than any Milky Way counterpart. A narrow line width has been observed which suggests that the molecular complex may consist of numerous fragments with a volume filling fraction approximately 0.01. NGC 5461 also shows a 10 micron and 20 micron excess which is similar to that of galactic H II regions. The ultraviolet observations show that the 2200 A dust feature is greatly attenuated in all of the H II regions but least of all in NGC 5461. The near-infrared flux densities and B-gamma line strengths are consistent with the hypothesis that a significant fraction of the infrared emission is free-free.

Blitz, L.↗
NASA NTRS1988

An improved version of NCOREL: A computer program for 3-D nonlinear supersonic potential flow computations

A computer code called NCOREL (for Nonconical Relaxation) has been developed to solve for supersonic full potential flows over complex geometries. The method first solves for the conical at the apex and then marches downstream in a spherical coordinate system. Implicit relaxation techniques are used to numerically solve the full potential equation at each subsequent crossflow plane. Many improvements have been made to the original code including more reliable numerics for computing wing-body flows with multiple embedded shocks, inlet flow through simulation, wake model and entropy corrections. Line relaxation or approximate factorization schemes are optionally available. Improved internal grid generation using analytic conformal mappings, supported by a simple geometric Harris wave drag input that was originally developed for panel methods and internal geometry package are some of the new features.

Siclari, Michael J.↗
NASA NTRS1989

The formation and study of titanium, zirconium, and hafnium complexes

Research involves the preparation and characterization of a series of Ti, Zr, Hf, TiO, and HfO complexes using the poly(pyrazole) borates as ligands. The study will provide increased understanding of the decomposition of these coordination compounds which may lead to the production of molecular oxygen on the Moon from lunar materials such as ilmenite and rutile. The model compounds are investigated under reducing conditions of molecular hydrogen by use of a high temperature/pressure stainless steel autoclave reactor and by thermogravimetric analysis.

Wilson, Bobby↗
NASA NTRS2010

Serious Games that Improve Performance

Serious games can help people function more effectively in complex settings, facilitate their role as team members, and provide insight into their team's mission. In such games, coordination and cooperation among team members are foundational to the mission's success and provide a preview of what individuals and the team as a whole could choose to do in a real scenario. Serious games often model events requiring life-or-death choices, such as civilian rescue during chemical warfare. How the players communicate and what actions they take can determine the number of lives lost or saved. However, merely playing a game is not enough to realize its most practical value, which is in learning what actions and communication methods are closest to what the mission requires. Teams often play serious games in isolation, so when the game is complete, an analytical stage is needed to extract the strategies used and examine each strategy's success relative to the others chosen. Recognizing the importance of this next stage, Noblis has been developing Game Analysis, software that parses individual game play into meaningful units and generates a strategic analysis. Trainers create a custom game-specific grammar that reflects the objects and range of actions allowable in a particular game, which Game Analysis then uses to parse the data and generate a practical analysis. Trainers have then enough information to represent strategies in tools, such as Gantt and heat map charts. First-responder trainees in North Carolina have already partnered Hot-Zone and Game Analysis with great success.

McGowan, Clement, III↗
NASA NTRS2020

A Concept for the Deployment of a Large Lunar Crater Radio Telescope Using Teams of Tethered Robots

Kilometer-scale craters on the far side of the Moon have unique potential as future locations for large radio telescopes, which can observe the universe at wavelengths and frequencies (> 10 m, < 30 MHz) not possible with conventional Earth or orbital-based approaches. Distinct advantages of building a Lunar Crater Radio Telescope (LCRT) on the far side include i) isolation from radio noise due to the Earth’s ionosphere, orbiting satellites, and the Sun, ii) days of uninterrupted dark/cold sky viewing during lunar night, and iii) terrain geometry naturally suited for constructing the largest mesh antenna structure in the Solar System. A key challenge to constructing LCRT on the Moon is related to the complexity of deploying a 1-km diameter antenna and hanging receiver within a lunar crater whose diameter, depth, and slope are 3-5 km, 1 km, and ~30 degrees respectively. In this paper, we first evaluate the trade space for deploying a large, complex structure within a crater, and then provide a more detailed concept evaluation of our favored approach, which employs coordinated teams of tethered rovers to extract and suspend a folded antenna from a lander at the base of a crater. NASA’s Jet Propulsion Laboratory in collaboration with California Institute of Technology (Caltech) have developed a novel robotic system for accessing extremely steep terrains; the Axel rover is a two-wheeled rugged terrain vehicle that is supported by an electro-mechanical tether that provides power, data, and tensile support from a top-side anchor location. Recently, a pair of Axel robots have been used in a DuAxel configuration that allows for four-wheel driving and repeated passive anchoring at different locations. The DuAxel system has unique advantages for deploying an LCRT antenna, including the ability to deploy from a lander near a crater, drive a distance to the crater rim to deploy an Axel, and later, retract the deployed Axel in order to sequentially lift up sections of the antenna. Our proposed concept involves delivering a packaged antenna and receiver to the bottom-center of a crater floor on a lander, then later sending a team of multiple DuAxel rovers to retrieve guide wires from the lander, which are pulled to the top of the crater. We explore this concept in detail and provide some initial quantitative analysis to demonstrate the feasibility of our system with respect to the spatial and mass properties of the antenna as juxtaposed to DuAxel capabilities. Finally, we outline next steps towards validating our concept on the way to a future lunar deployment opportunity.

Hallinan, Greg↗
DOE OSTI2018

ARM Radar Science Recommendations from 2017 6th ARM Radar Workshop

The U.S. Department of Energy (DOE) Atmospheric Radiation Measurement (ARM) Climate Research Facility’s radar organization was formed to provide an integrated approach to meet the scientific objectives of ARM. The radar organization consists of two groups: Radar Science and Radar Engineering and Operations. The two groups work closely for planning, coordination, and communications to produce high-quality observations and products from the ARM radar network, which consists of complex radars deployed in very challenging environments. In addition, scanning cloud radars are relatively new in the community, with very limited products that are mature enough to be applied for modeling studies. The Radar Science Group and Radar Engineering and Operations Group meet regularly along with researchers and users from the community in a workshop. The overarching objective of the workshop is to maximize the usage of ARM radar data for improving our understanding of processes and, ultimately improving representation of clouds and precipitation in models. The 6th DOE ARM Radar Engineering and Radar Science Workshop was held October 24-26, 2017, at Stony Brook University. Approximately 40 participants were present; a detailed list of participants is listed in Section 5. This report documents recommendations made by members of the science community who attended the workshop. Their recommendations appear italicized in the report. ARM management will consider these recommendations in their future planning and prioritization activities. The topics addressed during the workshop are contained in the agenda (Section 4). Significant action items, recommendations, and comments that came out of the meeting are contained in Section 3. The content in Section 3 presents a path through important discussions that were pursued during the Workshop.

Southern Great Plains, North Slope of Alaska, East↗
DOE OSTI2018

Lead(II) coordination polymers with imidazole-4- and pyrazole-3-carboxylate isomeric linkers: Structural diversity and luminescence properties

Highlights: • Two Pb(II)-based CPs with N-heteroaromatic carboxylates were obtained. • Crystal structure of polymer 1 demonstrates a 1D structural motif with 2C1 topology. • Polymer 2 is a 2D complex with cpf topology. • The lone pair activity in CPs have been investigated via DFT calculations. • The fluorescence properties of the polymers were studied in the solid state at RT. - Abstract: Using 1H-imidazole-4-carboxylic acid (4imCOOH) and 1H-pyrazole-3-carboxylic acid (3pyrCOOH) coordination polymers [Pb(4imCOO){sub 2}(H{sub 2}O)]{sub n} (1) and [Pb{sub 2}(3pyrCOO){sub 4}]{sub n} (2) were constructed. Obtained polymers were characterized via FT-IR, X-ray, PL and TG methods. The coordination polyhedron around Pb(II) in 1 is described as distorted pentagonal pyramid with hemidirected coordination sphere (based on DFT calculations). Compound 2 consists of two crystallographically independent Pb(II) centres: Pb1 forms distorted monocapped pentagonal pyramid polyhedron (CN = 7, hemidirected), whereas the coordination polyhedron of Pb2 is distorted monocapped pentagonal pyramid (CN = 7) or tricapped octahedron (CN = 9, including secondary bonds) with holodirected geometry (confirmed by DFT calculations). Crystal structure of polymer 1 demonstrates a 1D structural motif with 2C1 topology while polymer 2 is a 2D compound with cpf topology. Polymer 1 presents blue-green emission at 485 nm at RT in the solid state, whereas polymer 2 exhibits two emission centres with maximum at 449 nm (blue fluorescence) and at 532 nm (green-yellow fluorescence), respectively.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2023

Tetracopper σ‐Bound μ ‐Acetylide and ‐Diyne Units Stabilized by a Naphthyridine‐based Dinucleating Ligand

Abstract Reactions of a dicopper(I) tert ‐butoxide complex with alkynes possessing boryl or silyl capping groups resulted in formation of unprecedented tetracopper(I) μ ‐acetylide/diyne complexes that were characterized by NMR and UV/Vis spectroscopy, mass spectrometry and single‐crystal X‐ray diffraction. These compounds possess an unusual μ 4 ‐ η 1 : η 1 : η 1 : η 1 coordination mode for the bridging organic fragment, enforced by the rigid and dinucleating nature of the ligand utilized. Thus, the central π system remains unperturbed and accessible for subsequent reactivity and modification. This has been corroborated by addition of a fifth copper atom, giving rise to a pentacopper acetylide complex. This work may provide a new approach by which metal‐metal cooperativity can be exploited in the transformation of acetylide and diyne groups to a variety of substrates, or as a starting point for the controlled synthesis of copper(I) alkyne‐containing clusters.

Ríos, Pablo↗
DOE OSTI2023

Tetracopper σ‐Bound μ ‐Acetylide and ‐Diyne Units Stabilized by a Naphthyridine‐based Dinucleating Ligand

Abstract Reactions of a dicopper(I) tert ‐butoxide complex with alkynes possessing boryl or silyl capping groups resulted in formation of unprecedented tetracopper(I) μ ‐acetylide/diyne complexes that were characterized by NMR and UV/Vis spectroscopy, mass spectrometry and single‐crystal X‐ray diffraction. These compounds possess an unusual μ 4 ‐ η 1 : η 1 : η 1 : η 1 coordination mode for the bridging organic fragment, enforced by the rigid and dinucleating nature of the ligand utilized. Thus, the central π system remains unperturbed and accessible for subsequent reactivity and modification. This has been corroborated by addition of a fifth copper atom, giving rise to a pentacopper acetylide complex. This work may provide a new approach by which metal‐metal cooperativity can be exploited in the transformation of acetylide and diyne groups to a variety of substrates, or as a starting point for the controlled synthesis of copper(I) alkyne‐containing clusters.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2020

Restoring Distribution System Under Renewable Uncertainty Using Reinforcement Learning

Distributed energy resources (DERs) in distribution systems, including renewable generation, micro-turbine, and energy storage, can be used to restore critical loads following extreme events to increase grid resiliency. However, properly coordinating multiple DERs in the system for multi-step restoration process under renewable uncertainty and fuel availability is a complicated sequential optimal control problem. Due to its capability to handle system non-linearity and uncertainty, reinforcement learning (RL) stands out as a potentially powerful candidate in solving complex sequential control problems. Moreover, the offline training of RL provides excellent action readiness during online operation, making it suitable to problems such as load restoration, where in-time, correct and coordinated actions are needed. In this study, a distribution system prioritized load restoration based on a simplified single-bus system is studied: with imperfect renewable generation forecast, the performance of an RL controller is compared with that of a deterministic model predictive control (MPC). Our experiment results show that the RL controller is able to learn from experience, adapt to the imperfect forecast information and provide a more reliable restoration process when compared with the baseline controller.

61 RADIATION PROTECTION AND DOSIMETRY↗
DOE OSTI2020

Restoring Distribution System Under Renewable Uncertainty Using Reinforcement Learning: Preprint

Distributed energy resources (DER) in distribution systems, including renewable generation, micro-turbine, and energy storage, can be used to restore critical loads following extreme events to increase grid resiliency. However, properly coordinating multiple DERs in the system for multi-step restoration process under renewable uncertainty and fuel availability is a complicated sequential optimal control problem. Due to its capability to handle system non-linearity and uncertainty, reinforcement learning (RL) stands out as a potentially powerful candidate in solving complex sequential control problems. Moreover, the offline training of RL provides excellent action readiness during online operation, making it suitable to problems such as load restoration, where in-time, correct and coordinated actions are needed. In this study, a distribution system prioritized load restoration based on a simplified single-bus system is studied: with imperfect renewable generation forecast, the performance of an RL controller is compared with that of a deterministic model predictive control (MPC). Our experiment results show that the RL controller is able to learn from experience, adapt to the imperfect forecast information and provide a more reliable restoration process when compared with the baseline MPC controller.

61 RADIATION PROTECTION AND DOSIMETRY↗
DOE OSTI2021

Restoring Distribution System Under Renewable Uncertainty Using Reinforcement Learning

Distributed energy resources (DER) in distribution systems, including renewable generation, micro-turbine, and energy storage, can be used to restore critical loads following extreme events to increase grid resiliency. However, properly coordinating multiple DERs in the system for multi-step restoration process under renewable uncertainty and fuel availability is a complicated sequential optimal control problem. Due to its capability to handle system non-linearity and uncertainty, reinforcement learning (RL) stands out as a potentially powerful candidate in solving complex sequential control problems. Moreover, the offline training of RL provides excellent action readiness during online operation, making it suitable to problems such as load restoration, where in-time, correct and coordinated actions are needed. In this study, a distribution system prioritized load restoration based on a simplified single-bus system is studied: with imperfect renewable generation forecast, the performance of an RL controller is compared with that of a deterministic model predictive control (MPC). Our experiment results show that the RL controller is able to learn from experience, adapt to the imperfect forecast information and provide a more reliable restoration process when compared with the baseline MPC controller.

61 RADIATION PROTECTION AND DOSIMETRY↗