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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 397 records · Page 22

CERES : a cryo-EM re-refinement system for continuous improvement of deposited models

The field of electron cryomicroscopy (cryo-EM) has advanced quickly in recent years as the result of numerous technological and methodological developments. This has led to an increase in the number of atomic structures determined using this method. Recently, several tools for the analysis of cryo-EM data and models have been developed within the Phenix software package, such as phenix.real_space_refine for the refinement of atomic models against real-space maps. Also, new validation metrics have been developed for low-resolution cryo-EM models. To understand the quality of deposited cryo-EM structures and how they might be improved, models deposited in the Protein Data Bank that have map resolutions of better than 5 Å were automatically re-refined using current versions of Phenix tools. The results are available on a publicly accessible web page (https://cci.lbl.gov/ceres). The implementation of a Cryo-EM Re-refinement System ( CERES ) for the improvement of models deposited in the wwPDB, and the results of the re-refinements, are described. Based on these results, contents are proposed for a `cryo-EM Table 1', which summarizes experimental details and validation metrics in a similar way to `Table 1' in crystallography. The consistent use of robust metrics for the evaluation of cryo-EM models and data should accompany every structure deposition and be reported in scientific publications.

59 BASIC BIOLOGICAL SCIENCES↗

ALTRIOS (Advanced Locomotive Technology and Rail Infrastructure Optimization System) [SWR-22-54]

The Advanced Locomotive Technology and Rail Infrastructure Optimization System (ALTRIOS) is a unique, fully integrated, open-source software tool to evaluate strategies for deploying advanced locomotive technologies and associated infrastructure for cost-effective decarbonization. ALTRIOS simulates freight-demand driven train scheduling, mainline meet-pass planning, locomotive dynamics, train dynamics, energy conversion efficiencies, and energy storage dynamics of line-haul train operations. Because new locomotives represent a significant long-term capital investment and new technologies must be thoroughly demonstrated before deployment, this tool provides guidance on the risk/reward tradeoffs of different technology rollout strategies. An open, integrated simulation tool is invaluable for identifying future research needs and making decisions on technology development, routes, and train selection. ALTRIOS was developed as part of a collaborative effort by a team comprising the National Renewable Energy Laboratory (NREL), University of Illinois Urbana-Champaign (UIUC), Southwest Research Institute (SwRI), and BNSF Railway. Python Package: https://pypi.org/project/altrios/ Rust Crate: https://crates.io/crates/altrios-core

Baker, Chad↗

H2gen.jl

SAND2026-22943O H2Gen.jl is a Julia software package for hydrogen conversion modeling. It provides lightweight static and dynamic calculations for electrolyzer operation from electricity to hydrogen and fuel-cell operation from hydrogen to electricity. Sandia National Laboratories is a multimission laboratory managed and operated by National Technology & Engineering Solutions of Sandia, LLC, a wholly owned subsidiary of Honeywell International Inc., for the U.S. Department of Energy’s National Nuclear Security Administration under contract DE-NA0003525.

Michelen Strofer, Carlos [Sandia National Lab. (SN↗

Pushing the Limits of Micro battery Capacity and Energy

Micro battery with higher energy density will extend the service life of the miniature sensors so that the scientists and engineers could be able to collect more data along with the time in ecological and environmental vectors, such as animal tracking. Within this project, a completely new cell design (Gen2) for micro batteries to further increase their cell capacity and energy is developed. The new cell design directly packages the active material in a hard aluminum case, decreasing the percentage of non-active components. The manufacturing process to improve wetting ability is studied and the trial run is finally given to evaluate the feasibility of the proposed technology. It’s found that both the capacity and energy with same battery size could be increased by 30% comparing with Gen1 micro battery technology previously developed by PNNL. The yield of Gen2 micro batteries is still lower due to the high degree of manual operation, especially for drilling process where more precise position control is needed. More effort is still required to improve the capability of automatic manufacturing processes. The new battery technology will support the development of smaller and lighter miniature sensors at PNNL and could potentially contribute to the large-scale manufacturing capabilities of micro batteries in US with reliable performances and long-term shelf life.

25 ENERGY STORAGE↗

Feasibility Studies and Downselection of New Materials and Manufacturing Technologies for Nuclear Applications

This report is intended to present the results of multi-laboratory collaborative studies on the feasibility and downselection of the structural materials that are newly considered for application to future nuclear energy technologies. The Advanced Materials and Manufacturing Techniques (AMMT) program has been implemented to develop cross-cutting technologies in support of a broad range of nuclear reactor technologies and to maintain U.S. leadership in materials and manufacturing technologies for nuclear energy applications. In line with these program objectives, this collaborative studies aim to explore new materials utilizing advanced manufacturing technologies. The FY23 research scope consists of the feasibility studies on new materials and relevant advanced manufacturing technologies, collection of materials properties data and knowledge through experiments and literature survey, and development and application of decision criteria matrix for downselecting candidate materials and manufacturing technologies. The three-laboratory efforts for FY23 have focused on the three new material groups including oxide dispersion strengthened (ODS) materials, refractory composites and alloys, and high entropy alloys (HEAs) investigated, respectively, by Oak Ridge National Laboratory (ORNL) (work package: CT-23OR130406), Los Alamos National Laboratory (LANL) (CT-23LA130403) and Pacific Northwest National Laboratory (PNNL) (CT-23PN130408). The execution of this multi-lab research aimed to provide the AMMT program a merit-based feasibility study identifying an accelerated development path for these materials. A collaborative approach for achieving this goal was to develop a common materials evaluation criteria matrix and apply to all new candidate materials for the evaluation and prioritization of new materials using advanced manufacturing processes. The decision criteria matrix created is a matrix of criteria which a prospective material is scored against. The evaluation criteria are divided into four categories: Application Space, Environmental Compatibility, Physical & Mechanical Properties, and Manufacturability. Materials are given a score from 1−5 for each criterion, with the highest score (5) essentially mean that a material has the most near-term potential for application. Application of the decision criteria matrix will provide guidance to the future research on new materials.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

Initial Temperature Testing of Advanced Manufactured Melt Wire Package

As a part of the In-Pile Instrumentation Program, The Idaho National Laboratory (INL) has recently established in-house capabilities to fabricate and test new advanced manufactured sensors for measuring the peak irradiation temperature inside a nuclear test reactor. Although nuclear test reactors can use standard methods of real-time temperature monitoring, such as thermocouples, the complexity of feedthroughs and attachment complications to collect real-time measurements greatly increases the cost of the experiment. Passive monitoring techniques may be utilized that exploit the melting point of well characterized material (standard melt wires), however, the limited space available for instrumentation during experiments is also a challenge. To accommodate the challenge, INL has expanded its temperature detection instrumentation capabilities paired with the advancement of in-house advanced manufacturing options to include printed melt wires for peak irradiation temperature measurement. The advanced manufactured melt wire package can determine peak temperatures in experiments that can fit the challenging space available during irradiation. Recent results and knowledge from this ongoing work have made it possible to develop unique temperature sensors that can accomplish user specific temperature ranges inside the harsh environments experienced during radiation testing. This report summarizes the initial temperature testing using fabricated melt wires with two different melting temperatures, silver (melting temperature of ~960 °C) and solder (melting temperature of ~160 °C), that were initially tested for their relative melting points using non-standard method of furnace and hot plate testing under normal air conditions. Future work will include more controlled way of testing printed melt wires under inert gas with multiple temperature measurements followed by comparison of standard melt wire package performance for baseline characterization.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

Enabling groundbreaking experiments that advance our understanding of the universe through accurate target specifications

The Target Fabrication (TFAB) team at the National Ignition Facility (NIF) is tasked with assembling and qualifying targets for physics experiments. These targets are critical components used in experiments that advance research in areas such as fusion energy, high-energy-density physics, and astrophysics. Target Fabrication Engineers (TFEs) are responsible for producing and validating target specifications, which are compiled into detailed specification packages. TFAB produces hundreds of targets annually, with each target requiring several specification datasheets that culminate in a comprehensive specification package. TFAB needs an efficient and accurate means to generate these specification datasheets to maintain the rigorous NIF shot schedule.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

New Enzymes for Plastics Recycling from Biosensor-Guided Evolution and Machine Learning: Cooperative Research and Development Final Report, CRADA Number CRD-23-24335

The Agile BioFoundry (ABF) is a consortium of national laboratories dedicated to accelerating biomanufacturing and enabling the bioeconomy. The ABF operates a flexible biotechnology platform that can adjust to the needs of numerous government, academic, and industrial partners, thus enabling them to rapidly develop and optimize the production of a wide range of bioproducts. In this project, the ABF partnered with Birch Biosciences, Inc. to use ABF technology to assist in the development of high-performance enzymes that enable circular, sustainable recycling of poly(ethylene terephthalate) (PET) plastics. A primary goal of this project is to enable cost-effective, high yield, sustainable recycling of PET plastic packaging products.

09 BIOMASS FUELS↗

sCO2 heat exchanger control software

SAND2022-6992 O The sCO2 Heat Exchanger Control Software was written for control and operation of high temperature, high pressure supercritical CO2 systems designed for use as heat exchangers. The software was written using the basic LabVIEW package with LabVIEW modules added to it. The software controls valves and actuators, displays data from pressure transducers and thermocouples, and is able to record data at different storage rates. Sandia National Laboratories is a multimission laboratory managed and operated by National Technology & Engineering Solutions of Sandia, LLC, a wholly owned subsidiary of Honeywell International Inc., for the U.S. Department of Energy’s National Nuclear Security Administration under contract DE-NA0003525.

Garcia Maldonado, Luis↗

Powering Post-COVID-19 Resilient Recovery with Green Stimulus

As the coronavirus disease (COVID-19) pandemic spread globally in early 2020, many governments enacted lockdown measures as an initial containment response. These lockdowns, while effective in slowing infection rates, have also had substantial economic consequences. A series of supply and demand shocks, workforce and supply chain disruptions, and other impacts of the pandemic and ensuing lockdowns have upended the livelihoods for much of the world's population. This quick read spotlights how green stimulus plans and other recovery measures can support near-term recovery and enable longer-term power system resilience against future threats. The term “green stimulus” encompasses fiscal measures (i.e., governmental tax and spending actions) that support short-term economic activity that enhances environmental and natural resource quality over a longer term. The deployment of energy efficiency (EE) and renewable energy (RE) technologies, as well as associated initiatives (e.g., grid modernization, electrification of transport, and so on) have been demonstrably effective in providing this kind of short-run economic boost while simultaneously strengthening the resilience of the power sector. Along with green stimulus packages, concurrent action on the regulatory side—for example, the development of green building codes, updating grid interconnection standards, creating programs and marketplaces for demand-side efficiency, and others—can be a force multiplier in ensuring that public spending achieves maximum impact in near-term recovery and long-term power sector transformation

29 ENERGY PLANNING, POLICY, AND ECONOMY↗

Retro-Commissioning Sensor Suitcase for Energy Efficiency

This project will enable Pacific Northwest National Laboratory (PNNL) and Lawrence Berkeley National Laboratory (LBNL) to work with industry partner, GreenPath Energy Solutions, joint developers of the Suitcase, to enhance the capabilities and usability of the Retro-Commissioning Sensor Suitcase (hereinafter the Sensor Suitcase or Suitcase), assisting GreenPath to take the Suitcase to market and rapidly expand their market share. The proposed project will specifically focus on 1) adding sensors types to extend the data collection capability and support more building and equipment performance metrics and identification of even more energy saving opportunities, 2) developing algorithms to identify recommendations for the new energy savings opportunities from item 1 and to prototype software modifications implementing them, 3) validating the use of vibration sensors to detect the operating state of a broader set of packaged HVAC equipment (additional capacities, different numbers of stages, etc.) than tested in initial development and modifying the state algorithm and software code, as needed, 4) improving cost-effectiveness in manufacturing the Sensor Suitcase, and 5) additional field testing of the technology in real buildings to more comprehensively validate Suitcase performance and to guide refinement of its capabilities. Project results will position GreenPath, and potential future licensees, to implement the new capabilities developed in this project in GreenPath’s RCx Building Suitcase, increasing its functionality and the savings resulting from its use. These enhancements will increase the value of the Suitcase to users and increase the potential market for its use and impacts in that impact.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

GRIDCERF - Geospatial Raster Input Data for Capacity Expansion Regional Feasibility

The Geospatial Raster Input Data for Capacity Expansion Regional Feasibility (GRIDCERF) data package is a high-resolution product to evaluate siting suitability for renewable and non-renewable power plants in the conterminous United States. GRIDCERF offers hundreds of individual suitability layers for use with both renewable and non-renewable power plant technology configurations in a harmonized format that can be easily ingested by geospatially-enabled modeling software. It also provides pre-compiled technology-specific suitability layers and allows for user customization to robustly address science objectives when evaluating varying future conditions. GRIDCERF data can be directly used with the CERF (Capacity Expansion Regional Feasibility) model to site power plants at a 1km resolution. GRIDCERF includes composite technology siting suitability raster layers for the following utility scale technology configurations. Note that, in addition to technology sub-types shown below, various cooling types are also included (recirculating, pond, once-through, recirculating-seawater, dry-hybrid, or dry) for various technologies. Biomass Conventional (with or without CCS) IGCC (with or without CCS) Coal Conventional (with or without CCS) IGCC (with or without CCS) Natural Gas Combined-cycle (CC) (with or without CCS) Turbine Geothermal Enhanced Geothermal Systems (EGS) - Class 1 through Class 5 resource potential Nuclear Gen 2 Light Water Reactor (LWR) Gen 3 Small Modular Reactor (SMR) Gen 3 AP1000 Refined Liquids Combined-cycle (CC) (with or without CCS) Turbine Solar Photovoltaic (PV) - for capacity factors in the range of 6-18% Utility-scale Concentrating Solar Power (CSP) - for capacity factors in the range of 24-46% Tower Wind (Onshore) - for capacity factors in the range of 5-50% 80m hub height 100m hub height 120m hub height 140m hub height Wind (Offshore) - for capacity factors in the range of 25-60% 100m hub height 140m hub height 160m hub height

capacity expansion↗

GRIDCERF - Geospatial Raster Input Data for Capacity Expansion Regional Feasibility

The Geospatial Raster Input Data for Capacity Expansion Regional Feasibility (GRIDCERF) data package is a high-resolution product to evaluate siting suitability for renewable and non-renewable power plants in the conterminous United States. GRIDCERF offers hundreds of individual suitability layers for use with both renewable and non-renewable power plant technology configurations in a harmonized format that can be easily ingested by geospatially-enabled modeling software. It also provides pre-compiled technology-specific suitability layers and allows for user customization to robustly address science objectives when evaluating varying future conditions. GRIDCERF data can be directly used with the CERF (Capacity Expansion Regional Feasibility) model to site power plants at a 1km resolution. GRIDCERF includes composite technology siting suitability raster layers for the following utility scale technology configurations. Note that, in addition to technology sub-types shown below, various cooling types are also included (recirculating, pond, once-through, recirculating-seawater, dry-hybrid, or dry) for various technologies. Biomass Conventional (with or without CCS) IGCC (with or without CCS) Coal Conventional (with or without CCS) IGCC (with or without CCS) Natural Gas Combined-cycle (CC) (with or without CCS) Turbine Geothermal Enhanced Geothermal Systems (EGS) - Class 1 through Class 5 resource potential Nuclear Gen 2 Light Water Reactor (LWR) Gen 3 Small Modular Reactor (SMR) Gen 3 AP1000 Refined Liquids Combined-cycle (CC) (with or without CCS) Turbine Solar Photovoltaic (PV) - for capacity factors in the range of 6-18% Utility-scale Concentrating Solar Power (CSP) - for capacity factors in the range of 24-46% Tower Wind (Onshore) - for capacity factors in the range of 5-50% 80m hub height 100m hub height 120m hub height 140m hub height Wind (Offshore) - for capacity factors in the range of 25-60% 100m hub height 140m hub height 160m hub height

capacity expansion↗

Weapon Material Program: FY24 Annual Report

The Weapon Material Program (WMP) framework was started in July of Fiscal Year (FY) 2022, along with other Mission Support organizations. The first year was about building the organization with the right people, identifying needs, and developing a vision for expectations. It was also a year to move forward with new equipment and technology for weapon material processes. With numerous improvements, WMP is building world-class systems for production, warehousing, and analytical testing. FY 2023 was a year of development. The WMP was a new organization defining its identity, its focus, and its mission. At the end of FY 2023, WMP evaluated its current position and its immediate needs along with its future goals. The entire organization set out on this FY 2024 journey to success. The lack of funding, staffing, and visibility dramatically impacted weapon material operations, testing, and qualifications. This neglect required numerous areas to be addressed and improvement plans to be developed and implemented. WMP processes, procedures, and overall business operations were dramatically in need of updating, revision, and formal documentation. This included all areas: technology, equipment, facility modifications/upgrades, and testing improvements. To ensure organizational improvement and forward momentum in FY 2024, WMP executed a multi-faceted strategic vision. Action items included the following: • Filling open positions with capable personnel who would contribute to a more robust organization • Establishing more formal operations and problem-solving techniques • Improving departmental procedures to align with expanding scope • Improving training • Establishing collaboration meetings with other departments/organizations • Focusing on the importance of identifying and mitigating concerns with At-Risk Materials (@RM) • Leading modernization eff orts for Blending and Packaging (B&P) We are on the verge of a transformational improvement in all of our processes in support of the mission. The following area achievements outlined in this report reflect the hard work toward achieving the goal of “being the material Subject Matter Experts in the nuclear enterprise”.

45 MILITARY TECHNOLOGY, WEAPONRY, AND NATIONAL DEF↗

Natural fibers as promising core materials of vacuum insulation panels

To reduce energy consumption in buildings, this paper investigates the feasibility of using natural fibers as cost-effective, environmentally sustainable core materials for vacuum insulation panels (VIPs). First, a comprehensive experimental study was conducted for 10 potential natural fiber candidates. The thermal conductivities of the 10 natural fiber mats at various vacuum pressures were measured; their compression and morphology properties were quantified. In addition, an analytical model was used to explore the major factors that influence the thermal conductivity of natural fibers as a function of internal air pressure. Results show that recycled cotton, kapok, and bamboo fibers are ideal candidates for VIP core materials; at <0.05 Pa, their thermal conductivities varied between 2 and 4 mW/(m∙K). Furthermore, for some fibers, thermal conductivity was inversely proportional to fiber density. For the selection of fiber materials for VIP cores, the ideal fiber candidate has a small fiber diameter and a low fiber mat density. Based on thermal measurements, even though the internal air pressure of 5 Pa was enough to attain the minimum thermal conductivity, obtaining internal air pressure below 5 Pa is recommended for prolonged service life, considering small leaks of VIP package barrier films and potential off-gassing from fibers. The simulation results predicting the effective thermal conductivities matched the experimental results well. These findings indicate that natural fiber–based VIPs have the potential to be a sustainable, inexpensive alternative to the current technologies in building insulation materials.

36 MATERIALS SCIENCE↗

Investigating the Role of Acid Sites in the Hydrocracking of Polyethylene-EVOH Multilayer Film Waste over Pt/BEA Catalyst

Multilayer polymer films (MFs) containing poly(ethylene-co-vinyl alcohol) (EVOH) and polyolefins are ubiquitous in single-use food and medical packaging. MFs are currently landfilled or incinerated rather than mechanically recycled because of the processing difficulties associated with their form factor and complex multicomponent structures. Advanced chemical recycling is a promising solution. Prior reports have explored hydrogenolysis and hydrodeoxygenation to convert EVOH, but these technologies are limited by catalyst deactivation and slow apparent kinetics, respectively. Alternatively, in this work, we demonstrate the efficient hydrocracking of commercial MFs into naphtha range (C5-C12) alkanes over platinum (Pt) supported on acidic zeolites. Mixtures of low-density polyethylene (LDPE) and EVOH are utilized as MF surrogates to gain fundamental insights. Pt deposited on BEA supports with varying Lewis acid site (LAS) concentrations are synthesized and tested for hydrocracking. Surprisingly, Pt/BEA with high LAS concentrations demonstrate improved activity for LPDE/EVOH blends over LDPE alone. In contrast, LAS concentrations are shown to have no influence on LDPE hydrocracking. LAS and Brønsted acid sites (BAS) catalyze the dehydration of EVOH to form water, which improves LDPE hydrocracking. Polyaromatics formed primarily via EVOH thermal degradation lead to detrimental coke formation, which hinders hydrocracking activity. Reaction conditions and feed ratios of LDPE and EVOH are tuned to balance these competing effects. Reusability tests demonstrate that Pt/BEA maintains high activity (81% conversion in 2 h) and high selectivity towards naphtha (78%) over multiple reuse cycles. Furthermore, these findings position hydrocracking as a promising technology for the circularity of complex MF plastic waste.

36 MATERIALS SCIENCE↗

PowerConverterDynamics.jl

SAND2026-22944O PowerConverterDynamics.jl is a Julia software package for differentiable DC power-conversion dynamics. It models a variable DC source, power converter, common DC bus, and battery module with current, voltage, loss, and state-of-charge dynamics. Sandia National Laboratories is a multimission laboratory managed and operated by National Technology & Engineering Solutions of Sandia, LLC, a wholly owned subsidiary of Honeywell International Inc., for the U.S. Department of Energy’s National Nuclear Security Administration under contract DE-NA0003525.

Michelen Strofer, Carlos [Sandia National Lab. (SN↗