Modeling electrical particle thermal energy storage systems for long-duration, grid-electricity storage applications
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Gifford, Jeffrey (ORCID:0000000259090325)↗
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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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Single Quadrupole Multiple Fragment Ion Monitoring Quantitative Mass Spectrometry
Single quadrupole mass spectrometry (MS) with enhanced in-source multiple fragment ion monitoring was designed to perform high sensitivity quantitative mass analyses. Enhanced in-source fragmentation amplifies fragmentation from traditional soft electrospray ionization producing fragment ions that have been found to be identical to those generated in tandem MS. We have combined enhanced in-source fragmentation data with criteria established by the European Union Commission Directive 2002/657/EC for electron ionization single quadrupole quantitative analysis to perform quantitative analyses. These experiments were performed on multiple types of complex samples that included a mixture of 50 standards, as well as cell and plasma extracts. The dynamic range for these quantitative analyses was comparable to triple quadrupole multiple reaction monitoring (MRM) analyses at up to 5 orders of magnitude with the cell and plasma extracts showing similar matrix effects across both platforms. Amino acid and fatty acid measurements performed from certified NIST 1950 plasma with isotopically labeled standards demonstrated accuracy in the range of 91–110% for the amino acids, 76–129% for the fatty acids, and good precision (coefficient of variation <10%). To enhance specificity, a newly developed correlated ion monitoring algorithm was designed to facilitate these analyses. This algorithm autonomously processes, aligns, filters, and compiles multiple ions within one chromatogram enabling both precursor and in-source fragment ions to be correlated within a single chromatogram, also enabling the detection of coeluting species based on precursor and fragment ion ratios. Single quadrupole instrumentation can provide MRM level quantitative performance by monitoring/correlating precursor and fragment ions facilitating high sensitivity analysis on existing single quadrupole instrumentation that are generally inexpensive, easy to operate, and technically less complex.
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
Developing and Demonstrating a Lab Method for Quantifying Hair Exposure to Environmental Tobacco Smoke with a Forensic Perspective
Forensic science and chemistry curricula often lack hands-on experimental designs that effectively simulate the impact of environmental tobacco smoke (ETS) or other common elements found at crime scenes, such as marijuana, on trace forensic evidence. Hair, a critical form of trace evidence, offers unique advantages for assessing long-term exposure to environmental pollutants, including ETS. This study presents a novel, noninvasive forensic laboratory module designed to evaluate ETS exposure on various human hair types (untreated, dyed, and bleached). The experimental procedure involved controlled cigarette smoke exposure, followed by analysis using UV−visible spectroscopy, FTIR spectroscopy, and zeta potential measurements. Thirteen students participated in the three-week lab module (three sessions per week). Pre- and postlab assessments were conducted to evaluate learning outcomes. The prelab assessment focused on baseline knowledge of forensic hair analysis, as well as student expectations and confidence. The postlab assessment evaluated knowledge gained, technical insights, application of techniques, self-reflection, conceptual understanding, and practical skill development. This design helped students comprehend the effects of chemical treatments that significantly influence hair’s capacity to adsorb ETS residues by altering its physical and chemical properties. Integration of this experiment into the forensic chemistry curriculum led to measurable gains in student understanding, technical competency, and appreciation for realworld forensic applications. This method offers a valuable teaching and investigative tool for assessing individual ETS exposure in forensic contexts.
FTIR↗
Maturing global CO 2 storage resources on offshore continental margins to achieve 2DS emissions reductions
Most studies on CO 2 emissions reduction strategies that address the ‘two-degree scenario’ (2DS) recognize a significant role for CCS. For CCS to be effective, it must be deployed globally on both existing and emerging energy systems. For nations with large-scale emissions, offshore geologic CO 2 storage provides an attractive and efficient long-term strategy. While some nations are already developing CCS projects using offshore CO 2 storage resources, most geographic regions have yet to begin. This paper demonstrates the geologic significance of global continental margins for providing broadly-equitable, geographically-relevant, and high-quality CO 2 storage resources. We then use principles of pore-space utilization and subsurface pressure constraints together with analogs of historic industry well deployment rates to demonstrate how the required storage capacity can be developed as a function of time and technical maturity to enable the global deployment of offshore storage for facilitating 2DS. Our analysis indicates that 10–14 thousand CO 2 injection wells will be needed globally by 2050 to achieve this goal.
58 GEOSCIENCES↗
Machine Learning Application for CCUS Carbon Storage: Fracture Analysis and Mapping in The Illinois Basin
This is the conference paper accompanying an oral presentation at the 58th US Rock Mechanics/Geomechanics Symposium (ARMA) June 23 to 26 in Golden, CO. The paper highlights using machine learning to quantify fracture network for carbon storage and is part of the SMART Initiative project applications.
Liu, Guoxiang↗
Carbon Dioxide Utilization (CO2U) ICEF Roadmap 2.0. Draft October 2017
Last year, experts from CO 2 Sciences, Columbia University and Valence Strategic came together to develop a roadmap. That document, Carbon Dioxide Utilization ICEF Roadmap 1.0, released at the UNFCCC Marrakesh Climate Change Conference in 2016, surveyed the commercial and technical landscape of CO 2 conversion and use. The document provided extensive background and analysis and has helped to provide a foundation for additional studies, including this one.This roadmap is meant to complement and expand upon the work of its predecessor. Based in part on a workshop at Columbia University’s Center on Global Energy Policy in July 2017, it explores three distinct categories of CO 2 -based products, the technologies that can be harnessed to convert CO2 to these products, and the associated research and development needs. It also explores the complicated topic of life cycle analysis—critically important when considering the climate impacts of CO 2 conversion and use—as well as policy tools that could be used to promote CO 2 -based products.
29 ENERGY PLANNING, POLICY, AND ECONOMY↗
Environmental Restoration Operations, Consolidated Quarterly Report, January - March 2019
This Sandia National Laboratories, New Mexico Environmental Restoration Operations (ER) Consolidated Quarterly Report (ER Quarterly Report) fulfills all quarterly reporting requirements set forth in the Compliance Order on Consent. Table I-1 lists the six sites remaining in the corrective action process. This ER Quarterly Report presents activities and data as follows: SECTION I: Environmental Restoration Operations Consolidated Quarterly Report, January — March 2019 SECTION II: Because there is no perchlorate sampling collection to report this quarter, this edition of the ER Quarterly Report does not include any analysis of data in Section II "Perchlorate Screening Quarterly Groundwater Monitoring Report." SECTION III: Technical Area-V In-Situ Bioremediation Treatability Study Full-Scale Operation, January — March 2019.
54 ENVIRONMENTAL SCIENCES↗
Improving Fission Products at CARIBU: Near Field Detection (Q2/FY21 Quarterly Progress Report)
The 95 Zr manuscript describing our experimental approach to measure branching ratios of long-lived fission products has been completed and successfully published in NIM A. This article is an important milestone in this effort and will serve as a great reference in any future reports describing results of other measurements we plan to perform. We have also expended our team, and Daniel Hoff joined us as a postdoc. We have been training him on how to use our analysis and simulation tools, as well as bringing him up to speed on the technical details of our experiment.
73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
Argonne Leadership Computing Facility: 2021 Operational Assessment Report
This Operational Assessment Report describes how the Argonne Leadership Computing Facility (ALCF) met or exceeded every one of its goals for calendar year (CY) 2021 as an advanced scientific computing center. In CY 2021, the ALCF operated its production resource, Theta, an Intel-based Cray XC40 system (11.7-petaflops) augmented with 24 NVIDIA DGX A100-based nodes (3.9-petaflops) that supports diverse workloads, integrating data analytics with artificial intelligence (AI) training and learning in a single platform. In 2021, we began deploying Polaris, our newest 40- petaflops system, and augmented this powerful testbed system with an additional 28 nodes to support the integration of real-time experiments and HPC resources. We also deployed our two largest storage systems yet, named Grand and Eagle, that will bring new services to our users and will power data-driven research for years to come. Last year, Theta delivered a total of 20.8 million node-hours to 16 Innovative and Novel Computational Impact on Theory and Experiment (INCITE) projects and 7.2 million node-hours to ASCR Leadership Computing Challenge (ALCC) projects (32 awarded during the 2020–2021 ALCC year and 17 awarded during the 2021–2022 ALCC year), as well as substantial support to Director’s Discretionary (DD) projects (5.5 million node-hours). As Table ES.1 shows, Theta performed exceptionally well in terms of overall availability (95.1 percent), scheduled availability (99.4 percent), and utilization (98.1 percent; Table 2.1). As of the submission date of this document, ALCF’s user community has published 249 papers in high-quality, peer-reviewed journals and technical proceedings. At the 2021 International Conference for High Performance Computing, Networking, Storage and Analysis (SC’21), Argonne researchers won two HPCwire Readers’ Choice Awards and were part of a Gordon Bell Prize finalist team recognized for developing an AI-enabled, multi-resolution simulation framework for studying complex biomolecular machines. Their framework was used to observe the SARS-CoV-2 replication-transcription machinery in action, by directly integrating experimental data. ALCF also provided a comprehensive program of high-performance computing (HPC) support services to help our community make productive use of the facility’s diverse and growing collection of resources. We are now entering the exascale era, with exascale machines being planned for national laboratories across the country, including Aurora at Argonne National Laboratory (Argonne) in 2023. ALCF researchers have been leading and guiding numerous strategic activities that will push the boundaries of what’s possible in computational science and engineering and allow us to deliver science on day one.
97 MATHEMATICS AND COMPUTING↗
Non-Technical Barriers to Geothermal Development in California and Nevada [Slides]
This presentation presents the findings of our study, including an analysis of federal, state, and local geothermal regulatory and permitting processes, case studies analyzing site-specific attributes that may impact project development at four selected geothermal project sites, an analysis of cost and timeline implications for geothermal project development, and the results of a qualitative study focused on inter-agency coordination and collaboration efforts between federal, state, and/or local agencies for geothermal projects located in California and Nevada. Our analysis found that development timelines may be impacted by multiple federal and state environmental review processes and duplicative permitting requirements as well as coordination efforts between numerous federal, state, and local agencies involved in issuing authorizations and permits necessary for project development. In addition, projects in California and Nevada may face site-specific environmental challenges due to the presence of sensitive resources (e.g., biological species and species habitat, cultural resources) that may result in project construction delays. Our study results also indicate that protracted geothermal development timelines caused by delays in acquiring necessary permits and environmental reviews may result in loss of generated electricity revenue and additional financing costs, which may increase economic uncertainty associated with project development. Through our qualitative analysis, we found that utilization of best practices, including tiering to existing environmental review documents and developing memoranda of understanding, which clearly delineate agency roles and responsibilities may reduce overall project timelines, costs, and uncertainties associated with geothermal project development in California and Nevada.
15 GEOTHERMAL ENERGY↗
Distributed Rules-Based Deconfliction of ADMS Applications: Part 1: Requirements & Decomposition
This work introduces a rules-based deconfliction methodology for resolving conflicting device control commands issued by advanced power applications considering a range of technical, economic, environmental, and social objectives. The methodology is designed to serve as one of multiple alternative implementations (along with application cooperation and global optimization) for the numerical component of the Deconfliction Pipeline. Development of the methodology is divided into two parts. This first document introduces the requirements, context, and methods for decomposing the deconfliction problem using the Laminar Coordination Framework and Variable Grid Structures. The deconfliction problem is decomposed into a distributed optimization problem based on the concept of quasi-static grid segments, which form independent distributed areas for control and coordination. Selection of the optimal number of decompositions of the deconfliction problem should be made based on a tradeoff analysis between computational speed and global optimality. This second document will define an initial set of technical, economic, and environmental criteria, as well as thirty specific qualitative rules that are used as part of the deconfliction methodology to eliminate non-viable setpoint alternatives. The deconfliction optimization problem is converted into a ranking of individual discrete setpoints, which are scored by the extent to which they satisfy specific decision criteria. The ranking is determined through the concepts of deconfliction exclusivity, priority, and preference. Several multi-criteria decision-making frameworks are examined with the simple multi-attribute rating technique exploiting ranks (SMARTER) recommended as a simple implementation alternative that aligns with the steps of the rules-based deconfliction methodology.
97 MATHEMATICS AND COMPUTING↗
Where are the Data? Automating a Workflow for Carbon Storage Data Gap Analyses
This presentation demonstrates a spatial analysis workflow to assess data availability for the many components of geologic carbon storage technical viability. The workflow relies upon a knowledge-data framework that links the different components of GCS technical viability to the data types needed for evaluation. Using this contextual information, a combination of data science methods (e.g., natural language processing) and spatial analyses are applied to identify areas where sufficient data exists for a given component. The results are aggregated into maps illustrating data density and spatial gaps across all technical viability factors and data categories, as well as the individual component and category level for a more nuanced understanding. Presented at the FECM NETL Carbon Management Program Review Meeting 2024.
Creason, Christopher↗
Where are the Data? Automating a Workflow for Carbon Storage Data Gap Analyses
This presentation demonstrates a spatial analysis workflow to assess data availability for the many components of geologic carbon storage technical viability. The workflow relies upon a knowledge-data framework that links the different components of GCS technical viability to the data types needed for evaluation. Using this contextual information, a combination of data science methods (e.g., natural language processing) and spatial analyses are applied to identify areas where sufficient data exists for a given component. The results are aggregated into maps illustrating data density and spatial gaps across all technical viability factors and data categories, as well as the individual component and category level for a more nuanced understanding. Presented at the Geological Society of America Connects 2024 Annual Meeting in Anaheim, California, 22-25 September 2024.
Creason, Christopher↗
AI-Ready Control System for the Fermilab Accelerator Complex
Reliable, high-intensity operation of the Fermilab Accelerator Complex is critical to the success of the Long-Baseline Neutrino Facility and Deep Underground Neutrino Experiment. We describe the requirements and infrastructure necessary to support routine use of artificial intelligence and machine learning (AI/ML) in the accelerator control system. Three capabilities are identified: a machine learning operations (MLOps) framework standardizing the lifecycle of AI/ML automation from data management through deployment and monitoring; a data quality framework defining and enforcing standards required to build trustworthy AI/ML applications; and workflow integration with large language models to assist physicists, engineers, and operators with information retrieval, code development, and routine analysis. Use cases spanning beam diagnostics, beam control, and support system automation illustrate the technical requirements across the complex.
43 PARTICLE ACCELERATORS↗
Staying Competitive in Clean Manufacturing: Insights on Barriers from Industry Interviews
While industrial emissions research has historically focused on energy-intensive sectors like steel, cement, and chemicals, this study addresses a critical gap by examining barriers across all the manufacturing industry in the U.S. Sectors like food processing, retail, plastics, and transportation face unique challenges distinct from heavy industry, operating on thin margins with limited bargaining power while experiencing heightened consumer and stakeholder pressure for improved environmental responsibility. Through structured interview data collection process and using quantitative ratings and qualitative analysis, this research identifies and categorizes emission reduction barriers across four key themes: financial, technical, organizational, and regulatory. Unlike energy-intensive industries that may pursue hydrogen or carbon capture technologies, discrete manufacturing industry like automotive, electrical and electronics, and machine manufacturers typically focus on energy efficiency, electrification of thermal processes, and alternate fuel switching, solutions better aligned with their lower-temperature processes and distributed facility profiles. The study’s primary contribution lies in documenting specific barrier manifestations within organizations and identifying proven mitigation strategies that companies have successfully implemented or observed among peers.
business competitiveness↗
Northwest Colorado Local Energy Analysis: October 2025 Results
The U.S. Department of Energy's (DOE) Communities Local Energy Action Program (Communities LEAP) provided customized technical assistance to the Northwest Colorado region to assist in developing strategies that facilitate long-term economic benefits through locally driven energy planning and development. The region sought technical assistance to model alternatives energy projects in response to the expected retirement of coal-fired powers plant and associated coal mines by 2030. Northwest Colorado faces a potential economic gap due to the loss of tax revenue, labor income, and jobs within the region due to the impending closure of the Craig and Hayden Power Stations and related mining operations at Trapper and Colowyo mines.
08 HYDROGEN↗
Technical, analytical, and computer support Annual report, 18 Feb. 1970 - 17 Feb. 1971
Design study with mathematical model for performance analysis of silicon-germanium thermoelectric generators
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Analytical techniques and instrumentation: A compilation
Technical information on developments in instrumentation is arranged into four sections: (1) instrumentation for analysis; (2) analysis of matter; (3) analysis of electrical and mechanical phenomena; and (4) structural analysis. Patent information for two of the instruments described is presented.
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