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DOE OSTI2025

Radioisotope production at the Spallation Neutron Source: Design concept of isotope production target

Upon completion of the Second Target Station (STS) Project in the mid 2030s, the Spallation Neutron Source accelerator at Oak Ridge National Laboratory will deliver a 2.7 MW proton beam to the neutron production targets. In the post-STS phase, the accelerator will have a reserve beam power capacity of at least 100 kW beyond what the two neutron production targets will receive, which could potentially be ramped up to 300 kW. In this paper, a design concept for a radioisotope production target that could utilize 250 kW of the reserve beam power capacity is presented. The target consists of thorium discs encapsulated in 316L austenitic steel shells that are cooled by water. The estimated post-irradiation activity of Ac-225 and Ra-225, critical medical radioisotopes used in targeted alpha therapy cancer treatment, is calculated at the end of bombardment after a 14 day long irradiation time. Thermal and structural analyses are performed on the basis of calculated nuclear heating data. The technical feasibility of a high-power target under a 250-kW beam load with an extremely low duty factor of $3.5\cdot 10^{-6}$ is presented from thermal, structural and fatigue lifetime perspectives.

Lee, Yong Joong [ORNL] (ORCID:0000000298381723)↗

DOE OSTI2021

Identification of SPR Caverns with Multiple Oil Layers

This analysis shows that when lower density crude oil is injected into the top of an underground salt storage cavern containing more dense crude, separate oil phases can form and coexist indefinitely. This has been observed at the U.S. Strategic Petroleum Reserve in spite of geothermal heating and natural convection, which tend to mix the contents of containers with significant vertical extent subjected to wall and bottom heating. Such persistent layering can create operational challenges for meeting delivery specifications if high-value, low-vapor pressure oil becomes trapped below incoming low-density, high-vapor pressure oil, effectively blocking access to the lower layers until the top layer is removed. Previous conceptual models assumed that the oil injection process mixed incoming oil with resident oil in a storage cavern, forming a single oil phase with relatively homogeneous properties. Here, a review of historical data from the Strategic Petroleum Reserve revealed that several caverns contain multiple oil layers. As a result, oil layering needs to be another variable considered when planning oil movements at SPR in order to optimize low-vapor pressure oil availability to assist in oil delivery blending.

02 PETROLEUM↗

DOE OSTI2021

Concurrent Optimization of Capital Cost and Expected O&M

Concentrating solar power (CSP) technologies can utilize heat from concentrated sunlight from a field of tracking mirrors to generate electricity, reform fuel, provide process heat, or augment fossil plant heat sources. Electricity-generating power tower systems focus light from thousands of independent heliostats onto a thermal receiver, which uses the focused light to warm a heat transfer fluid (HTF), typically, a molten nitrate salt. The HTF is then sent to a power generation cycle or diverted into thermal energy storage (TES) for later use. Thermal storage is – in principle – a straightforward proposition. However, optimal utilization of a TES resource is complex and multi-faceted: thermal energy may be dispatched to produce electricity immediately upon first availability, or thermal energy may be reserved for next-day peak periods at risk of filling storage and dumping energy, or a portion of the thermal energy can be reserved to maintain equipment temperatures, reducing power cycle startup time, etc. Many possible dispatch permutations variously emphasize producing peak power, operating through transients, expediting daily startup, etc. The best operation strategy can change day-to-day throughout the year, depending on the weather and market pricing forecasts. The project we describe in this report develops a software package that allows users to explore design optimization, operations decisions, and performance characterization of concentrating solar power tower plants. Users interface with the tool through a scripting language, and results are reported in time series tables, plots, runtime logs, and design outputs. Users choose from a list of variables such as tower height, solar multiple, design-point irradiance, thermal storage size, etc., and specify information about the system using a list of parameters. The software can then optimize the specified variables to reduce the cost of energy produced by the system while meeting certain production requirements, accounting for uncertain weather and electricity price forecasts, and correcting for equipment failures or repair time. The software we develop is the first comprehensive design tool of its kind to incorporate all of these aspects while being deployed as open source.

14 SOLAR ENERGY↗

DOE OSTI2021

Sustainable Coal Tar Pitch Carbon Fiber Manufacturing

Coal is a versatile resource that has historically propelled the Industrial Revolution, transportation, and energy generation, and continues to meet needs for power. The United States possesses the largest worldwide coal reserves (with a 2019 total production-to-recoverable-reserves ratio of 0.05) that are of high quality and are cost-effective to recover (i.e., $0.03/kg–$0.10/kg). However, the demand of coal for power generation has declined because of a shift to natural gas (because of lower natural gas prices) and to renewable energy sources. This decline has affected the economic viability US coal industry. Historically, domestic demand for coal was driven mostly by the electric power sector, which accounts for about 93% of the total demand, followed by industrial uses (primarily for cement and chemicals at a minimal level) and steel production (coke). The complex, dense carbon chemical structure of coal, abundant domestic supply, and stable, low price gives it great potential for use in a wide range of value-added non-fuel coal products (e.g., nanomaterials at $20,000/kg–$100,000/kg and commercial-grade carbon fiber at $22/kg–$33/kg), as well as in upgraded coal fuels.

01 COAL, LIGNITE, AND PEAT↗

DOE OSTI2021

2021 Summer Resource Adequacy in the ERCOT Region

This report is an update to the NETL report on the same topic that examined the potential system performance of the Electric Reliability Council of Texas (ERCOT) system during the summer of 2020. Anticipated reserve margins in ERCOT have risen year-over-year from the 10.7 percent reported in ERCOT’s Final Seasonal Assessment of Resource Adequacy (SARA) for Summer 2020 to 15.7 percent for Summer 2021 in ERCOT’s Capacity, Demand and Reserves [CDR] report published in December 2020 and 2021 Summer Preliminary SARA published in March 2021. Using data from ERCOT’s 2021 Summer SARA, CDR, and historical performance data, six economic dispatch scenarios using PROMOD were developed to assess the risk to ERCOT of a load shedding event for Summer 2021. The results suggest that ERCOT could make it through the summer season without a loss of load event, as long as the weather remains normal. However, through a combination of scenarios, including increased demand, increased forced outages, and low wind output, ERCOT is likely to find itself operating in emergency conditions.

24 POWER TRANSMISSION AND DISTRIBUTION↗

DOE OSTI2021

Variable Renewable Energy Participation in U.S. Ancillary Services Markets: Economic Evaluation and Key Issues

Variable renewable energy (VRE) is not yet meaningfully participating in U.S. ancillary services (AS) markets. VRE participation in AS markets could provide a new source of revenues for VRE resource owners to offset declining energy and capacity values and a new tool for power system operators to address emerging system constraints. This paper uses a price-taker dispatch model and historical prices to estimate the economic value of standalone and hybrid (battery-paired) VRE participation in AS markets, from resource owner and electricity system perspectives, in each of the seven U.S. independent system operator and regional transmission organization (ISO/RTO) markets. Across ISO/RTO markets, average (2015-2019) simulated incremental revenues from regulation market participation were $\$$0.0-2.9/MWh (+0-15% of revenue without participation) for standalone VRE owners and $\$$1-33/MWh (+1-69%) for hybrid VRE owners. However, ISO/RTO reserve markets are relatively thin and have the potential to become saturated by energy storage projects that are currently in ISO/RTO interconnection queues. In most markets, standalone and hybrid VRE were able to provide regulation reserves during periods with high regulation prices, suggesting that VRE participation in AS markets could have high system value. The analysis highlights the value of separate upward and downward regulation products and suggests that ISOs/RTOs might consider initially focusing on enabling hybrid VRE provision of AS.

14 SOLAR ENERGY↗

DOE OSTI2022

2022 Summer Resource Adequacy in the ERCOT Region

This report is a 2022 update to the National Energy Technology Laboratory (NETL) report that examined the potential system performance of the Electric Reliability Council of Texas (ERCOT) system during the summer of 2021. Anticipated summer reserve margins in ERCOT have risen year-over-year from the 15.7 percent reported in ERCOT’s Final Seasonal Assessment of Resource Adequacy (SARA) for Summer 2021 to 22.8 percent in the Final SARA for Summer 2022, driven mostly by increases in wind and solar generation. Using data from ERCOT’s 2022 Summer SARA, Capacity, Demand and Reserves (CDR) reports, and historical performance data obtained from ERCOT and Hitachi Energy Velocity Suite, six economic dispatch scenarios using PROMOD were developed to assess the risk to ERCOT of a load shedding event for Summer 2022. The results suggests that ERCOT may be facing a very tight resource adequacy situation, with the potential for a serious shortfall during the summer peak, usually the end of July through mid-August, if demand and generator outage rates significantly exceed peak levels. Under these conditions, ERCOT will need to call on its operating tools, including Energy Emergency Alerts (EEA) and calls to conserve electricity, to maintain reliability and continue serving load. Those measures alone may not be sufficient to avert a shedding of load.

24 POWER TRANSMISSION AND DISTRIBUTION↗

DOE OSTI2023

Creation of Synthetic Electric Grids (SPP/MISO) Supporting PERFORM (Final Report)

Over the course of the project, two “realistic but not real” synthetic transmission-level grid models over the SPP-MISO and ERCOT footprints were created to provide more realistic data and increase the reliability and resiliency of the grids under a variety of scenarios. The synthetic ERCOT transmission grid is compatible with the distribution grid developed in collaboration with NREL. All generators are based on the EIA 860 data and a column with EIA plant code and Gen ID is added to generators of both grids so that they can be easily mapped. The improvements are also made to electric grids including N-1 contingencies with some remedial actions, improving the transmission lines to avoid lines in lakes, including an HVDC line to the SPP-MISO case, providing several generator parameters and their temporal constraints that were not included in EIA 860 form, generators’ cost curves, load offer curves, adding phase shifters and tap changers with impedance correction tables, adding reactive power control and partitioning the grids into active and reactive reserve zones and determine different types of the required reserve for each zone. Hourly load time series at the bus level were generated to create scenarios for solving power flow in different loading conditions. Weather measurement information and the models of renewable generators are used to directly include the impact of weather on the grids. Based on a variety of load and weather conditions the grids are improved to accommodate different conditions. The ERCOT 7k-bus grids were also modeled for the year 2030 with predicted improvements in renewable resources. The renewable generation model was also improved with historic weather data included. The impact of electric vehicles on the ERCOT grid is also modeled.

24 POWER TRANSMISSION AND DISTRIBUTION↗

DOE OSTI2022

Modeling and Market Design Considerations for Conventional and Decarbonized Resources

The following paper reviews various market design issues that will need to be reconsidered due to anticipated changes in the resources that supply energy in wholesale electricity markets. As the energy supply continues towards decarbonization, the change in resource technologies will affect the fundamentals of production scheduling and the policies to address supply variability and uncertainty. We show through simple numerical examples that the existing market design approach based on fuel costs will result in $0/MWh prices with intermittent price spikes during reserve shortages, but that incorporating more granular reserve pricing, energy storage participation, and price-responsive demand participation can restore efficient market clearing with reasonable pricing outcomes. The market design approach fundamentally shifts from fuel based to opportunity cost based. We briefly review alternative market design frameworks that can support this shift, including intraday markets, decentralized markets, flexibility options, and swing contracts. Market designs may also be required to accommodate or support various out-of-market policies and agreements; ideally, these external factors can be integrated into the market design to facilitate efficient exchanges across longer time scales, between other markets, and in support of public policy goals. The paper concludes by discussing how decarbonization trends may affect the design and use of production cost models for short term operations and long term planning studies.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗

DOE OSTI2022

Task 12 PV Sustainability - Mineral Resource Use Footprints of Residential PV Systems

Resource use intensity is often mentioned as one of the main characteristics of PV systems and PV electricity. Recently, the International Energy Agency published a report on the role of critical minerals in clean energy transitions. The Product Environmental Footprint pilot study on PV electricity quantified (among other environmental impacts) its abiotic depletion potential. So far, a comprehensive assessment of resource use impacts highlighting the different facets of its impacts is however lacking. For the first time, the resource use impacts of PV electricity are quantified simultaneously with four impact category indicators recommended or suggested by the Life Cycle Initiative hosted at UN Environment. The indicators cover distinctly different aspects of resource use, namely resource depletion with the Abiotic Depletion Potential, ultimate reserves (ADP UR ), economic resource scarcity with the Abiotic Depletion Potential, economic reserves (ADP ER ), resource quality with the Surplus Ore Potential, Ultimate Recoverable Resources (SOP URR ) and re-source criticality with the ESSENZ method. The resource use impacts caused from the generation of 1 kWh electricity with a residential scale photovoltaic (PV) system installed in Central Europe using mono- and multi-crystalline silicon panels and CdTe panels, respectively are quantified. The product system includes manufacture, use and end of life treatment (take back and recycling) of the PV panels, cabling, inverter and supporting structure, the supply chains of the raw materials and energy used in PV panel and inverter manufacture as well as transport logistics.

14 SOLAR ENERGY↗

DOE OSTI2024

Solar and Storage Integration in the Southeastern United States: Economics, Reliability, and Operations

Solar energy has the potential to be a core energy resource for the southeastern United States. To better understand the implications of higher levels of solar PV (27%-43% of total generation capacity) and electricity storage (13%-49% of peak load) would affect electricity system reliability, costs, and operations in the U.S. Southeast, this study sought to address two main questions. First, how would higher levels of solar PV and electricity storage impact the costs, reliability, and operations of electricity systems in the Southeast in 2035? Second, at different levels of solar PV and electricity storage, what are the benefits of operational coordination among utilities in the Southeast, through more efficient regional dispatch and sharing operating reserves? To answer these questions, the study used detailed capacity expansion and dispatch modeling to develop and examine 15 scenarios with different levels of solar PV, electricity storage, and operational coordination, focusing on the year 2035. The study also evaluates the benefits of operational coordination among utilities through more efficient regional dispatch and reserve sharing, at different levels of solar and storage. The study focuses on five balancing regions that cover Alabama, Georgia, Kentucky, North Carolina, South Carolina, Tennessee, and parts of Mississippi and Missouri.

14 SOLAR ENERGY↗

DOE OSTI2024

Solar and Storage Integration in the Southeastern United States: Economics, Reliability, and Operations

14 SOLAR ENERGY↗

DOE OSTI2024

Bill Savings vs. Backup Power: Evaluating operational tradeoffs for home solar+storage systems [Slides]

Adoption of residential solar photovoltaic+energy storage systems (PVESS) is driven by both bill savings opportunities and customer demand for backup power. Prior work by this team (Gorman et al., 2022; Gorman et al., 2023) explored PVESS backup power capabilities during long-duration power interruptions (e.g., due to severe weather events), when customers are assumed to be able to anticipate the event and charge their batteries in advance. In many cases, however, power interruptions are unpredictable (and often relatively short); for those types of events, a customer will typically set its battery to maintain some minimum capacity in reserve in case of an interruption, which reduces the capacity available for managing utility bills. This study evaluates this operational tradeoff to help customers and installers configure backup reserve settings, and to inform decision-making more generally about the customer value of backup power services compared to utility bill savings. This study utilizes Berkeley Lab’s PRESTO tool to produce stochastic simulations of (predominantly short-duration) power interruption events, and builds on an earlier case-study demonstrating PVESS backup performance during short-duration interruptions (Baik et al., 2023).

14 SOLAR ENERGY↗

DOE OSTI2025

Hybrid Power Plants for Energy Resilience: A Case Study

As renewable energy technologies are increasingly adopted, they pose an opportunity to improve the sustainability and resilience of distributed grids, especially when their design and operation is coordinated as a hybrid power plant. When included in hybrid power plants, distributed wind turbines in particular have the potential to enhance the resilience of distributed grids in areas with good wind resource, due to their ability to provide more consistent generation and ancillary services as compared to photo-voltaic (PV) solar panels. Despite this benefit, U.S. distributed wind adoption is lower than other comparable renewable energy technologies. In this study, we seek to demonstrate how hybrid power plants that include distributed wind turbines can contribute to distribution grid resilience by meeting loads (especially critical loads) more consistently, increasing reserve capacity, and providing value to customers during outages. To demonstrate these contributions, we integrate three separate frameworks and apply them to a case study in a rural electric cooperative in Iowa. Through this case study, we simulate and compare hybrid power plant design and operation during two hazard events: a tornado that causes a 48-hour distribution outage and a winter weather event that causes a 6-hour generation outage. The inclusion of a hybrid power plant that leverages 1) increased battery duration and 2) advanced forecasting and dispatch strategies that reserve capacity leading up to a hazard event best reduce lost loads as well as diesel consumption that would otherwise be used to meet those loads during short- and long-duration hazard events. Depending on the hybrid power plant capacity and operation, we find that the outage mitigation value of a hybrid power plant (measured in value to customers to avoid an outage and avoided lost revenues for the utility) is significant in both hazard events; adding wind, solar, and battery assets to the existing system adds about $50-$100M in avoided lost load and at least $4-$8k in utility value in the tornado hazard event, and $570k-$2.2M in avoided lost load and at least $220-$650 in utility value in the winter hazard scenario. In both the tornado and winter hazard scenarios, optimizing the operation of the hybrid system for resilience can lend similar value as increasing battery duration by 5 MWh for the lower capacity systems considered.

17 WIND ENERGY↗

DOE OSTI2025

Enhanced Outcrop Methane Capture (Final Project Report)

This report provides the final status of the “Enhanced Outcrop Methane Capture (EOMC) Project” which was focused on drilling two new methane capture wells along the Fruitland Formation Outcrop for capture of methane and carbon dioxide which are naturally seeping from the Outcrop. The EOMC Project was focused on evaluating whether novel horizontal drilling technology will result in improved capture of methane and carbon dioxide which are naturally seeping from the Fruitland Formation Outcrop on Southern Ute tribal trust lands within the Southern Ute Indian Reservation (the “Reservation”).

01 COAL, LIGNITE, AND PEAT↗

DOE OSTI2026

Section 3 Reporting: Preserve America

Brookhaven National Laboratory (BNL) is a multidisciplinary laboratory with seven Nobel Prize-winning discoveries, 37 R&D 100 Awards, and countless advances in science and technology. For over 75 years, the Laboratory has played a leading role in the Department of Energy (DOE) Science and Technology mission and continues to contribute to the DOE’s missions in energy resources, environmental quality, and national security. The Laboratory is operated and managed by Brookhaven Science Associates (BSA), which was founded by the Research Foundation for the State University of New York on behalf of Stony Brook University, and Battelle, a non-profit applied science and technology organization. BNL is committed to longstanding partnerships with researchers, academic institutions, industry, students, teachers, and the surrounding community. BNL is located near the center of Suffolk County on Long Island, New York within Brookhaven Township, about 60 miles east of New York City. Most of BNL’s principal facilities are located near the center of the 5,265-acre (8.23 square mile) site (Figure 1). The developed area encompasses approximately 1,820 acres, consisting of: ▪ 500 acres originally developed by the Army (as part of WW II Camp Upton) and still used for offices and other operational buildings. ▪ 200 acres occupied by large, specialized research facilities. ▪ 520 acres occupied by outlying facilities, such as the Sewage Treatment Plant, research agricultural fields, housing facilities, and fire breaks. ▪ 400 acres of roads, parking lots, and connecting areas. ▪ 200 acres developed for the Long Island Solar Farm. The balance of the site, approximately 3,400 acres, is largely wooded and represents a native pine barrens ecosystem. In November 2000, DOE set aside 530 acres of undeveloped land at BNL as the Upton Ecological and Research Reserve. The Upton Reserve preserves this portion of the pine barrens ecosystem and provides an area for ecological research and education activities.

99 GENERAL AND MISCELLANEOUS↗

DOE OSTI2022

Ch3MS-RF: a random forest model for chemical characterization and improved quantification of unidentified atmospheric organics detected by chromatography–mass spectrometry techniques

Abstract. The chemical composition of ambient organic aerosols plays a critical role in driving their climate and health-relevant properties and holds important clues to the sources and formation mechanisms of secondary aerosol material. In most ambient atmospheric environments, this composition remains incompletely characterized, with the number of identifiable species consistently outnumbered by those that have no mass spectral matches in the literature or the National Institute of Standards and Technology/National Institutes of Health/Environmental Protection Agency (NIST/NIH/EPA) mass spectral databases, making them nearly impossible to definitively identify. This creates significant challenges in utilizing the full analytical capabilities of techniques which separate and generate spectra for complex environmental samples. In this work, we develop the use of machine learning techniques to quantify and characterize novel, or unidentifiable, organic material. This work introduces Ch3MS-RF (Chemical Characterization by Chromatography–Mass Spectrometry Random Forest Modeling), an open-source, R-based software tool, for efficient machine-learning-enabled characterization of compounds separated in chromatography–mass spectrometry applications but not identifiable by comparison to mass spectral databases. A random forest model is trained and tested on a known 130 component representative external standard to predict the response factors of novel environmental organics based on position in volatility–polarity space and mass spectrum, enabling the reproducible, efficient, and optimized quantification of novel environmental species. Quantification accuracy on a reserved 20 % test set randomly split from the external standard compound list indicates that random forest modeling significantly outperforms the commonly used methods in both precision and accuracy, with a median response factor percent error of −2 %, for modeled response factors, compared to > 15 %, for typically used proxy assignment-based methods. Chemical properties modeling, evaluated on the same reserved 20 % test set and an extrapolation set of species identified in ambient organic aerosol samples collected in the Amazon rainforest, also demonstrate robust performance. Extrapolation set property prediction mean absolute errors for carbon number, oxygen to carbon ratio (O : C), average carbon oxidation state (OSc‾), and vapor pressure are 1.8, 0.15, 0.25, and 1.0 (log(atm)), respectively. Extrapolation set out-of-sample R2 for all properties modeled are above 0.75, with the exception of vapor pressure. While predictive performance for vapor pressure is less robust compared to the other chemical properties modeled, random-forest-based modeling was significantly more accurate than other commonly used methods of vapor pressure prediction, decreasing the mean vapor pressure prediction error to 0.24 (log(atm)) from 0.55 (log(atm)) (chromatography-based vapor pressure prediction) and 1.2 (log(atm)) (chemical formula-based vapor pressure prediction). The random forest model significantly advances an untargeted analysis of the full scope of chemical speciation yielded by two-dimensional gas chromatography (GCxGC-MS) techniques and can be applied to gas chromatography coupled with electron ionization mass spectrometry (GC-MS) as well. It enables the accurate estimation of key chemical properties commonly utilized in the atmospheric chemistry community, which may be used to more efficiently identify important tracers for further individual analysis and to characterize compound populations uniquely formed under specific ambient conditions.

54 ENVIRONMENTAL SCIENCES↗

DOE OSTI2025

Technical note: A modified formulation of dynamic energy budget theory for faster computation of biological growth

Abstract. The mass conservation equation in the presence of boundary fluxes and chemical reactions from non-equilibrium thermodynamics is used to derive a modified dynamic energy budget (mDEB) model. Compared to the standard dynamic energy budget (sDEB) model (Kooijman, 2009), this modified formulation does not place the dilution effect in the mobilization kinetics of reserve biomass, and it maintains the partition principle for reserve mobilization dynamics for both linear and non-linear kinetics. Overall, the mDEB model shares most features with the sDEB model. However, for biological growth that requires multiple nutrients, the mDEB model is computationally much more efficient by not requiring numerical iterations for obtaining the specific growth rate. In an example of modeling the growth of Thalassiosira weissflogii in a nitrogen-limiting chemostat, the mDEB model was found to have almost the same accuracy as the sDEB model while requiring almost half of the computing time of the sDEB model. Since the sDEB model has been successfully applied in numerous studies, we believe that the mDEB model can help improve the modeling of biological growth and the associated ecosystem processes in various contexts.

Tang, Jinyun↗