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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 217 records · Page 12

Heat capacity, entropy, formation energy and spin-fluctuation behavior of U 3 Si 5 from 2.4 to 397.4 K

U-Si intermetallic compounds are of considerable interest for their applications as accident-tolerant nuclear fuels. Here we present low-temperature heat capacity (LTHC) measurements of one of the U-Si phases, U 3 Si 5 , using a Quantum Design Physical Properties Measurement System (PPMS) from 2.4 to 397.4 K. We observed an upturn in C p /T (T) below 10 K and have attributed this behavior to potential spin-fluctuations (SF) with an SF temperature (T sf ) of 27 K. An enhancement of LTHC was also observed, as manifested by a large electronic heat capacity coefficient (γ el ) of 342.9 mJ/mol•K 2 . From the heat capacity data, the following thermodynamic parameters were determined: the characteristic Debye temperature (θ D ) over the temperature range 30 – 397 K is 177 ± 2 K, and the standard entropy ($Δ^{298.15}_0$$S^o$) is 283.3 ± 5.7 J•mol -1 •K -1 (equivalent to 35.4 ± 0.7 J•mol -1 •atom -1 •K -1 ). Combined with our previously measured formation enthalpy ($Δ_fH^°_{el}$) of U 3 Si 5 , the Gibbs free energy of formation of U 3 Si 5 from the elements ($Δ_fG^°_{el}$) was determined to be –45.2 ± 9.0 kJ•mol -1 •atom -1 .

36 MATERIALS SCIENCE↗

Correlations for the specific heat capacity of ( U x Pu 1 - x ) 1 - y Gd y O 2 - z derived from molecular dynamics

We report UO 2 is the primary conventional fuel used in most nuclear reactors with Gd 2 O 3 commonly added as a burnable absorber to produce a more level power distribution in the reactor core at the beginning of operation. It can also be mixed with other actinide oxides to produce mixed oxide (MOx) fuel. In this study, molecular dynamics simulations were used to predict the specific heat capacity of Gd-doped PuO 2 , UO 2 and (U, Pu)O 2 MOx accommodating Gd 3+ substituted at cation sites via two charge compensation mechanisms - oxygen vacancy formation and the oxidation of U 4+ to U 5+ . The specific heat capacity values for PuO 2 and UO 2 are in good agreement with other studies showing a distinct peak at high temperatures - above 1800 K. As Gd 3+ is added, the peak height reduces for each composition considered. An analytical fit was applied to the data where Gd 3+ was fully charge compensated by either oxygen vacancies or U 5+ . The expression was then validated by predicting the specific heat capacity for three compositions of (Ux Pu 1-x ) 1-y Gd y O 2-z containing both oxygen vacancies and U 5+ , and compared to molecular dynamics data.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Characterizing electrical panel capacity, breaker space, and loads in U.S. single-family homes

Electrical panels distribute electricity to appliances, equipment, and other building loads and maintain safety by preventing overloads of branch circuits, feeders, and utility service wires connecting homes to the grid. Load calculations in the National Electrical Code (NEC) determine the capacity of installed electrical panels in the United States, which are rated in amps (A). Circuit breakers within electrical panels affect the magnitude and number of loads that panels can serve. In home retrofits and renovations, existing electrical panels may not accommodate new electrical loads, either due to insufficient electrical capacity or a lack of available breaker spaces. Homes with these panel constraints may need to replace existing panels with new panels that have greater capacity and breaker space.

24 POWER TRANSMISSION AND DISTRIBUTION↗

Insight into the deformation features and capacity loss mechanisms of lithium-ion pouch cells under spherical indentation conditions

Mechanical deformation under extreme conditions is one of the important reasons for the failure of lithium-ion batteries in automotive application. However, the deformation features and component failure of lithium-ion cells to external loading has never been a design consideration. Here, in this study, we conduct spherical indentation tests on a dozen of lithium-ion cells with different capacities under different control mode conditions to investigate their deformation features and capacity loss mechanisms. The experimental results show that, under mechanical deformation conditions, internal faults of cells occur in stages, and energy accumulation and sudden release are two key processes of cell's mechanical failure. The cells' state of charge is the main factor affecting their thermal runaway behaviors. In addition, a finite element model is developed to simulate the deformation features and the failure mechanism of key components of lithium-ion pouch cells; the 3D x-ray computed tomography is employed to demonstrate its internal configuration. With this model, the force-strain response, the deformation features as well as the size of the failure area of lithium-ion cells under spherical indentation conditions are accurately predicted. In 3D x-ray computed tomography images, unique mud cracks in cooper current collector are observed, and the influence mechanisms of the isolated fragments on the cell capacities are revealed. These results may provide useful information for the mechanical structure design of the components of lithium-ion pouch cells.

25 ENERGY STORAGE↗

Tin asymmetric membranes for high capacity sodium ion battery anodes

Sodium-ion batteries have attracted tremendous research attention as promising candidates for next generation energy storage systems due to low-cost and high abundancy. Furthermore, comparing to current Li-ion battery technology, limitations on the anode side seriously hinder the cell performance since sodium does not easily intercalate into graphite materials. Here, tin nanoparticles embedded in various asymmetric membrane structures were developed to leverage the high capacity of tin (847 mA h g -1 based on Na 15 Sn 4 ) and accommodate the significant volume expansion for long cycle life. It was demonstrated 762 mA h g -1 reversible capacity at 50 mA g -1 and stable cycling performance over 100 cycles with 92.1% capacity retention at 100 mA g -1 can be achieved for the tin asymmetric membrane electrode synthesized using polysulfone and tin tert-butoxide precursor.

25 ENERGY STORAGE↗

Impact of Charge Voltage on Factors Influencing Capacity Fade in Layered NMC622: Multimodal X-ray and Electrochemical Characterization

Ni-rich NMC is an attractive Li-ion battery cathode due to its combination of energy density, thermal stability, and reversibility. While higher delivered energy density can be achieved with a more positive charge voltage limit, this approach compromises sustained reversibility. Improved understanding of the local and bulk structural transformations as a function of charge voltage, and their associated impacts on capacity fade are critically needed. Through simultaneous operando synchrotron X-ray diffraction (XRD) and X-ray absorption spectroscopy (XAS) of cells cycled at 3–4.3 or 3–4.7 V, this study presents an in-depth investigation into the effects of voltage window on local coordination, bulk structure, and oxidation state. These measurements are complemented by ex situ X-ray fluorescence (XRF) mapping and scanning electrochemical microscopy mapping (SECM) of the negative electrode, X-ray photoelectron spectroscopy (XPS) of the positive electrode, and cell level electrochemical impedance spectroscopy (EIS). Initially, cycling between 3 and 4.7 V leads to greater delivered capacity due to greater lithium extraction, accompanied by increased structural distortion, moderately higher Ni oxidation, and substantially higher Co oxidation. Continued cycling at this high voltage results in suppressed Ni and Co redox, greater structural distortion, increased levels of transition metal dissolution, higher cell impedance, and 3× greater capacity fade.

capacity fading mechanisms↗

Investigating the effect of screen-printed structured graphite electrodes with low tortuosity for high-capacity and fast-charging lithium-ion batteries

A flexible screen-printed graphite electrode was fabricated as an anode for developing fast-charging lithium-ion batteries with low tortuosity. A homogenous anode ink was prepared by mixing graphite as the active material, carbon black (C45) as the conductive additive, and polyvinylidene fluoride (PVDF) as the binder in N-Methyl-2-pyrrolidone (NMP) solvent. The ink was deposited on a flexible copper foil via a stainless-steel screen consisting of an array of pores, that act as secondary pore networks (SPNs), using the screen-printing process. Lithium-ion battery half-cells were assembled using the printed graphite anode, lithium metal foil as the counter electrode, and 1.2 M lithium hexafluorophosphate (LiPF 6 ) in ethyl carbonate: ethyl methyl carbonate (EC: EMC = 3:7) as the electrolyte. The effect of SPNs on the cell performance was investigated by performing formation, rate and cycling tests on the assembled cells, at different C-rates. It was observed that the cells consisting of SPNs with a pore size of 100 μm and edge-to-edge distance of 100 μm between the pores exhibited significantly higher specific capacities of 168 and 129 mAh/g when compared to reference cells without SPNs, which had capacities of 120 and 85 mAh/g, at high C-rates of 4 C and 6 C, respectively. The cells with SPNs also demonstrated excellent cycling performance with ~ 95% capacity retention after 100 cycles at 2 C.

Fast charging lithium-ion battery↗

Market Pricing and Settlements Analysis Considering Capacity Sharing and Reserve Substitutions of Operating Reserve Products

Electricity market pricing and settlement are the key signals for real-time dispatch and long-term investment decisions. Regional transmission operators (RTOs) in the U.S. adopt uniform pricing scheme, which is based on the marginal costs of supplying an incremental MW of electric services. The marginal cost of an electric service is highly dependent on the constraints in the pricing models of RTOs. A slight difference in constraint modeling of pricing model on energy and ancillary services could result in drastically different market clearing prices (MCPs), cleared reserve quantities, and associated revenue. RTOs in the U.S. have various market designs and assumptions in ancillary services modeling in capacity sharing and reserve substitutes. This paper examines four combination models of capacity sharing and reserve substitutes and analyzes the associated market implications. The numerical results present that 1) cascading reserve requirements have direct impact on reserve pricing schemes 2) both cascading reserve requirements and sharing capacity have significant impact on reserve MCPs and locational marginal prices, and thus result in drastically different reserve revenue, energy revenue, generation cost, and generation profit.

ancillary services↗

Global Carbon Budget 1800-2018 Loss of Additional Sink Capacity and Present Transient Difference

A dataset of two global carbon fluxes: the loss of additional sink capacity (LASC) and present versus transient difference (PTD). The loss of additional sink capacity is the loss of indirect anthropogenic sink capacity in land ecosystems caused by the loss of ecosystems that can increase carbon in response to changing environments, primarily forests. The present transient difference refers to the direct anthropogenic flux in land ecosystems (from land cover and land use change) and the difference in that flux when calculated assuming "present day" (actually more like 1980) ecosystem carbon stocks or when calculated assuming transient carbon stocks (i.e. caused by environmental change). In this dataset, the LASC and PTD fluxes were calculated using the TRENDY ensemble of Dynamic Global Vegetation Models (DGVMs; Sitch et al., 2024) following the methods described therein and in Obermeier et al. (2021). For further details see Obermeier et al. (2021), Friedlingstein et al. (2019), Sitch et al. (2024), and Walker et al. (2025). The dataset includes ensemble means and standard deviations for annual fluxes, fluxes cumulated annually over the whole time period, and cumulated since 1959. These data were originally collected to compare different approaches (DGVMs versus bookkeeping models) for estimating land use and land cover change (LULCC) emissions (Obermeier et al. 2021). More recently, and similarly, these data were used to harmonize the estimates of the direct and indirect anthropogenic fluxes in the global carbon cycle and to recalculate the global carbon budget (Walker et al., 2025).

54 ENVIRONMENTAL SCIENCES↗

USAID Haiti Training Session #3: Capacity Expansion [Slides]

Welcome to Engage! Engage is a capacity expansion modeling tool supported by the National Renewable Energy Laboratory and based on the Calliope open-source capacity expansion model developed by the ETH Zurich University, maintained at the TU Delft University. Engage is an accessible (free, open-access, web-hosted) and flexible web-based energy system planning application for rapid multiple-energy-form energy system scenario exploration. Its cloud-based, collaborator-sharable data model, intuitive interface and visualization capabilities facilitate collaboration and communication among teams, with experts, and among diverse stakeholder groups exploring energy system implications from district to national-scale models. This training series was developed under USAID to empower Haitian stakeholders to explore modeling scenarios in Engage to develop a Haiti Energy Master Plan. This training series includes a general overview of how Engage works along with tailored exercises that target Haiti's specific energy needs, such as modeling the capacity expansion of the bulk power system, fuel scarcity challenges, the development of microgrids, and the economic viability of transmission strategies. See NREL/PR-7A40-89365 for the French translation of this document.

24 POWER TRANSMISSION AND DISTRIBUTION↗

Hosting Capacity Improvement Method Using MV–MV Solid-State-Transformer

As a large number of distributed generations are connected to the distribution system, research on the hosting capacity is actively being conducted. In particular, various methods, such as smart inverter functionality, co-located energy storage systems (ESS), and the use of on-load tap changers (OLTC), have been proposed to improve the hosting capacity. In this paper, a method to improve the hosting capacity by utilizing a solid-state transformer (SST) and its unique control capability is proposed. Lastly, the proposed method is verified in the distribution system of the Republic of Korea using the OpenDSS program.

24 POWER TRANSMISSION AND DISTRIBUTION↗

Cyclic Prefix Direct Sequence Spread Spectrum Capacity Analysis

Cyclic Prefix Direct Sequence Spread Spectrum (CP-DSSS) is a novel waveform that has the potential to solve 5G objectives such as ultra reliable low latency communication (URLLC) and massive machine Type Communication (mMTC). This paper analyzes the capacity of the CP-DSSS waveform in comparison with Orthogonal Frequency Domain Multiplexing OFDM). CP-DSSS can be optimized to achieve the same capacity as OFDM when optimized by the water-filling algorithm. A significant advantage for CP-DSSS is that this capacity can be achieved with all symbols being transmitted with the same effective rate. As a result, stronger forward error correction codes can be used in a CP-DSSS implementation compared to an OFDM implementation with resource block constraints. In addition, the applicability of CP-DSSS as a waveform for a secondary network operating in the same frequency band as the primary network is discussed.

5G and Beyond Communications↗

County-Level Hourly Renewable Capacity Factor Dataset for the ReEDS Model

This dataset contains hourly capacity factors for each renewable resource class and region (in this case, county). Technologies like large-scale utility PV (UPV), onshore wind, offshore wind, and concentrating solar power (CSP) are included. The dataset contains 7 years of hourly weather data (2007-2013) for different sites across the US and is used as one of the inputs to the ReEDS-2.0 model (see the "ReEDS 2.0 GitHub Repository" resource link below), developed by NREL. The weather profiles apply to any capacity that exists or is built in each region and class. This helps calculate the generation that can be provided using these resources. Open, reference, and limited are 3 scenarios based on land-use allowance, derived from the Renewable Energy Potential (reV) model developed by NREL, which helps generate supply curves for renewable technologies and assess the maximum potential of renewable resources in a designated area. Each zipped file in this dataset corresponds to a technology and contains the respective land-use scenario files required to run that technology in ReEDS. To use this dataset, download and place the extracted files in the locally cloned ReEDS repository inside one of the folders (inputs/variability/multi_year). After completing this copy, upon running the ReEDS model at the county-level spatial resolution for respective analysis purposes, the program will detect the presence of these files and will not fail.

Array↗

Tailoring the Redox Reactions for High-Capacity Cycling of Cation-Disordered Rocksalt Cathodes

Cation-disordered rocksalts (DRXs) have emerged as a new class of high-capacity Li-ion cathode materials. One unique advantage of the DRX chemistry is the structural flexibility that substantially lessens the elemental constraints in the crystal lattice, such as Li content, choice of transition metal redox center paired with appropriate d 0 metal, and incorporation of F anion, which allows optimization of the key redox reactions. Herein, a series of the DRX oxyfluorides based on the Mn redox have been designed and synthesized. By tailoring the stoichiometry of the DRX compositions, high-capacity cycling by promoting the cationic Mn 2+ /Mn 4+ redox reactions while suppressing those from anionic O is successfully demonstrated. A highly fluorinated DRX compound, Li 1.2 Mn 0.625 Nb 0.175 O 1.325 F 0.675 (M 0.625 F 0.675 ), delivers a capacity of ≈170 mAh g -1 at C/3 for 100 cycles. Furthermore, this work showcases the concept of balancing the cationic and anionic redox reactions in the DRX cathodes for improved electrochemical performance through the rational composition design.

25 ENERGY STORAGE↗

A High Potential, Low Capacity Fade Rate Iron Complex Posolyte for Aqueous Organic Flow Batteries

An iron complex, tris(4,4'-bis(hydroxymethyl)-2,2'-bipyridine) iron dichloride is reported, which operates at near-neutral pH with a redox potential of 0.985 V versus SHE. This high potential compound is employed in the posolyte of an aqueous flow battery, paired with bis(3-trimethylammonio)propyl viologen tetrachloride in the negolyte, exhibiting an open-circuit voltage of 1.3 V at near-neutral pH. It demonstrates excellent cycling performance with a low temporal capacity fade rate of 0.07% per day over 35 days of cycling. The extended cycling lifetime is the result of low permeability and improved structural stability of the newly developed iron complex compared to that of the iron tris(bipyridine) complex. The combination of high redox potential and low capacity fade rate compares favorably with those of all previously demonstrated organic and organometallic aqueous posolytes. Extensive investigation into the possible degradation mechanisms, including post-mortem chemical and electrochemical analyses, indicates that stepwise ligand dissociations of the iron complex are responsible for the reported capacity loss during cell cycling. Further, this investigation provides unprecedented insight to guide further improvements of such metalorganic compounds for energy storage and conversion applications.

25 ENERGY STORAGE↗

Lanthanum induced lattice strain improves hydrogen sulfide capacities of copper oxide adsorbents

This work probes the effects of La on reactions involving CuO sorbents and H 2 S in gaseous streams. La-CuO sorbents with nominal La/Cu atomic ratios of 1:2 achieved higher capacities (27 and 36 g H 2 S per 100 g sorbent) compared to CuO sorbents (25 g H 2 S per 100 g sorbent). Here, comparison of the La-CuO sorbents using energy dispersive x-ray spectroscopy and La L 3 -edge XAS suggested that increased capacity resulted from more uniform dispersion of La within the CuO phase (3.3 wt.% vs. 1.0 wt.% La). X-Ray absorption near edge structure analysis suggested more electron-rich Cu species in La-CuO samples, while extended X-ray absorption fine structure modeling showed an increase in single-scattering path lengths for neighboring and near-neighbor atoms. These changes suggest that La induces strain in the Cu-O lattice, thereby increasing H 2 S capacity by reducing energy barriers associated with surface reactions between oxygen atoms and adsorbed H 2 S molecules.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Understanding the Benefit of Hybrid Electrolytes towards Vanadium Dissolution Suppression and Improved Capacity Retention in Zinc‐Aqueous Batteries Using NaV 3 O 8 Cathodes

Vanadate cathodes used in aqueous Zn-ion batteries with ZnSO 4 are hindered by capacity loss from V dissolution into the electrolyte. However, studies pinpointing the onset of dissolution as a function of electrochemical redox state and quantifying the amount of associated active material are lacking. To prevent dissolution of the NaV 3 O 8 active material, Na + ions are introduced into the electrolyte. Specifically, a hybrid ZnSO 4 + Na 2 SO 4 electrolyte is investigated in concert with NaV 3 O 8 (NVO) cathodes of varied crystallinity to determine the resulting impacts on cathode dissolution and functional electrochemistry. The use of Na + -containing hybrid electrolyte shows no significant change in Zn 2+ diffusion coefficients yet improved capacity retention. Time-resolved quantitative optical emission spectroscopy demonstrates the suppression of V dissolution with the hybrid electrolyte in both pristine and cycled electrodes. Operando synchrotron X-ray diffraction and absorption provide mechanistic insights. Hydrated NVO with wider interplanar spacing exhibits much higher H + /Zn 2+ capacity, while the Na 2 SO 4 mitigates the formation of irreversible side products. Furthermore, this study demonstrates that the use of hybrid electrolytes and control of crystallite size in the parent material can significantly improve electrochemical behavior of layered V-based cathodes in Zn-ion batteries, providing a general strategy toward safe and resilient aqueous battery systems.

36 MATERIALS SCIENCE↗

Synthesizing High-Capacity Oxyfluoride Conversion Anodes by Direct Fluorination of Molybdenum Dioxide (MoO 2 )

High-capacity metal oxide conversion anodes for lithium-ion batteries (LIBs) are primarily limited by their poor reversibility and cycling stability. In this study, a promising approach has been developed to improve the electrochemical performance of a MoO 2 anode by direct fluorination of the prelithiated MoO 2 . The fluorinated anode contains a mixture of crystalline MoO 2 and amorphous molybdenum oxyfluoride phases, as determined from a suite of characterization methods including X-ray diffraction, Raman spectroscopy, and X-ray photoelectron spectroscopy, and scanning transmission electron microscopy. Electrochemical measurements indicate that fluorination facilitates the conversion reaction kinetics, which leads to increased capacity, higher coulombic efficiency, and better cycling stability as compared to the nonfluorinated samples. Overall, these results suggest that fluorination after prelithiation not only favors formation of the oxyfluoride phase but also improves the lithium-ion diffusivity and reversibility of the conversion reaction, making it an attractive approach to address the problems of conversion electrodes. These findings provide a new route to design high-capacity negative electrodes for LIBs.

25 ENERGY STORAGE↗