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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 973 records · Page 54

Electroelastic investigation of drying rate in the direct contact ultrasonic fabric dewatering process

Ultrasonic vibrations, used to atomize liquids into a fine mist, are a promising solution for the future of efficient clothes drying technology. The world’s first ultrasonic dryer—demonstrated by researchers at Oak Ridge National Laboratory—successfully applies the scientific principles behind ultrasonic drying, and several working prototypes have been demonstrated. This technology is based on direct mechanical coupling between mesh piezoelectric transducers and wet fabric. During the atomization process, vertical oscillations of a contained liquid, called Faraday excitations, result in the formation of standing waves on the liquid surface. At increasing amplitudes and frequencies of oscillation, wave peaks become extended and form “necks” connecting small secondary droplets to the bulk liquid. When the oscillation reaches an acceleration threshold, the droplet momentum is sufficient to break the surface tension of the neck and enable the droplets to travel away from the liquid. In this work, we investigate the atomization process using an ultrasonic transducer as it pertains to moisture retained within a fabric. An experimentally validated electromechanical analytical-numerical model is proposed. This model bridges the vibrations of a piezoelectric mesh transducer to the critical acceleration needed for fabric drying to occur. Then, the drying rate model is developed, consisting of an initial nonlinear region due to atomization, followed by a linear thermal evaporation region. The models developed identify the influence of key parameters on ultrasonic drying and will aid in improving atomizer design for efficient, timely fabric drying. This study is the first proposed model for the ultrasonic atomization of fabrics saturated with water, applicable to any type of transducer. The results present a non-dimensional equation for the ultrasonic dewatering of fabrics, dependent only on transducer acceleration and the surface area of the cloth. Furthermore, the development of this technology using the proposed physical models will allow for global reductions in electrical demand related to clothes drying.

42 ENGINEERING↗

Scaling methodologies and similarity analysis for thermal hydraulics test facility development for water-cooled small modular reactor

Small modular reactors (SMRs) represent a promising option for providing clean and sustainable energy due to their potential for enhanced safety, reduced capital costs, and increased siting flexibility. However, new reactor systems require the development and operation of representative scaled-down test facilities to support the verification and validation of system computer codes and models. Here this study reviews the research on scaling methodologies and similarity principles pivotal in developing non-nuclear integral effects test and separate effects test facilities for water-cooled SMRs. The study focuses on a review of the scaling methods, similarity approaches, and possible challenges posed by the unique and compact design features of integral-pressurized water reactor-type SMRs, and their representative test facilities. This study also reviews previous research related to scaling and similarity methodologies and provides insights into design considerations for achieving prototypic conditions in test facilities. The findings and recommendations emphasize the broader impact of appropriate scaling and similarity principles to ensure meaningful and transferable results from non-nuclear test facilities to accelerate the safe and efficient deployment of next-generation water-cooled SMRs.

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗

An Accelerated Approach for Computationally Efficient Evaluation of Deflagration Time During Abnormal Thermal Events

The challenges of modeling abnormal thermal events for explosives of interest to LLNL can be simplified by an accelerated approach to calculate Prout-Tompkins (P-T) parameters describing autocatalytic deflagration. Rather than depending on detailed modeling in multiphysics codes that include chemical reactivity (e.g. ALE3D), the accelerated approach can calculate P-T parameters based solely on experimental time of deflagration measurements for the explosive of interest. We compare deflagration time for five explosives with previously known P-T parameters at conditions typical of abnormal thermal events and demonstrate that the accelerated approach produces deflagration predictions with a maximum error of 3% and an average error of 1.7%. While the accelerated approach may not be applicable to all experimental conditions, it holds promise of rapid derivation of P-T parameters for accurate modeling of abnormal thermal events of interest to LLNL.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Magnetic Microcalorimeter Gamma Detectors with Ultra-High Energy Resolution - (Final Report)

The goal of this project was to build a commercially viable magnetic microcalorimeter (MMC) γ-spectrometer with an ultra-high energy resolution <50 eV for accurate non-destructive assay (NDA) of nuclear materials. Improved NDA simplifies and accelerates safeguards analyses in the nuclear fuel cycle and enhances capabilities to detect the diversion of nuclear materials for illicit purposes. High-resolution MMC γ-spectrometers can also improve the accuracy of nuclear data that NDA is based on.

42 ENGINEERING↗

Accelerating Nuclear-Integrated Data Centers in the USA: SWOT Analysis, Power-Thermal Management Strategies, and Industrial-Scale Demonstration and Potential Deployment

Driven by the growth in digital services, cloud computing, AI, and manufacturing, data centers face rising energy demands that challenge traditional power sources and cooling efficiency. This study explores using nuclear power to meet these demands, focusing on accelerated reactor technology deployment and highlighting needs such as N+1/N+2 power supplies and integrated power-thermal management. A SWOT analysis addresses grid connectivity, reactors, and site selection, particularly DOE sites. Reactor technology demonstration and deployment could be accelerated by leveraging test facilities such as MARVEL, MAGNET, TED, FAS, DOME, LOTUS, ATR, Energy System Proving Grounds, and upcoming Energy Launch Pads, along with modeling and simulation tools such as RELAP5, MOOSE, VERA, RAVEN, and FORCE. The potential power and thermal management options, including various cooling technologies, waste-heat utilization, and an industrial-scale demonstration plan, aim to accelerate the integration of nuclear power and data centers in the USA, while emphasizing community and stakeholder engagement and synergistic efforts.

21 - SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLAN↗

ASME Code Qualification Plan for LPBF 316 SS

This report describes a plan to qualify laser powder bed fusion (LPBF) 316 stainless steel for use with the American Society of Mechanical Engineers (ASME) Boiler & Pressure Vessel Code Section III, Division 5 rules for metallic components in high temperature nuclear reactors. Accomplishing this goal would make the material and manufacturing process available to vendors for inclusion in the next generation of advanced, high temperature reactors. The general approach adopted here is to treat LPBF 316 as if it was a completely new material and to develop a plan to qualify the material according to the current ASME practices. One key goal of this work is to explore and develop accelerated qualification approaches that might reduce the time required to qualify new materials by reducing the need for long term testing. However, the qualification plan here does not employ any accelerated qualification approaches to provide a limiting, bounding description of the number, duration, and types of testing required to qualify LPBF 316 without such techniques and to describe a comprehensive dataset that could be used to explore and validate accelerated qualification approaches in the future. The report addresses the fundamental challenges to qualifying Advanced Manufacturing (AM) materials for high temperature applications and summarizes the ASME Section III qualification process as well as current efforts to qualify LBPF and DED 316 for low temperature applications. The report then discusses specific issues, both material and logistical, related to qualifying PBF 316 steel. The final chapters of the report describe a complete test plan designed to generate sufficient data to qualify the material as well as a data management plan for how to store and manage the data to eventually provide the test data packaged needed to qualify the material with ASME.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

A methodology for decay heat characterization in molten salt reactors

Accurate decay heat prediction in molten salt reactors (MSRs) faces dual challenges: complex operational uncertainties and the need for interpretable models compatible with engineering workflows. This work presents a hybrid machine learning and segmented polynomial methodology that addresses both requirements through three key innovations. First, a modular data architecture encodes MSR-specific operational parameters (power density: 1-100 W cm -3 , humidity: 0-0.1 wt %, air ingress: 0-0.1 mol %) with uncertainty-aware temporal discretization spanning 15 orders of magnitude. Second, region-optimized machine learning models achieve 92.3 % root mean square error (RMSE) reduction over conventional polynomials while maintaining physical interpretability through automated piecewise equation generation. Third, dual front-end interfaces accelerate safety analyses — a Jupyter environment enables researchers to explore 10,000+ parameter combinations via interactive widgets, while a Streamlit web application reduces design iteration cycles through production-grade visualization tools. Operational deployment demonstrates prediction times of only a couple hundred milliseconds for 10 4 years decay profiles, enabling real-time optimization of spent fuel container designs.

42 - ENGINEERING↗

Charting the state of GEMs in microalgae: progress, challenges, and innovations

Genome-scale metabolic models (GEMs) provide a systems-level framework for understanding and engineering microalgal metabolism. This review explores the evolution of GEMs in microalgae, highlighting advances in light modeling, automation, and multi-omics integration. Special emphasis is placed on Chlamydomonas reinhardtii as a model species. Limitations of current models, particularly for microalgae, are discussed, alongside promising developments in dynamic modeling and machine learning. Together, these innovations chart a path toward more predictive, adaptable GEMs that can accelerate biotechnological applications of microalgae in sustainable production systems.

Plant Sciences↗

aphBO-2GP-3B: a budgeted asynchronous parallel multi-acquisition functions for constrained Bayesian optimization on high-performing computing architecture

High-fidelity complex engineering simulations are often predictive, but also computationally expensive and often require substantial computational efforts. The mitigation of computational burden is usually enabled through parallelism in high-performance cluster (HPC) architecture. Optimization problems associated with these applications is a challenging problem due to the high computational cost of the high-fidelity simulations. In this paper, an asynchronous parallel constrained Bayesian optimization method is proposed to efficiently solve the computationally expensive simulation-based optimization problems on the HPC platform, with a budgeted computational resource, where the maximum number of simulations is a constant. The advantage of this method are three-fold. Firstly, the efficiency of the Bayesian optimization is improved, where multiple input locations are evaluated parallel in an asynchronous manner to accelerate the optimization convergence with respect to physical runtime. This efficiency feature is further improved so that when each of the inputs is finished, another input is queried without waiting for the whole batch to complete. Second, the proposed method can handle both known and unknown constraints. Third, the proposed method samples several acquisition functions based on their rewards using a modified GP-Hedge scheme. The proposed framework is termed aphBO-2GP-3B, which means asynchronous parallel hedge Bayesian optimization with two Gaussian processes and three batches. The numerical performance of the proposed framework aphBO-2GP-3B is comprehensively benchmarked using 16 numerical examples, compared against other 6 parallel Bayesian optimization variants and 1 parallel Monte Carlo as a baseline, and demonstrated using two real-world high-fidelity expensive industrial applications. The first engineering application is based on finite element analysis (FEA) and the second one is based on computational fluid dynamics (CFD) simulations.

97 MATHEMATICS AND COMPUTING↗

Unique Facilities, Innovative Treatment Processes, and a Talented Workforce Allow Fluor Idaho to Successfully Disposition Transuranic Waste - 18388

Fluor Idaho is utilizing state-of-the-art equipment, treatment technologies, and employee expertise at the Department of Energy's (DOE) Idaho Site to treat contact-handled transuranic (CH-TRU) waste, as well as extremely challenging remote-handled transuranic (RH-TRU) waste forms, to prepare the material for shipment and permanent disposal at the Department's Waste Isolation Pilot Plant (WIPP). Nowhere else in the DOE Complex - perhaps the world - will one find the compilation of tools and an experienced workforce with an unparalleled history of safely retrieving, characterizing, treating, repackaging, certifying, and shipping TRU waste. Since 2003, the Advanced Mixed Waste Treatment Project (AMWTP) has used both conventional and unique retrieval concepts, high-tech characterization equipment - including real-time radiography and radioassay - robotics, and automated treatment processes to retrieve and treat 65,000 cubic meters of above-ground CH-TRU waste. Additionally, engineered controls and specialized personal protective equipment have allowed employees to make thousands of entries into high-radiation areas without a skin or clothing contamination incident - evidence of the employees' commitment to safety. AMWTP has encountered and found solutions for many challenging waste forms, including polychlorinated biphenyl-contaminated wastes, TRU waste containers with up to 1,000 fissile gram equivalent plutonium-239, oversized TRU boxes, and partially absorbed organic sludge waste. By utilizing additional facilities and equipment at the Accelerated Retrieval Project V and VII, Fluor Idaho has developed new processing lines and capabilities to ensure worker safety and milestone completion. These two soft-sided buildings, located at a facility adjacent to AMWTP, were originally constructed to exhume Comprehensive Environmental Response, Compensation and Liability Act (CERCLA) TRU wastes from a section of a 97-acre landfill. After a total of 1,150 cubic meters of targeted waste were removed, personnel, working in collaboration with state regulators, successfully implemented a unique regulatory strategy that allowed these CERCLA facilities to be modified and permitted to treat Resource Conservation and Recovery Act (RCRA) wastes from the AMWTP - a savings of tens of millions of dollars over the cost of constructing new buildings. Adding to the AMWTP's technological uniqueness is its ability to treat wastes from other facilities in the DOE Complex. Two prior decision documents and an agreement with the state of Idaho have allowed AMWTP to treat wastes from 15 other DOE sites. It is the only project in the complex to have done so. At another project located next to AMWTP, targeted waste exhumation within the Subsurface Disposal Area is approximately two years ahead of schedule. Crews have removed more than 8,600 cubic meters of CH-TRU and hazardous wastes from eight exhumation areas that equal a combined footprint of 4.75 acres. Less than one acre remains to be exhumed to satisfy the 2008 Record of Decision waste exhumation end state between the DOE, Environmental Protection Agency, and state of Idaho. Construction of the final building where targeted waste exhumation will continue was completed during the summer of 2017. Exhumation will be completed within the next few years. Following exhumation completion, an evapotranspiration barrier (or cap) will be constructed over the entire landfill. Fluor Idaho continues to make progress on a more challenging project involving an inventory of RH-TRU waste that also contains the reactive metal sodium. Crews are utilizing hot cells, once used for spent nuclear fuel reprocessing and high-level waste treatment at the Idaho Nuclear Technology and Engineering Center, to render this challenging waste form safe for disposal in a national geologic waste repository. The treatment methods being employed on this RH-TRU waste are unique in the DOE Complex. Minute concentrations of water are sprayed onto the sodium-contaminated material in a process called 'spritzing' to chemically change the sodium from a reactive metal to a non-reactive salt. In other cases, sodium-contaminated waste is dipped in water to initiate a reaction in a process called 'immersion.' Lastly, for more challenging waste shapes that could not be successfully treated with the two prior methods, crews lower the sodium-contaminated RH-TRU waste into a one-of-a-kind distillation unit that uses high temperature and vacuum to volatilize the sodium and recapture it in a condenser unit for disposal. The RH-TRU waste treated with this technology is then safe for permanent disposal. Fluor Idaho is proud to operate DOE's CH- and RH-TRU waste treatment facilities, as well as use innovative processes and its talented workforce to complete this important work-scope. Such capabilities allow the contractor to meet the commitments made by the DOE to the state of Idaho. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

Identifying Dense NiSe 2 /CoSe 2 Heterointerfaces Coupled with Surface High-Valence Bimetallic Sites for Synergistically Enhanced Oxygen Electrocatalysis

Constructing heterostructures with abundant interfaces is essential for integrating the multiple functionalities in single entities. Herein, the synthesis of NiSe 2 /CoSe 2 heterostructures with different interfacial densities via an innovative strategy of successive ion injection is reported. The resulting hybrid electrocatalyst with dense heterointerfaces exhibits superior electrocatalytic properties in an alkaline electrolyte, superior to other benchmarks and precious metal catalysts. Advanced synchrotron techniques, post structural characterizations, and density functional theory (DFT) simulations reveal that the introduction of atomic-level interfaces can lower the oxidation overpotential of bimetallic Ni and Co active sites (whereas Ni$^{2+}$ can be more easily activated than Co$^{2+}$) and induce the electronic interaction between the core selenides and surface in situ generated oxides/hydroxides, which play a critical role in synergistically reducing energetic barriers and accelerating reaction kinetics for catalyzing the oxygen evolution. Hence, the heterointerface structure facilitates the catalytic performance enhancement via increasing the intrinsic reactivity of metallic atoms and enhancing the synergistic effect between the inner selenides and surface oxidation species. This work not only complements the understanding on the origins of the activity of electrocatalysts based on metal selenides, but also sheds light on further surface and interfacial engineering of advanced hybrid materials.

36 MATERIALS SCIENCE↗

Coherent Strain-Inhibiting Phase Construction of Lithium-Rich Manganese-Based Oxide Toward High Mechanochemical Stability

A layered lithium-rich manganese-based oxide cathode, containing $R\overline{3}m$ (LiTMO 2 , TM = Mn, Ni, Co) and $C2/m$ (Li 2 MnO 3 ) nanodomains, utilizes both transition metals and oxygen redox to yield substantial energy density. However, the inherent heterogeneous nature and distinct nanodomain redox chemistries of layered lithium-rich oxides will inevitably cause pernicious lattice strain and structural displacement, which can hardly be eliminated by conventional doping or coating strategies and result in accelerated performance decay. Herein, we incorporate a strain-inhibiting perovskite phase coherently grown within the layered structure to effectively restrain the displacement and lattice strain during uneven Li-ion extraction. The enhanced mechanochemical stability of the designed cathode benefits the persistent structure and reversible oxygen redox, thereby achieving high initial Coulombic efficiency and stable cycling and voltage profiles. In conclusion, our approach of lattice engineering alleviates the strain and displacement caused by inhomogeneous reactivity between heterogeneous nanodomains and promotes the development of advanced cathode materials with long durability.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Machine learning overcomes human bias in the discovery of self-assembling peptides

Peptide materials have a wide array of functions, from tissue engineering and surface coatings to catalysis and sensing. Tuning the sequence of amino acids that comprise the peptide modulates peptide functionality, but a small increase in sequence length leads to a dramatic increase in the number of peptide candidates. Traditionally, peptide design is guided by human expertise and intuition and typically yields fewer than ten peptides per study, but these approaches are not easily scalable and are susceptible to human bias. Here, in this work, we introduce a machine learning workflow—AI-expert—that combines Monte Carlo tree search and random forest with molecular dynamics simulations to develop a fully autonomous computational search engine to discover peptide sequences with high potential for self-assembly. We demonstrate the efficacy of the AI-expert to efficiently search large spaces of tripeptides and pentapeptides. The predictability of AI-expert performs on par or better than our human experts and suggests several non-intuitive sequences with high self-assembly propensity, outlining its potential to overcome human bias and accelerate peptide discovery.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Anisotropic strength behavior of single-crystal TATB

High-rate strength behavior plays an important role in the shock initiation of high explosives, with plastic deformation serving to localize heat into hot spots and as a mechanochemical means to enhance reactivity. Recent simulations predict that detonation-like shocks produce highly reactive nanoscale shear bands in the layered crystalline explosive TATB (1,3,5-triamino-2,4,6-trinitrobenzene), but the thresholds leading to this response are poorly understood. We utilize molecular dynamics to simulate the high-rate compressive stress–strain response of TATB, with a focus on understanding flow behavior. Here, the dependence of strength on pressure and loading axis (crystal orientation) is explored. The deformation mechanisms fall broadly into two categories, with compression along crystal layers activating a buckling/twinning mode and compression normal to the layers producing nanoscale shear bands. Despite the complexity of the underlying mechanisms, the crystal exhibits relatively straightforward stress–strain curves. Most of the crystal orientations studied show rapid strain softening following the onset of yielding, which settles to a steady flow state. Trajectories are analyzed using five metrics for local states and structural order, but most of these metrics yield similar distributions for these deformation mechanisms. On the other hand, a recently proposed measure of intramolecular strain energy is found to most cleanly distinguish between these mechanisms, while also providing a plausible connection with mechanochemically accelerated decomposition kinetics. Localization of intramolecular strain energy is found to depend strongly on crystal orientation and pressure.

36 MATERIALS SCIENCE↗

STEPS: A Portable Numerical Simulation Toolkit for Electrical Power System Dynamic Studies

Numerical simulation is the key technique for large scale power system analysis. Redistribution of global renewable power via international interconnections requires new simulation tools to study the interconnected systems with different nominal frequencies as a whole. In this paper we introduce an open source simulation toolkit for electrical power systems (STEPS) which is hosted at Github. Its kernel is coded in C++ with major functions of power flow and electro-mechanical dynamic simulation. Flexible options are provided and configurable to improve power flow solution and dynamic simulation. Common devices and models are supported in STEPS for AC/DC hybrid system studies. Studies of interconnected systems with different nominal frequencies is supported in STEPS for research of international interconnection. Application program interfaces are provided and wrapped with Python to enable high-level interfaces for general applications. STEPS is thread safe and parallel computation is supported in both kernel and script levels to accelerate simulation. It is portable and works on Windows and GNU/Linux platforms. Cases from small to large scale systems are thoroughly tested to validate the toolkit with commercial packages as benchmarks.

42 ENGINEERING↗

Extending ORNL HPDM Capabilities for Design and Optimization of New Refrigerant Blends – FY19 1st Quarterly Milestone Report: Development of Heat Pump System Models (Space Heating) for HFO Blends

We recently published numerous heat pump system models at the HPDM website, in the category of “Space Heating”. The published system configurations include single-stage heat pumps using TXV for expansion or a short-tube fixed-orifice coupled with a suction line accumulator, a two-stage heat pump system putting two compressors in series, single state heat pump using two parallel compressors (tandem), vapor injection systems with a vapor injection compressor coupled with an intermediate economizer or a flash tank. These configurations should cover all the residential heat pump products on the market. Additionally, to accelerate the refrigerant transition and make thousands of existing compressor maps reusable by the new refrigerants, ORNL created a mathematical approach to scale typical vapor injection compressor maps, developed from one baseline refrigerant to be used by the new HFO refrigerants/blends.

42 ENGINEERING↗

Round 2 Update of Stress Testing Results for Organic Light-Emitting Diode Panels and Luminaires

Organic light-emitting diode (OLED) sources are a potential solid-state lighting technology for use in indoor lighting applications. Some of the advantages offered by OLEDs include thin profiles, low glare, diffuse lighting, and unique form factors. The U.S. Department of Energy (DOE) has released five reports about OLED technologies to provide information and analysis to the lighting industry. These reports include the evaluation of two different field deployment sites, a market analysis, and two independent assessments of the performance of select commercially available OLED products. This report builds on earlier DOE efforts with OLED technology by updating information about previously benchmarked OLED products (i.e., the Chalina luminaire from Acuity Brands and the Brite 2 and Brite Amber panels from OLEDWorks) in accelerated stress tests (ASTs). In addition, this report also provides an initial analysis of the performance of recently released OLED products—the Brite 3 panels from OLEDWorks.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗