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DOE OSTI2023

Thermal Effects in Binary Neutron Star Mergers

Abstract We study the impact of finite-temperature effects in numerical-relativity simulations of binary neutron star mergers with microphysical equations of state and neutrino transport in which we vary the effective nucleon masses in a controlled way. We find that, as the specific heat is increased, the merger remnants become colder and more compact due to the reduced thermal pressure support. Using a full Bayesian analysis, we demonstrate that this effect will be measurable in the postmerger gravitational wave signal with next-generation observatories at signal-to-noise ratios of 15.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

DOE OSTI2023

Summertime ozone pollution in China affected by stratospheric quasi-biennial oscillation

In recent years, the near-surface ozone (O 3 ) level has been rising fast in China, with increasing damage to human health and ecosystems. In this study, the impact of stratospheric quasi-biennial oscillation (QBO) on interannual variations in summertime tropospheric O 3 over China is investigated based on GEOS-Chem model simulations and satellite retrievals. QBO has a significant positive correlation with near-surface O 3 concentrations over central China (92.5–112.5° E, 26–38° N) when the sea surface temperature (SST) over the eastern tropical Pacific is warmer than normal, with a correlation coefficient of 0.53, but QBO has no significant effect on O 3 under the cold SST anomaly. Compared to the easterly phase of QBO, the near-surface O 3 concentrations have an increase of up to 3 ppb (5% relative to the average) over central China during its westerly phase under the warm SST anomaly. O 3 also increases above the surface and up to the upper troposphere, with a maximum increase of 2–3 ppb (3%–5%) in 850–500 hPa over central China when comparing westerly phase to easterly phase. Process-based analysis and sensitivity simulations suggest that the O 3 increase over central China is mainly attributed to the anomalous downward transport of O 3 during the westerly phase of QBO when a warm SST anomaly occurs in the eastern tropical Pacific, while the local chemical reactions and horizontal transport processes partly offset the O 3 increase. This work suggests a potentially important role of QBO and the related vertical transport process in affecting near-surface O 3 air quality, with an indication for O 3 pollution prediction and prevention.

54 ENVIRONMENTAL SCIENCES↗

DOE OSTI2025

Modeling the mechanisms of coastal vegetation dynamics and ecosystem responses to changing water levels

Coastal forests are increasingly experiencing mortality due to inundation by fresh- and seawater, leading to their replacement by marshes. These shifts alter vegetation composition, biogeochemical cycling, carbon storage, and hydrology. Using a hydraulically enabled ecosystem demography model (FATES-Hydro), we conducted numerical experiments to investigate the mechanisms behind inundation-driven forest loss and the ecosystem-scale consequences of forest-to-marsh transitions. We compared mortality processes and their effects across broadleaf and conifer trees at two coastal sites – Lake Erie (freshwater) and Chesapeake Bay (saline). Our simulations show that hydraulic failure, driven by root loss under prolonged flooding, is the primary mortality mechanism across both tree types and sites. Forest replacement by marsh reduced ecosystem-scale leaf area index (LAI), gross primary production (GPP), transpiration, and deep soil water uptake in conifer forests, while broadleaf forests experienced smaller changes due to lower initial LAI and greater marsh compensation. Marsh invasion occurred following canopy thinning driven by tree mortality. These findings suggest that, under similar root loss, hydraulic failure dominates coastal tree mortality regardless of species or water type, with denser forests experiencing stronger ecosystem impacts. Our study identifies key mortality mechanisms and offers testable hypotheses for future empirical studies on coastal vegetation change.

Ding, Junyan [Occidental College, Los Angeles, CA ↗

DOE OSTI2026

Reductions in wind farm main bearing rating lives resulting from wake impingement

This paper studies the impacts of wake impingement on main bearing rating lives predicted during the wind turbine design stage. A computational tool chain was developed to explore and quantify these effects across a wind farm populated by 10 MW wind turbines. Wind field and turbine load modelling was undertaken using the Dynamiks Python package, including application of a dynamic wake meandering model. The ISO 281 basic bearing rating life formulation was subsequently applied in order to evaluate impacts from wake effects. Analyses included a two-turbine parametric analysis, followed by a full wind farm analysis undertaken for the TotalControl 32-turbine reference wind farm, including full wind rose simulations across all operational wind speeds. Site conditions were accounted for using a Weibull wind speed distribution and a range of parametric wind direction rose models. Results indicate that wind farm main bearing rating lives are negatively impacted by the effects of wake impingement, resulting in rating life reductions for the analysed wind farm of the order of 16 % on average and as much as 20 %–25 %, both for the locating main bearing. Despite these high sensitivities, it is important to note that these resultant rating lives (i.e. the predicted lives) still far exceed the standard wind turbine operational lifetimes of 20–30 years. Wake impacts were also found to be asymmetrically related to the side on which the rotor is impinged, suggesting that, for the main bearing, there may be a “better” side for wake impingement to occur. Rating life sensitivities to wind rose shape were also observed. While these findings must be interpreted with due consideration for the various methodological limitations present, they provide compelling evidence that wake effects at the wind farm level should necessarily be included when undertaking main bearing operational load modelling, rating life assessment, or other load-related analyses.

17 WIND ENERGY↗

DOE OSTI2021

Working With Your Utility Series: Interconnection Basics

This training provided information on interconnection basics for federal agencies developing distributed energy projects. Considerations covered included: Understanding interconnection processes and timelines, interconnection siting considerations, technology-specific interconnection issues, and interconnect agreements. This webinar is the first in a multi-part series on working with electric utilities to develop distributed energy projects on federal sites.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2022

System Resilience Benefits of Dual-Fuel Capable Generators

The growing dependency on natural gas (NG) for power generation raises challenges for ensuring the resilience of power systems during extreme cold weather. Dual-fuel capable generators that can switch from burning NG to distillate fuel oil during an NG shortage over one way to alleviate these challenges. In this study, the impacts of gas unavailability on the IEEE 73-bus reliability test system (RTS) with 2019 updated generation mixture are explored. An extension to the standard production cost model formulation of unit commitment and economic dispatch is proposed to allow the representation of dual-fuel capable generators that can switch fuels between NG and distillate oil with a specified oil tank capacity and tank refueling capability. The operation of the system under gas unavailability with 0%, 25%, 50%, 75%, and 100% of combined cycle and combustion turbine generators as dual-fuel capable with a one-day supply of fuel oil are simulated using PLEXOS, a production cost model. The dual-fuel generator performance, unserved energy, and system costs are fully assessed.

dual-fuel capable generator↗

DOE OSTI2022

Market-Integrated Optimization of Wind-Battery-Hydrogen Hybrids for Peaking Capacity via Storage

As Integrated Energy Systems (IES) combine multiple energy and storage technologies to provide potentially more value and less risk via resource diversification, complementary overbuild, increased flexibility, and revenue-stacking, IES value is dependent on electricity market dispatch and grid interactions should play an important role in IES design and operation. This study hybridizes and retrofits wind and combustion turbine plants to study the impacts of replacing gas generation capacity with wind, battery, PEM electrolysis, hydrogen tanks and hydrogen turbines. The optimized design is co-simulated in a production cost model with different bidding strategies in order to compare performance and highlight the importance of grid-interactions. We analyze the revenue and dispatch changes as well as the price and cost implications of wind-battery-hydrogen IESs.

electrolysis↗

DOE OSTI2023

First-of-a-Kind Fuel-bearing Molten Chloride Irradiation Experiment

Molten salt reactors (MSRs) have garnered increasing attention recently with several demonstration efforts on the way. A key challenge to the licensing basis for these reactors is the lack of experimental data on fueled salts. This is expected to be crucial to the safety evaluation and licensing basis of reactors of this type deployed in the future. While capability for irradiating molten salts has been reestablished in the recent decade, no enriched fuel irradiation capability has been developed and tested as of yet. A new experiment vehicle under development at Idaho National Laboratory (INL) is presented here. The Molten-salt Research Temperature-controlled Irradiation (MRTI) experiment was developed to host enriched uranium bearing salt samples to be irradiated at a test reactor within the lab complex. One of the key scientific objectives is to provide irradiated salt samples for post-irradiation examination (PIE) to study the impact of fission product generation and neutron/gamma radioactivity on the salt solution and salt-facing wall material. This paper provides a detailed overview of the mechanical design of the experiment, followed by an overview of the fabrication and assembly of an initial prototype vehicle (with non-fuel-bearing salt). A summary of the key analyses conducted as a part of the performance and safety evaluation is then provided. Lastly, an overview of the test conducted in prototypic out-of-pile (non-neutron) environment are shown. These evaluations provide the foundation for a planned irradiation of an enriched uranium-bearing chloride salt sample in the near term. The upcoming irradiation will contain 13 cm3 of UCl3-NaCl salt (93% enrichment) generating around 20 W/cm3 of fission energy during irradiation and a temperature range that can be contained between bounds of 525-900°C.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

DOE OSTI2021

Additive Manufacturing of Lightweight Structures: Microfibrillated Cellulose – PLA Biofoams

Extrusion-based polymer additive manufacturing (AM) technology is growing rapidly. The introduction of fiber reinforced feedstock materials and recent developments in the manufacturing systems have promulgated large scale AM of composites to create new industries and applications. Synthetic fibers such as carbon and glass fibers are commonly used to reinforce polymer composites. However, increasing environmental and long-term sustainability concerns are leading to new materials using cellulose fiber reinforcement in bio-derived polymers. These materials offer new property sets, new supply chains and have the potential to provide economical solutions leading to new applications. Large scale AM can be attractive for many different applications because of its ability to freeform manufacture complex geometries; each application may require different material properties. One of the novel application areas for large scale AM is 3D printing of lightweight materials via foaming. Although achieving low density is the key in light weighting via foaming, mechanical performance is also important for many applications. In this study the impact of micro-cellulose fibers (MFC) on foaming behavior and the mechanical properties of additively manufactured parts is investigated. MFC-polylactic acid (PLA) feedstock pellets were prepared at varying MFC content (5, 10, 15 and 20 wt.%) to understand the impact of cellulose fiber content on density and mechanical properties of the AM biocomposites. Also, the impact of extrusion speed and foaming agent content on the AM biocomposites is investigated. Although achieving uniform printed foam structure is challenging with the presence of cellulose fibers, promising results were accomplished with density values below 0.5g/cm3.

Tekinalp, Halil↗

DOE OSTI2025

Distributed Coordination of Demand-side Flexible Resources in Microgrid with All-Time Feasibility

The prevalence of distributed renewable generators motivates microgrid operators to exploit demand-side flexible resources (DFRs). Due to their dispersed nature, distributed DFR coordination has been a vibrant research area, while there are several issues awaiting to be addressed. On one hand, DFR power is internally coupled through power flow, while DFR usually cannot access grid information. On the other hand, in time-restricted scenarios, solution feasibility cannot be guaranteed by conventional dual-based algorithms. To fill these gaps, we propose a distributed DFR coordination framework with all-time feasibility. The proposed framework accounts for the distinct access of microgrid entities to grid information. A distributed and all-time feasible algorithm is proposed for optimal DFR coordination, which allows DFRs to make local decisions without violating constraints throughout iterations. The effectiveness of the proposed algorithm is demonstrated through case studies. The impact of peer-to-peer communication links on algorithm convergence is also investigated, which emphasizes the balance between communication investment and algorithm performance.

Li, Hongyi [Iowa State Univ., Ames, IA (United Sta↗

DOE OSTI2025

Characterization of Coal Refuse Sites in West Virginia: Stream Loss, Volume Estimation, and Land Cover Analysis for Restoration Feasibility

Coal refuse disposal across Appalachia has resulted in widespread environmental degradation, including stream burial, landscape destabilization, and long-term hydrologic impacts. This study provides a GIS-based spatial characterization of 623 coal refuse sites in West Virginia, evaluating their potential for ecological and economic restoration. Stream loss was quantified through digitization of historic topographic maps, revealing over 194,500 meters of historically present streams lost, with 105,000 meters directly buried beneath refuse piles. Volume estimation using empirical Bayesian kriging and modern LiDAR surfaces indicated approximately 1.96 billion cubic meters of deposited refuse. Land cover analysis based on NAIP-derived classification showed that 48% of the total site area was forested, while 15% remained barren. These results highlight not only the environmental footprint of legacy refuse deposits but also their potential for restoration through stream daylighting and beneficial reuse. Emerging opportunities, including rare earth element recovery and mitigation banking, may offer economic incentives to facilitate reclamation. This work establishes a spatial framework to prioritize refuse sites for restoration, balancing ecological uplift with feasible material management strategies.

58 GEOSCIENCES↗

DOE OSTI2021

Parametric Study of SANSMIC Input and Resulting Impact on Predicted Cavern Geometry and Leaching Efficiency

The Sandia Solution Mining Code (SANSMIC) has been used for many years to examine the development of salt cavern geometry, both in a confirmatory manner with comparisons made to real-world sonar data and in a predictive manner when updated sonar data are not available. SANSMIC models require some modeling choices in order to incorporate real-world data. Key modeling choices include the vertical resolution of cavern geometry to implement, as well as how to incorporate daily raw water injection data into the SANSMIC model. This report documents five studies that address the impact of the modeling choices on the predicted cavern geometries and calculated leaching efficiencies. In most cases, hypothetical cylindrical initial cavern geometries are used to provide a common baseline against which to test the systematic variation of input variables including cavern radius, oil-brine-interface (OBI) depth, vertical cell size, raw water injection rate, raw water injection duration, workover time, and number of leaching stages. The use of smaller cell sizes is recommended moving forward to provide a better one-to-one relationship between sonar data and the modeled cavern. A new methodology for incorporating raw water injection data is also recommended, in order to more closely model real-world injection and workover times. Overall, the systematic studies performed here have increased our confidence in previous SANSMIC model results, as well future use of the code for predicting leaching effects on cavern geometries. Some minor changes to modeling choices are recommended, which can easily be applied with the version of SANSMIC currently under development.

42 ENGINEERING↗

DOE OSTI2022

A discussion on various experimental methods of impact ionization coefficient measurement in GaN

Impact ionization coefficients play a critical role in semiconductors. In addition to silicon, silicon carbide and gallium nitride are important semiconductors that are being seen more as mainstream semiconductor technologies. As a reflection of the maturity of these semiconductors, predictive modeling has become essential to device and circuit designers, and impact ionization coefficients play a key role here. Recently, several studies have measured impact ionization coefficients. We dedicated the first part of our study to comparing three experimental methods to estimate impact ionization coefficients in GaN, which are all based on photomultiplication but feature characteristic differences. The first method inserts an InGaN hole-injection layer, the accuracy of which is challenged by the dominance of ionization in InGaN, leading to possible overestimation of the coefficients. The second method utilizes the Franz–Keldysh effect for hole injection but not for electrons, where the mixed injection of induced carriers would require a margin of error. The third method uses complementary p–n and n–p structures that have been at the basis of this estimation in Si and SiC and leans on the assumption of a constant electric field, and any deviation would require a margin of error. In the second part of our study, we evaluated the models using recent experimental data from diodes demonstrating avalanche breakdown.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

DOE OSTI2022

Computational Design of a Simple Flyer Plate Launcher

The response of materials to shock loading is important to understand for a variety of applications. When shock physics emerged during and after WWII, direct explosive loading or explosively driven plate impact was the primary tool for these studies. Subsequent decades have seen the widespread use of large caliber guns for plate impact studies, laser-shock facilities and pulsed power facilities. INL currently lacks a gun suitable for plate impact or explosives casting and machining facilities; however, it does possess explosives use and handling capabilities. An option for performing plate impact experiments was needed, therefore continuum scale models were utilized to explore a few simple donor-acceptor explosive plane wave lens designs, one of which could be hand packed with plastic explosives to launch flyer plates. 2D simulations were performed to study different geometries in an effort to minimize the difference in shock arrival across the central portion of a small copper flyer plate. A shock wave arrival time difference under 50 ns across 50 percent of the center of the flyer was achieved with a few designs. This work summarizes the computational models and results.

36 MATERIALS SCIENCE↗

DOE OSTI2023

Toward More Efficient Organic Solar Cells: A Detailed Study of Loss Pathway and Its Impact on Overall Device Performance in Low‐Offset Organic Solar Cells

Abstract Low‐offset organic solar cell systems have attracted great interest since nonfullerene acceptors came into the picture. While numerous studies have focused on the charge generation process in these low‐offset systems, only a few studies have focused on the details of each loss channel in the charge generation process and their impact on the overall device performance. Here, several nonfullerene acceptors are blended with the same polymer donor to form a series of low‐offset organic solar cell systems where significant variation in device performance is observed. Through detailed analyses of loss pathways, it is found that: i) the donor:acceptor interfaces of PM6:Y6 and PM6:TPT10 are close to the optimum energetic condition, ii) energetics at the donor:acceptor interface are the most important factor to the overall device performance, iii) exciton dissociation yield can be field‐dependent owing to the sufficiently small energetic offset at the donor:acceptor interface, and iv) the change in substituents in the terminal group of Y‐series acceptors in this work mainly affects energetics at the donor:acceptor interface instead of the interface density in the active layer. In general, this work presents a path toward more efficient organic solar cells.

14 SOLAR ENERGY↗

DOE OSTI2020

Achieving Productivity to Recover and Restore Columbia River Stream-Type Chinook Salmon Relies on Increasing Smolt-To-Adult Survival

Abstract We analyzed and compared productivity and survival rates of populations of stream-type Chinook Salmon Oncorhynchus tshawytscha from the upper and middle ranges of their distribution in the Columbia River basin. These two groups of populations undergo vastly different exposures during migration through the Federal Columbia River Power System (FCRPS). Declines of the Snake River populations, listed as threatened under the U.S. Endangered Species Act, have been associated with the development and operation of the FCRPS. In contrast, John Day River stream-type Chinook Salmon populations, which were less affected by the FCRPS, have declined to a lesser extent and are not listed. Smolt-to-adult survival rates (SARs) accounted for a majority of the variation in life cycle survival rates of Snake River Chinook Salmon. Productivity declined to 13% and 44% of historical productivity levels for Snake River and John Day River populations, respectively. A synthesis of previous studies contrasting anthropogenic impacts between the two regions supports the conclusion that FCRPS impacts explain the large difference in population productivity. Our results suggest that SARs of 4% would result in an expected productivity of up to 70% of historical levels (a SAR level consistent with regional restoration objectives). The SARs have been shown to be highly influenced by conditions within the FCRPS (e.g., water velocity and passage through dam powerhouses). Marine conditions also influence SARs; however, meaningful management actions are only available to affect conditions within the FCRPS. Given the importance of SARs to overall life cycle productivity, recovery and restoration strategies need to prioritize actions that have potential to substantially increase SARs by addressing the significant impacts of main-stem dams. This study highlights the importance of considering river management options in the face of increasingly variable and warming ocean conditions.

Petrosky, Charles E.↗

DOE OSTI2024

Impact of refrigerant undercharge faults on building indoor conditions and HVAC system operation in residential Buildings: A simulation study

This study investigates the impact of refrigerant undercharge on indoor temperature and HVAC system performance in residential buildings. Simulation models for typical residential buildings in Orlando, FL and Indianapolis, IN were developed using the ResStock database. A refrigerant undercharge fault model was then applied to the simulations with varying levels of fault intensity. The paper offers an extensive analysis, revealing that variations in supply air temperature, equipment runtime, and cooling energy consumption due to the level of refrigerant undercharge faults are notably significant on a summer representative day. Similarly, on a winter representative day, changes in supply air temperature and runtime are significant as well as changes in supplemental heat energy consumption. We find that occupants may remain oblivious to these faults during the cooling season, particularly when the HVAC system is oversized; in that case, supply air temperature data could help detect a fault. Another challenge is that during the heating season, when the supplemental heater operates, it is difficult to identify a refrigerant undercharge fault using only indoor and supply air temperature data. Finally, this study finds that supply air temperature, equipment runtime, and supplemental heater energy consumption data can help in detecting refrigerant undercharge faults.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

DOE OSTI2026

Impact of Porous Transport Layer In-Plane Conduction on Spatially Resolved Current and EIS Measurements in a Proton Exchange Membrane Water Electrolyzer

An XY segmented cell was developed for low temperature PEM water electrolysis (PEMWE). The system can assess the local performance by enabling in situ measurements of spatial currents and impedances. In this work, we show through experiments, as well as through modelling work, that the porous transport layer (PTL) must be segmented to eliminate crosstalk. Accurate measurements are only possible when crosstalk is fully eliminated. The XY segmented cell is applied to a case study characterizing the impact of a PTL platinum coating void on spatial performance. The localized performance impact of the coating void is found to be orientation specific: coating voids facing the catalyst layer reduce performance significantly more than coating voids facing the flow field. The results suggest that the tolerances for PTL coating uniformity can be lower at the side facing the flow field. The work showcases the feasibility of the XY segmented cell for impact assessment studies. The presented XY segmented cell enables the characterization of spatial phenomena in PEMWE devices and is envisioned to support modeling efforts and the investigation of manufacturing related tolerances for mass produced PEMWE devices.

08 HYDROGEN↗