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Mechanically strengthened heterogeneous Sm-Co sintered magnets

Samarium-cobalt sintered magnets offer excellent magnetic properties, thermal stability, and corrosion resistance. They are used in a variety of defense and civilian applications, especially when elevated operation temperatures (e.g., 200 ºC to 550 ºC) are required. However, the utilization of these materials is restricted by their brittleness. Improving their mechanical resilience would make them more cost-effective, efficient, and robust in decarbonization and other function-related applications while reducing the pressure on critical material supply chains. In this paper, we engineer a series of novel heterogeneous microstructures, such as laminated coarse grain (CG)/fine grain (FG) and core/shell CG/FG microstructures, to produce unprecedented combinations of superior mechanical and magnetic properties without altering the chemical compositions of the magnets or common heat treatment procedures. Further, a 60% flexural strength enhancement is obtained using heterogeneous Sm 2 (CoFeCuZr) 17 sintered magnets with little impact on their magnetic properties. The mechanically robust heterogeneous Sm-Co sintered magnets have a minor (e.g., less than 4.6%) reduction in the energy product (BH) max due to a slightly reduced squareness of the demagnetization curve, with no decrease in either the remanence (B r ) or the intrinsic coercivity (H ci ). The flexural strengths of these heterogeneous Sm-Co magnets depend on the volume ratios and mean grain sizes of the FG/CG regions, as well as their microstructural architectures. The fine-grained regions act as mechanical strengthening sites, which can be strategically used when designing the magnet for different applications. This technology is highly compatible with existing magnet manufacturing processes and thus can be adopted readily by the magnet industry.

36 MATERIALS SCIENCE↗

Unveiling the porosity effect of superbase ionic liquid-modified carbon sorbents in CO 2 capture from air

Direct air capture (DAC) of CO 2 represents one of the most promising technologies to achieve negative carbon emissions. In this work, the superbase ionic liquids (ILs)-modified carbon substrates were developed for DAC of CO 2 by harnessing the strong CO 2 binding capability of IL and the ordered porous channels of the carbon supports. Detailed porosity analysis revealed that the IL with an aromatic cation and an oxygenate anion preferred to fill the micropores, and a thin layer was created on the surface of the mesopores. Strong π-π interaction between the IL layer and the carbon surface was disclosed by wide-angle X-ray scattering (WAXS) analysis, leading to enhanced thermal stability of the IL phase. For the same lL coating amount, the DAC of CO 2 evaluation revealed that a larger mesopore size and pore volume in the carbon/IL composite materials led to higher CO 2 uptake capacity by exposing more active sites to integrate CO 2 from diluted sources. Further, the thermodynamic analysis confirmed the critical role of IL coating in providing strong chemisorption sites and significantly improved selectivity to enrich the diluted CO 2 from the air atmosphere. This work provides guidance on leveraging the scaffolds' surface properties and porosities of the scaffolds to optimize DAC of CO 2 behavior.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Structural effects of composition tuning in A-site disordered perovskite La0.5Li0.5−xMxTiO3 (M = Na, K) nanorods for fast interfacial transport for solid composite electrolyte design

Polymer-ceramic composite electrolytes (CPE) have emerged as promising replacements for currently used liquid organic electrolytes, which pose as safety hazards, in Li-ion batteries. Limits in conductivity enhancement in CPEs is often attributed to a high resistance for Li-ion transport along the interface due to the incompatibility of the polymer and ceramic phases. A clear understanding of the interfacial structure and how this impacts interfacial Li-ion transport is needed in order to efficiently design a CPE with optimal ionic conductivity. In this study, density functional theory (DFT) calculations, in conjunction with scanning transmission electron microscopy (STEM) and electron energy loss spectroscopy (EELS), are used to unveil the bulk and surface structure of La0.5Li0.5−xMxTiO3 (M = Na, K) (LMTO) nanorods, a newly-reported ceramic system with promising applications in CPEs, and the LMTO interactions with the poly(lithium sulfonyl (trifluoromethane sulfonyl)imide methacrylate) (p(MTFSILi)) polymerized ionic liquid. Substitution of lithium for sodium and potassium onto the A-site perovskite lattice is shown to increase the stability of the preferred pseudocubic perovskite phase because of their increased cation size which allows them to reduce the TiO6 octahedral rotations in the bulk and at the surface. STEM and EELS results show that LMTO nanorods with differing compositions have Ti-enriched (110)-oriented surfaces. Increased sodium and potassium compositions in LMTO is also shown using the DFT calculations to weaken the binding of the lithium atom to the MTFSI unit when LiMTFSI is adsorbed to the LMTO surface. This weakening of lithium binding to the polymer at the LMTO interface indicates that the lithium mobility is increased, correlating to an increase in interfacial Li-ion transport. Overall, this work provides insights into how to tune the interfacial interactions between the polymer (p(MTFSI)) and ceramic (LMTO) for optimal CPE design.

Shepard, Lauren B [Pennsylvania State University, ↗

Ground-state phase diagram and superconductivity of the doped Hubbard model on six-leg square cylinders

Here, we have studied the ground state properties of Hubbard model on long six-leg square cylinders with doped hole concentration per site 5.55%≤δ≤12.5% using density-matrix renormalization group. By keeping a large number of states for long system sizes, we find that the nature of the ground state is remarkably sensitive to the presence of next-nearest-neighbor electron hopping t'. In the positive t' side, we find a robust d-wave superconducting (SC) phase characterized by coexisting quasi-long-range SC and charge density wave (CDW) correlations. Without t' the ground state forms an insulating stripe phase with long-range CDW order but short-range spin-spin and SC correlations. In stark contrast to four-leg cylinders, our results show that the lightly doped Hubbard model on six-leg cylinders remains insulating in the negative t' side where the SC correlations decay exponentially with short correlation lengths. In the larger negative t' side, the doped holes form a novel holon Wigner crystal with one doped hole per emergent unit cell and short-range spin-spin correlations.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

AmeriFlux FLUXNET-1F US-xBR NEON Bartlett Experimental Forest (BART)

This is the AmeriFlux Management Project (AMP) created FLUXNET-1F version of the carbon flux data for the site US-xBR NEON Bartlett Experimental Forest (BART). This is the FLUXNET version of the carbon flux data for the site US-xBR NEON Bartlett Experimental Forest (BART) produced by applying the standard ONEFlux (1F) software. Site Description - The Bartlett Experimental Forest is an actively managed forest; managed portions (30%) reflect a range of forest patch sizes and structural distributions. The Bartlett forest has a history of logging dating from colonial times through the beginning of the 20th century. Approximately 70% of the land area has remained uncut since the early 1900s. Natural disturbances include late 19th century fire, beech scale-Nectria complex (beech bark disease) beginning in the 1940s, severe wind disturbance resulting from hurricanes in 1938 and 1954 and a damaging ice storm in 1998.

Network), NEON (National Ecological Observatory↗

NC State University Industrial Assessment Center. Final Report

This report documents work from the Industrial Assessment Center program at NC State University. The program is funded by the US Department of Energy Advanced Manufacturing Office. The IAC provides energy conservation assessments for small and medium sized manufacturers in NC, SC, and VA. Students are involved in all aspects of the assessment including the on-site visit, interacting with plant personnel, collecting data, performing engineering analyses on potential energy efficiency measures, and producing a technical report for the client.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

Draft ASME Code Case to qualify L-PBF 316H material for Section III, Division 5 applications

This report documents the AMMT program’s development and submission of a draft ASME Code Case to qualify Laser Powder Bed Fusion (L PBF) Type 316H stainless steel for Section III, Divi-sion 5 Class A and SM high temperature nuclear applications. It summarizes the technical basis, the comprehensive high temperature mechanical test database assembled between 2023–2026, and the proposed code language and qualification framework submitted to ASME. The work was co-ordinated across multiple national laboratories and leverages prior ASME efforts to integrate additive manufacturing into the Boiler & Pressure Vessel Code. The body of the report describes the experimental database and analysis supporting the Code Case: tensile, creep, fatigue, creep fatigue, and thermal aging tests collected from multiple additive manufacturing sites, machine types, and powder lots, with material processed by a solution anneal heat treatment. The dataset — including both full size and subsized specimens and tests oriented parallel and perpendicular to build direction — shows limited tensile anisotropy, tensile properties comparable to wrought 316H, creep strength within the scatter of wrought material, but markedly reduced creep ductility above about 650 °C associated with rapid σ phase formation in L PBF microstructures. The draft Code Case itself prescribes a staged qualification model (manufacturing process qualification, component qualification, and per build witness testing), treats L PBF components as equivalent to Type 316 weld metal for design and inspection, and requires mechanical, chemical, and metallographic controls tied to ASTM/ISO 52946. Key acceptance criteria include tensile tests within a 90% prediction interval of the AMMT dataset, a creep fatigue screening test adapted from ASME Section III, Division 5, Subsection HB, HBB 2800 but with the cycle acceptance reduced to 100 for L PBF material, and double volumetric inspection of production components. The report concludes that the present data support treating L PBF 316H as analogous to conventional fusion weld metal for Division 5 design and inspection, while highlighting important caveats: the σ phase driven loss of creep ductility above ~650 °C, preliminary indications of enhanced creep fatigue sensitivity in some lots, and remaining gaps in long term aging and additional cyclic testing. Recommended next actions include completing outstanding cyclic and long duration creep/aging tests on the solution annealed condition, supporting inclusion of the 316H chemistry and heat treatment in ASTM/ISO 52946, and continuing engagement with ASME and NRC during balloting and review to enable industry adoption.

Messner, Mark C. (ORCID:0000000200404385)↗

An evaluation of space acquired data as a tool for wildlife management in Alaska

The author has identified the following significant results. Interpretation of ERTS-1 imagery by color-coded densitometric displays and digital processes data verified that with adequate quadrat in situ sampling ERTS-1 data could be extrapolated to describe accurately the vegetative characteristics of analogous sites, and that surface acres of water for waterfowl production were obtainable for ponds a minimum of 5 acres in size.

Vantries, B. J.↗

The fracture morphology of nickel-base superalloys tested in fatigue and creep-fatigue at 650 C

The fracture surfaces of compact tension specimens from seven nickel-base superalloys fatigue tested at 650 C were studied by scanning electron microscopy and optical metallography to determine the nature and morphology of the crack surface in the region of stable growth. Crack propagation testing was performed as part of an earlier study at 650 C in air using a 0.33 Hz fatigue cycle and a creep-fatigue cycle incorporating a 900 second dwell at maximum load. In fatigue, alloys with a grain size greater than 20 micrometers, HIP Astroloy, Waspaloy, and MERL 76, exhibited transgranular fracture. MERL 76 also displayed numerous fracture sites which were associated with boundaries of prior powder particles. The two high strength, fine grain alloys, IN 100 and NASA IIB-7, exhibited intergranular fracture. Rene 95 and HIP plus forged Astroloy displayed a mixed failure mode that was transgranular in the coarse grains and intergranular in the fine grains. Under creep-fatigue conditions, fracture was found to be predominantly intergranular in all seven alloys.

Gayda, J.↗

Oblique impacts: Catastrophic vs. protracted effects

Proposed impacts as the cause of biologic catastrophes at the end of the Cretaceous and Eocene face several enigmas: protracted extinctions, even prior to the stratigraphic cosmogenic signature; widespread but non-uniform dispersal of the meteoritic component; absence of a crater of sufficient size; and evidence for massive intensive fires. Various hypotheses provide reasonable mechanisms for mass mortalities: global cooling by continental impact sites; global warming by oceanic impact sites; contrasting effects of asteroidal, cometary, and even multiple impacts; and stress on an already fragile global environment. Yet not every known large impact is associated with a major biologic catastrophe. An alternative is expanded: the consequences of an oblique impact. The most probable angle of impact is 45 deg with the probability for an impact at smaller angles decreasing: A vertical impact is as rare as a tangential impact with a 5 deg impact angle or less occurring only 8 percent of the time. Consequently a low-angle impact is a rare but probable event. Laboratory experiments at the NASA-Ames Vertical Gun Range reveal important information about cratering efficiency, impact vaporization, projectile dispersal, and phenomenology, thereby providing perspective for possible consequences of such an impact on both the Earth and Moon. Oblique impacts are rare but certain events through geologic time: A 5 deg impact by a 2 km-diameter impactor on the Earth would occur only once in about 18 my with a 10 km-diameter once in about 450 my. Major life extinctions beginning prior to the stratigraphic cosmogenic signature or protracted extinctions seemingly too long after the proposed event may not be evidence against an impact as a cause but evidence for a more complex but probable sequence of events.

Schultz, P. H.↗

Laser terminal attitude determination via autonomous star tracking

Freespace laser communication systems require an initial spatial acquisition process to coalign the cooperating terminal line of sites (typically to sub-microrad accuracy). The complexity and time required for this process can grow dramatically with the size of the host platform(s) initial uncertainty field-of-view. The feasibility of significantly refining the laser terminal attitude knowledge prior to the initiation of the spatial acquisition process via a preliminary star tracking operation is addressed. It is shown that currently planned laser terminal designs are capable of supporting this star tracking function with minimal hardware augmentation. An analysis of stellar spectral irradiance is presented which enables the computation of the tracking noise equivalent angle versus stellar class and visual magnitude.

Chapman, William↗

Towards the Interoperability of Web, Database, and Mass Storage Technologies for Petabyte Archives

At the San Diego Supercomputer Center, a massive data analysis system (MDAS) is being developed to support data-intensive applications that manipulate terabyte sized data sets. The objective is to support scientific application access to data whether it is located at a Web site, stored as an object in a database, and/or storage in an archival storage system. We are developing a suite of demonstration programs which illustrate how Web, database (DBMS), and archival storage (mass storage) technologies can be integrated. An application presentation interface is being designed that integrates data access to all of these sources. We have developed a data movement interface between the Illustra object-relational database and the NSL UniTree archival storage system running in a production mode at the San Diego Supercomputer Center. With this interface, an Illustra client can transparently access data on UniTree under the control of the Illustr DBMS server. The current implementation is based on the creation of a new DBMS storage manager class, and a set of library functions that allow the manipulation and migration of data stored as Illustra 'large objects'. We have extended this interface to allow a Web client application to control data movement between its local disk, the Web server, the DBMS Illustra server, and the UniTree mass storage environment. This paper describes some of the current approaches successfully integrating these technologies. This framework is measured against a representative sample of environmental data extracted from the San Diego Ba Environmental Data Repository. Practical lessons are drawn and critical research areas are highlighted.

Moore, Reagan↗

Retrieval of Surface Snow Grain Size and Melt Water from AVIRIS Spectra

The Earth's energy balance and hydrology are affected by the distribution and characteristics of snow cover on the surface. Snow grain size and snow melt influence surface albedo and hydrology. A model of snow reflectance that depends on both grain size and surface melt water was developed to derive these parameters from remote spectral measurements. This reflectance model is based on a discrete ordinate radiative transfer approach that uses Mie calculations of snow optical properties, which are based on the complex refractive index of ice and water. This snow model was linked to an atmospheric radiative transfer code and a nonlinear least squares fitting algorithm. The resulting combined algorithm was applied to an AVIRIS snow data set acquired over Mammoth Mountain, California. Maps of grain size and surface snow melt were generated that are consistent with the expected ranges and distributions for conditions at the site.

Green Robert O.↗

Terrestrial Energy Storage SPS Systems

Terrestrial energy storage systems for the SSP system were evaluated that could maintain the 1.2 GW power level during periods of brief outages from the solar powered satellite (SPS). Short-term outages of ten minutes and long-term outages up to four hours have been identified as "typical" cases where the ground-based energy storage system would be required to supply power to the grid. These brief interruptions in transmission could result from performing maintenance on the solar power satellite or from safety considerations necessitating the power beam be turned off. For example, one situation would be to allow for the safe passage of airplanes through the space occupied by the beam. Under these conditions, the energy storage system needs to be capable of storing 200 MW-hrs and 4.8 GW-hrs, respectively. The types of energy storage systems to be considered include compressed air energy storage, inertial energy storage, electrochemical energy storage, superconducting magnetic energy storage, and pumped hydro energy storage. For each of these technologies, the state-of-the-art in terms of energy and power densities were identified as well as the potential for scaling to the size systems required by the SSP system. Other issues addressed included the performance, life expectancy, cost, and necessary infrastructure and site locations for the various storage technologies.

Brandhorst, Henry W., Jr.↗

Experimental Shock Decomposition of Siderite and the Origin of Magnetite in Martian Meteorite ALH84001

Shock recovery experiments to determine whether magnetite could be produced by the decomposition of iron-carbonate were initiated. Naturally occurring siderite was first characterized by electron microprobe (EMP), transmission electron microscopy (TEM), Mossbauer spectroscopy, and magnetic susceptibility measurements to be sure that the starting material did not contain detectable magnetite. Samples were shocked in tungsten-alloy holders (W=90%, Ni=6%, Cu=4%) to further insure that any iron phases in the shock products were contributed by the siderite rather than the sample holder. Each sample was shocked to a specific pressure between 30 to 49 GPa. Previously reported results of TEM analyses on 49 GPa experiments indicated the presence of nano-phase spinel-structured iron oxide. Transformation of siderite to magnetite as characterized by TEM was found in the 49 GPa shock experiment. Compositions of most magnetites are greater than 50% Fe sup(+2) in the octahedral site of the inverse spinel structure. Magnetites produced in shock experiments display the same range of single-domain, superparamagnetic sizes (approx. 50 100 nm), compositions (100% magnetite to 80% magnetite-20% magnesioferrite), and morphologies (equant, elongated, euhedral to subhedral) as magnetites synthesized by Golden et al. (2001) or magnetites grown naturally by MV1 magnetotactic bacteria, and as the magnetites in Martian meteorite ALH84001. Fritz et al. (2005) previously concluded that ALH84001 experienced approx. 32 GPa pressure and a resultant thermal pulse of approx. 100 - 110 C. However, ALH84001 contains evidence of local temperature excursions high enough to 1 melt feldspar, pyroxene, and a silica-rich phase. This 49 GPa experiment demonstrates that magnetite can be produced by the shock decomposition of siderite as a result of local heating to greater than 470 C. Therefore, magnetite in the rims of carbonates in Martian meteorite ALH84001 could be a product of shock devolatilization of siderite as well.

Bell, Mary Sue↗

Infrastructure and DFLAW Support at Hanford - 20443

Manhattan Project era infrastructure systems are degrading at an accelerated pace across the Department of Energy's (DOE) Environmental Management complex. Revitalizing, rejuvenating and right-sizing these systems to ensure reliability for ongoing cleanup missions is a major focus at the 580-square- mile Hanford Site in southeast Washington State. The push to complete construction, commissioning, startup, and operation of facilities and systems in the Direct-Feed Low-Activity Waste (DFLAW) program at Hanford by 2023 requires considerable coordination among site contractors and a significant investment in infrastructure. The passage of time also poses a challenge. It has been about 75 years since facilities were first operated at the site, and approximately 40 years of plutonium production created a legacy of unidentified active and abandoned underground obstacles and waste sites that must be avoided when building and upgrading the infrastructure. Converting infrastructure systems originally built to support plutonium production from the 1940's to the 1980's and upgrading those systems to optimize technology is an ever-changing balance of funding profiles, available resources and execution strategies. The DOE Richland Operations Office (RL) has long recognized the need for increased investment in Hanford Site infrastructure to support the future processing of approximately 56 million gallons of waste currently stored in large underground tanks. When DFLAW is fully operational, safe and reliable infrastructure systems will be needed to ensure continuity of operations around the clock, 365 days a year. These include roadways, water, power, sewer, information technology systems and facilities. To ensure the readiness of Hanford's infrastructure to support treating tank waste in the next three years, 15 projects were identified with a combined value of $133.8 million. Through calendar year 2019, 7 infrastructure projects have been substantially completed and the remaining 8 projects, with a remaining value of $103.8 million, are scheduled to be completed by December 2023. RL and its site services/infrastructure contractor, Mission Support Alliance (MSA), regularly evaluate the needs of the DFLAW program and other Hanford Site missions to ensure the highest priority systems are addressed. In addition to a fast-approaching deadline for round-the-clock treatment operations, RL and MSA face another significant infrastructure challenge. As cleanup is being completed in a 220-square-mile area called the River Corridor, most of the cleanup operations going forward will occur in a 20-square-mile area in the center of the Hanford Site, known as the Central Plateau. Infrastructure systems are becoming more congested in an already overcrowded area. This paper/presentation will outline some of the challenges Hanford faces while executing infrastructure reliability projects. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

Predicting metal–metal interactions. I. The influence of strain on nanoparticle and metal adlayer stabilities

Strain-engineering of bimetallic nanomaterials is an important design strategy for developing new catalysts. In this paper, we introduce an approach for including strain effects into a recently introduced, density functional theory (DFT)-based alloy stability model. The model predicts adsorption site stabilities in nanoparticles and connects these site stabilities with catalytic reactivity and selectivity. Strain-based dependencies will increase the model’s accuracy for nanoparticles affected by finite-size effects. In addition to the stability of small nanoparticles, strain also influences the heat of adsorption of epitaxially grown metal-on-metal adlayers. In this respect, we successfully benchmark the strain-including alloy stability model with previous experimentally determined trends in the heats of adsorption of Au and Cu adlayers on Pt (111). For these systems, our model predicts stronger bimetallic interactions in the first monolayer than monometallic interactions in the second monolayer. We explicitly quantify the interplay between destabilizing strain effects and the energy gained by forming new metal–metal bonds. While tensile strain in the first Cu monolayer significantly destabilizes the adsorption strength, compressive strain in the first Au monolayer has a minimal impact on the heat of adsorption. Hence, this study introduces and, by comparison with previous experiments, validates an efficient DFT-based approach for strain-engineering the stability, and, in turn, the catalytic performance, of active sites in bimetallic alloys with atomic level resolution.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Assessing uncertainty in the timing of energy use during cost-optimal distributed energy technology selection and sizing

This paper empirically derives uncertainty ranges in cost-optimal solar PV and storage sizing by comparing results from the REopt Lite optimization platform from metered data and a set of simulated Department of Energy Commercial Reference Building (CRB) profiles at 65 sites. We find load profile shape alone does not explain a site’s optimal configurations (i.e., PV, Storage, PV and Storage, No System). Still, load profile shape does introduce uncertainty to optimal PV and storage capacities. Across all cases where PV is part of an optimal configuration, we find the average ratio of power capacities derived from metered loads to capacities derived from CRB profiles to be 0.97 (and as high as 1463), where 1 would be a perfect match in system size. For storage, the ratio is 1.6 (and as high as 42). We also assess how, in the absence of complete metered data, a CRB profile can be selected that would be expected to yield the most similar solar PV and storage capacities. From those metrics that can be available from billing data (i.e., peak demand, monthly load totals), we find that uncertainty is most reduced by selecting the CRB’s with an annual peak occurring at the most similar time, or those with the lowest average root mean square error (RMSE) among monthly peak loads. This research can help improve the implementation and interpretation of results derived from simulated load profiles and is an important next step in advancing smart grid solutions.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗