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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 685 records · Page 38
All sourcesNASA NTRSDOE OSTI
DOE OSTI2026

Water-stable direct air capture of CO 2 with microcapsules of task-specific ionic liquid and their electrothermal regeneration

Microcapsules of the task specific ionic liquid (TSIL) 1-ethyl-3-methylimidazolium 2-cyanopyrrolide [EMIM][2CNpyr] with composite polydimethylsiloxane (PDMS) shells were fabricated for use in CO 2 direct air capture (DAC) conditions. The TSIL was encapsulated using an oil-in-oil emulsion as a templating procedure through two different approaches. In the first approach, a PDMS-polyurea (PU) shell was constructed by interfacial polymerization, while in the second approach, a graphene oxide (GO)-PDMS shell was constructed by cross-linking GO sheets. The composition and structure of both capsule types were fully characterized, and their CO 2 DAC performance was evaluated by gravimetric and breakthrough analysis. Both capsules exhibited competitive capacities, with the PDMS-PU capsules and the GO-PDMS capsules reaching 0.75 mol kg −1 and 0.66 mol kg −1 , respectively. We further demonstrate that both capsule systems can be regenerated with complementary electrothermal methods. Microwave (MW) regeneration was used for the PDMS-PU capsules, effectively releasing absorbed CO 2 in less than an hour. Owing to the electrical conductivity of GO, GO-PDMS capsules were regenerated via radio frequency heating (RF). This work highlights the importance and opportunity of tuning solid–liquid composite performance for advanced applications, including direct air capture of carbon dioxide.

Al-Mahbobi, Luma [Texas A&M University, College St↗
DOE OSTI2024

Molecular dynamics simulations of uranyl and plutonyl cations in a task-specific ionic liquid

Ionic liquids (ILs) are a unique class of solvents with potential applications in advanced separation technologies relevant to the nuclear industry. ILs are salts with low melting points and a wide range of tunable physical properties, such as viscosity, hydrophobiciy, conductivity, and liquidus range. ILs have negligible vapor pressure, are often non-flammable, and can have high thermal stability and a wide electrochemical window, making them attractive for use in separations processes relevant to the nuclear industry. Metal salts generally have a low solubility in ILs; however, by incorporating new functional groups into the IL cation or anion that promote complexation with the metal, the solubility can be greatly increased. One such task-specific ionic liquid (TSIL) is 1-carboxy-N, N, N-trimethylglycine bis(trifluoromethylsulfonyl)imide ([Hbet][Tf 2 N]). Water, which is detrimental for electrochemical separations, is a common impurity in ILs and can coordinate with actinyl cations, particularly in ILs containing only weakly coordinating components. Understanding the behavior of actinides in TSIL/water mixtures on a molecular level is vital for designing improved separations processes. Classical molecular dynamics simulations of uranyl(VI) and plutonyl(VI) in 1-ethyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide ([EMIM][Tf 2 N]) with deprotonated Hbet (betaine) and water have been performed to understand the coordination and dynamics of the actinyl cations. We find that betaine is a much stronger ligand than water and prefers to coordinate the metal in a bidentate manner. Potential of mean force simulations yield a relative free energy for betaine coordination of approximately -120 to -90 kJ/mol in mixtures with water. As the amount of betaine coordinated to the actinide increases, the diffusion coefficient of the actinyl cation decreases. Moreover, the betaine ligand is able to bridge between two metal centers, resulting in dimeric complexes with actinide–actinide distances of ~5 Å. Potential of mean force simulations show that these structures are stable, with relative free energies of up to -40 kJ/mol. The crystal structure for [(UO 2 ) 2 (bet) 6 (H 2 O) 2 ][Tf 2 N] 4 shows that the betaine bridges between two uranium atoms to form dimeric complexes similar to those found in our simulations.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2024

Lamellar: A Rust-based Asynchronous Tasking and PGAS Runtime for High Performance Computing

Cybersecurity is one of the largest concerns in modern computing, impacting and dictating how governments, private corporations, and individuals interact with and live in an increasingly digital world. The NSA has recently released a memo [ 1] on “Software Memory Safety” where they highlight that both Microsoft and Google have stated around 70% of software vulnerabilities were due to memory safety issues. Although languages such as C and C++ provide freedom and flexibility with memory management, guaran- teeing safety falls mostly on the developer. The NSA recommends using “memory safe” languages whenever possible. In this paper we introduce Lamellar, an asynchronous tasking and PGAS HPC runtime written in Rust, one such "memory safe" language. We describe the entire Lamellar stack, from network interfaces to high- level abstractions such as distributed LamellarArrays and Active Messages. We conclude by showing comparable performance to legacy PGAS runtimes (e.g. OpenSHMEM) on a subset of the BALE kernel suite while maintaining strong memory safety principles.

HPC Software Systems, Rust Programming Language, P↗
DOE OSTI2024

A Compound Data Poisoning Technique with Significant Adversarial Effects on Transformer-based Sentiment Classification Tasks

Transformer-based models have demonstrated much success in various natural language processing tasks. However, they are often vulnerable to adversarial attacks, such as data poisoning, which can intentionally fool the model into generating incorrect results. In this article, we present a novel, compound variant of a data poisoning attack on a transformer-based model that maximizes the poisoning effect while minimizing the scope of poisoning. Here we do so by combining the established data poisoning technique (label flipping) with a novel adversarial artifact selection and insertion technique aimed at minimizing detectability and the scope of the poisoning footprint. We find that by using a combination of these two techniques, we achieve a state-of-the-art attack success rate of approximately 90% while poisoning only 0.5% of the original training set, thus minimizing the scope and detectability of the poisoning action. These findings have the potential to advance the development of better data poisoning detection methods.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2024

PaRSEC: Scalability, flexibility, and hybrid architecture support for task-based applications in ECP

This paper highlights the most significant enhancements made to PaRSEC, a scalable task-based runtime system designed for hybrid machines, during the Exascale Computing Project (ECP). The enhancements focus on expanding the capabilities of PaRSEC to address the evolving landscape of parallel computing. Notable achievements include the integration of support for three major types of accelerators (NVIDIA, AMD, and Intel GPUs), the refinement and increased flexibility of the communication subsystem, and the introduction of new programming interfaces tailored for irregular applications. Additionally, the project resulted in the development of powerful debugging and performance analysis tools aimed at assisting users in understanding and optimizing their applications. We present a comprehensive demonstration of these advancements through a series of benchmarks and applications within ECP and beyond, thereby showcasing the enhanced capabilities of PaRSEC across the diverse architectures within the ECP, providing valuable insights into the runtime system’s adaptability and performance across varied computing environments.

Bouteiller, Aurelien↗
DOE OSTI2024

SMART Task 6: Evaluation of the Costs of Geologic CO2 Storage for the Illinois Basin Decatur Project Site Using the NRAP/SMART Technoeconomic and Liability Evaluation for Storage (TALES) Model

This is a presentation featuring an analysis related to SMART Task 6 in which CO2 storage costs are presented. The National Energy Technology Laboratory has developed the NRAP/SMART Technoeconomic and Liability Evaluation for Storage (TALES) model to provide quantitative cost-based insights to support developers planning CO2 injection and storage projects. TALES calculates the revenues, costs, and financial performance of candidate CO2 saline storage project based on site-specific activity costs and financial parameters. TALES is being integrated as a module pertaining to storage cost as part of the broader SMART Visualization and Decision Support Platform (SVDSP). In this study, the TALES model was applied using real activity cost data associated with the development and operations at the Illinois Basin Decatur Project (IBDP) CO2 storage project site. Scenario analysis was implemented in which crucial operational and cost attributes were varied and the associated cost implications observed. Key results data and project cost summary metrics like first-year breakeven price of CO2 ($/tonne) and net present value (NPV) are presented in similar fashion to how they will appear in the SVDSP.

Vikara, Derek↗
DOE OSTI2024

SHASTA: Task 2.2: Sensor Development for Subsurface Hydrogen Storage Monitoring Technology Maturation and Commercialization Plan (TMCP)

In Task 2.2 under the SHASTA program, NETL is developing in-situ optical fiber sensors for real-time monitoring of hydrogen, methane, and chemical parameters such as pH at subsurface hydrogen storage conditions. This Technology Maturation and Commercialization Plan report will provide the summary of NETL sensor development and test results under the SHASTA program to meet the subsurface application requirements and proposed technology maturation and deployment plan, and commercialization potential.

08 HYDROGEN↗
DOE OSTI2024

Annual Report on NCSP Technical Support task in BNL during FY24

This work reports on the investigations done during FY 24 in collaboration with two 2024 Summer undergraduate interns through the DOE SULI and BNL SURP programs. These efforts were partially funded by the Nuclear Criticality Safety Program through the Technical Support Succession Plan task. The first project, developed by Ian Snider, focused on testing the impact of uncertainties in thermal cross sections for multiple materials in nuclear reactor simulations. The second project aimed implement concurrent into BNL’s machine-learning code to correct spin mis-assignments in neutron resonances, the Bayesian Resonance Reclassifier (BRR).

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2024

NRAP Task 5: Preliminary Evaluation of the Cost of Responding to a Hypothetical Leakage Scenario Using the NRAP/SMART TALES Model and other NRAP Tools

Poster presentation illustrating the use of tools developed as part of Task 5 of Phase 3 of NRAP to estimate the technical performance and costs of implementing remedial responses to address a leak of fluid out of the storage formation at a CO2 saline storage project. Presented at the 2024 FECM - NETL Carbon Management Research Project Review Meeting, 5-9 August, 2024, Pittsburgh, PA.

Morgan, David↗
DOE OSTI2024

Emergency Management of Tomorrow Research – Task 3B Research and Development Community Awareness: Eliciting Emergency Management Stakeholder Input

The Department of Homeland Security (DHS) Science and Technology Directorate (S&T) is partnering with Pacific Northwest National Laboratory (PNNL) to execute the Emergency Management (EM) of Tomorrow Research (EMOTR) program to identify current EM research, elicit capability needs from EM practitioners, and identify where technology, such as artificial intelligence (AI), may benefit the future of EM and emergency operations centers. This report details the methodology, analysis, and insights of interviews and focus groups conducted as part of the task to elicit stakeholder input.

99 GENERAL AND MISCELLANEOUS↗
DOE OSTI2025

MRCI Task 2: Addressing Key Technical Challenges - Executive Summary Report

This report provides a high-level overview of Task 2 products that were developed through defining carbon storage systems, Precambrian basement structure and stress, developing regional technical collaboration, modeling and risk assessment. Subtask 2.1: Defining Sub-Regional CS/CCUS Systems Subtask 2.2: Defining Precambrian basement faulting/stress Subtask 2.3: Developing industrial partnerships and regional technical collaborations Subtask 2.4: Conducting regional/subregional analysis Subtask 2.5: Assessing and managing risk for potential commercial-scale storage complexes

MRCI,Technical Challenges↗
DOE OSTI2025

MRCI Task 4: Evaluating Regional Infrastructure Technical Summary Report

The infrastructure required to enable carbon capture and sequestration (CCS) goes beyond the equipment and materials needed to capture, transport, and store carbon dioxide (CO2) but includes people and policy that make CCS feasible. The Infrastructure Assessment task of the Midwest Regional Carbon Initiative (MRCI) seeks to determine the infrastructure requirements for the MRCI study area through four activities: • Infrastructure Readiness: Strategizing the buildout of capture, transport, and storage infrastructure in the Midwest, Northeast, and Mid-Atlantic Offshore. • Site Readiness: Determining the CCS readiness of each state in the MRCI region in the categories of subsurface readiness; infrastructure readiness; regulations, permitting, and incentives; and social dynamics. • Jobs, Economics, and Social Characteristics: Quantifying the economic potential, job opportunities, and training opportunities for CCS as well as the social characteristics of the region with a focus on energy and environmental justice (EJ) issues. • Policy and Regulations: Providing an updated accounting of the CCS-relevant policy and regulations in the MRCI region.

CCUS,Carbon storage,Midwest,Midwest Regional Carbo↗
DOE OSTI2025

Open-source Tip-and-Cue for Change-Detection Tasking

Currently, no tool exists to detect daily change across the globe, let alone to do so cost- and resource-efficiently. The proposed tool will use open-source data to detect change in near-real-time to identify targets of interest for tasking, providing a unique capability for constant global situational awareness.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2025

TEAMER Technical Support of Ramboll's for Numerical Modeling of WECs to Support OES Task 10: Cooperative Research and Development (Final Report)

National Technology & Engineering Solutions of Sandia, LLC (NTESS) in collaboration with the National Renewable Energy Laboratory (NREL), and with guidance from Ramboll, will perform fluid dynamics simulations to support of The Ocean Energy Systems (OES) Energy Technology Collaboration Program Task 10 Wave Energy Converters (WEC) Modelling Verification and Validation effort. Specific numerical simulations include the fixed device wave impingement studies to benchmark the performance of simulation techniques against physical testing results.

16 TIDAL AND WAVE POWER↗
DOE OSTI2025

Annual Report on NCSP Technical Support task in BNL during FY25

This work reports on the investigations done during FY 25 in collaboration with one 2025 Summer undergraduate intern through the DOE SULI program. These efforts were partially funded by the Nuclear Criticality Safety Program through the Technical Support Succession Plan task. This project, developed by Matthew Molnar, aimed to apply the BNL’s machine-learning code to correct spin mis-assignments in neutron resonances, the Bayesian Resonance Reclassifier (BRR), to the odd-even nucleus 143 Nd. For this, the handling of spingroup classification had to be further investigated and improved.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2025

Applied Research and Development to Support Open Water Testing at PacWave – Task 5: Development of additively manufactured, functionally graded, corrosion resistant clads for wave energy applications

In this task, we focused on developing corrosion-resistant claddings for wave energy applications. Wave energy systems are exposed to saline conditions, which are corrosive to many metallic structural materials (e.g., carbon steel). Corrosion-resistant (stainless) steels are typically alloyed with >18% chromium (Cr) and >8% nickel (Ni), which dramatically raises material costs and can hinder the development of wave energy systems; thus, coatings are a necessary corrosion protection method for most. Non-metallic coatings (paint, epoxy) have shorter service lives, limited resistance to mechanical stress and wear, plus additional costs of inspection and eventual replacement. Therefore, overlay stainless steel (SS) claddings have a cost-effective use case for protecting components from corrosion, particularly for those that may be subject to mechanical stress / wear and with long service lives.

16 TIDAL AND WAVE POWER↗