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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 271 records · Page 15
All sourcesNASA NTRSDOE OSTI
DOE OSTI2022

Anomalous Ferromagnetic Behavior in Orthorhombic Li 3 Co 2 SbO 6

Monoclinic Li 3 Co 2 SbO 6 has been proposed as a Kitaev spin liquid candidate and investigated intensively, whereas the properties of its polymorph, the orthorhombic phase, are less known. In this work, we report the magnetic properties of orthorhombic Li 3 Co 2 SbO 6 as revealed by dc and ac magnetic susceptibility, muon spin relaxation (μSR), and neutron diffraction measurements. Successive magnetic transitions at 115, 89, and 71 K were observed in the low-field dc susceptibility measurements. The transitions below T N (115 K) are suppressed at higher applied fields. However, zero-field ac susceptibility measurements reveal distinct frequency-independent transitions at about 114, 107, 97, 79, and 71 K. A long-range magnetic ordered state was confirmed by specific heat, μSR, and neutron diffraction measurements, all indicating a single transition at about 115 K. The discrepancy between different measurements is attributed to possible stacking faults and/or local disorders of the ferromagnetic zigzag chains, resulting in ferromagnetic boundaries within the overall antiferromagnetic matrix.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2024

Colossal magnetoresistance from spin-polarized polarons in an Ising system

Recent experiments suggest a new paradigm toward novel colossal magnetoresistance (CMR) in a family of materials EuM 2 X 2 (M = Cd, In, Zn; X = P, As), distinct from the traditional avenues involving Kondo–Ruderman–Kittel–Kasuya–Yosida crossovers, magnetic phase transitions with structural distortions, or topological phase transitions. Here, we use angle-resolved photoemission spectroscopy and density functional theory calculations to explore their origin, particularly focusing on EuCd 2 P 2 . While the low-energy spectral weight royally tracks that of the resistivity anomaly near the temperature with maximum magnetoresistance ( T MR ) as expected from transport-spectroscopy correspondence, the spectra are completely incoherent and strongly suppressed with no hint of a Landau quasiparticle. Using systematic material and temperature dependence investigation complemented by theory, we attribute this nonquasiparticle caricature to the strong presence of entangled magnetic and lattice interactions, a characteristic enabled by the p - f mixing. Given the known presence of ferromagnetic clusters, this naturally points to the origin of CMR being the scattering of spin-polarized polarons at the boundaries of ferromagnetic clusters. These results are not only illuminating to investigate the strong correlations and topology in EuCd 2 X 2 family, but, in a broader view, exemplify how multiple cooperative interactions can give rise to extraordinary behaviors in condensed matter systems.

36 MATERIALS SCIENCE↗
DOE OSTI2025

Impact of Tiny Fermi Pockets with Extremely High Mobility on the Hall Anomaly in the Kagome Metal CsV 3 ⁢Sb 5

The kagome metal CsV 3 ⁢Sb 5 exhibits an unusual charge-density-wave (CDW) order, where the emergence of loop current order that breaks time-reversal symmetry (TRS) has been proposed. A key feature of this CDW phase is a nonmonotonic Hall effect at low fields, often attributed to TRS breaking. However, its origin remains unclear. Here, we conduct comprehensive magnetotransport measurements on CsV 3 ⁢Sb 5 and, through mobility spectrum analysis, identify the formation of tiny Fermi pockets with extremely high mobility below the CDW transition. Furthermore, electron irradiation experiments reveal that the nonmonotonic Hall effect is significantly suppressed in samples with reduced mobility, despite no substantial change in the electronic structure. In conclusion, these results indicate that the nonmonotonic Hall effect originates from these tiny Fermi pockets with high mobility carriers rather than anomalous Hall mechanisms, providing new insights into understanding the Hall anomaly in this kagome system.

36 MATERIALS SCIENCE↗
DOE OSTI2023

Superconductivity and magnetic and transport properties of single-crystalline CaK ( Fe 1 – x Cr x ) 4 As 4

Members of the CaK (Fe 1–x Cr x ) 4 As 4 series have been synthesized by high-temperature solution growth in single-crystalline form and characterized by x-ray diffraction, elemental analysis, and magnetic and transport measurements. The effects of Cr substitution on the superconducting and magnetic ground states of CaKFe 4 As 4 (T c = 35 K) have been studied. These measurements show that the superconducting transition temperature decreases monotonically and is finally suppressed below 1.8 K as x is increased from 0 to 0.038. For x-values greater than 0.012, signatures of a magnetic transition can be detected in magnetic measurements with the associated features in the transport measurements becoming detectable for x ≥ 0.038. The magnetic transition temperature increases in a roughly linear manner as Cr substitution increases. A temperature-composition (T – x) phase diagram is constructed, revealing a half-dome of superconductivity with the magnetic transition temperature, T*, appearing near 22 K for x ~ 0.017 and rising slowly up to 60 K for x ~ 0.077. The T – x phase diagrams for CaK (Fe 1–x T x ) 4 As 4 for T = Cr and Mn are essentially the same despite the nominally different band filling; this is in marked contrast to T = Co and Ni series for which the T – x diagrams scale by a factor of 2, consistent with the different changes in band filling Co and Ni would produce when replacing Fe. Superconductivity of CaK (Fe 1–x Cr x ) 4 As 4 is also studied as a function of magnetic field. A clear change in $H^{'}_{c2}$ (T)/T c , where $H^{'}_{c2}$ (T) is dH c2 (T)/dT, at x ~ 0.012 is observed and probably is related to a change of the Fermi surface due to magnetic order. Further, coherence length and the London penetration depths are also calculated based on H c1 and H c2 data. Both of them as a function of x show changes near x = 0.012, again consistent with Fermi surface changes associated with the magnetic ordering seen for higher x-values.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2024

Ion Manipulation from Liquid Xe to Vacuum: Ba-Tagging for a nEXO Upgrade and Future 0 νββ Experiments

Neutrinoless double beta decay (0𝜈𝛽𝛽) provides a way to probe physics beyond the Standard Model of particle physics. The upcoming nEXO experiment will search for 0𝜈𝛽𝛽 decay in 136 Xe with a projected half-life sensitivity exceeding 10 28 years at the 90% confidence level using a liquid xenon (LXe) Time Projection Chamber (TPC) filled with 5 tonnes of Xe enriched to ∼90% in the 𝛽𝛽-decaying isotope 136 Xe. In parallel, a potential future upgrade to nEXO is being investigated with the aim to further suppress radioactive backgrounds and to confirm 𝛽𝛽-decay events. This technique, known as Ba-tagging, comprises extracting and identifying the 𝛽𝛽-decay daughter 136 Ba ion. One tagging approach being pursued involves extracting a small volume of LXe in the vicinity of a potential 𝛽𝛽-decay using a capillary tube and facilitating a liquid-to-gas phase transition by heating the capillary exit. The Ba ion is then separated from the accompanying Xe gas using a radio-frequency (RF) carpet and RF funnel, conclusively identifying the ion as 136 Ba via laser-fluorescence spectroscopy and mass spectrometry. Simultaneously, an accelerator-driven Ba ion source is being developed to validate and optimize this technique. The motivation for the project, the development of the different aspects, along with the current status and results, are discussed here.

a-tagging↗
DOE OSTI2026

Disordered hydrogen adsorption at the three-fold site of W(110)

Hydrogen often forms disordered phases on metals; however, deciphering the atomic-scale behavior requires experimental and modeling techniques that directly probe the short-range order between neighboring hydrogen adsorbates. Here, to address this challenge, we applied direct recoil spectroscopy (DRS) to investigate hydrogen adsorption on the W(110) surface. We show that the recoiled hydrogen flux measured during DRS is sensitive to the short range order of the adsorbed hydrogen. Ordered hydrogen neighbors are much more efficient at dechanneling incident ions along low-index surface channels, strongly suppressing the recoiled hydrogen flux along these directions. By modeling the DRS measurements with molecular dynamics for ordered and disordered hydrogen phases, we find that at a hydrogen surface coverage of approximately Θ = 0.6, the hydrogen adsorbates are bound to three-fold sites in a disordered phase at room temperature. This finding is consistent with transfer-matrix scaling model calculations that suggest the transition to an ordered hydrogen phase occurs at a greater surface coverage of Θ = 0.83.

08 HYDROGEN↗
DOE OSTI2026

Manipulating Na/TM Ratio‐Driven Structural Heterogeneity of O3‐NaNi 1/3 Fe 1/3 Mn 1/3 O 2 Cathode for High‐Voltage Sodium‐Ion Batteries

The stability of O3-type NaNi 1/3 Fe 1/3 Mn 1/3 O 2 under high-voltage cycling is dictated by how synthesis encodes lattice strain and redox heterogeneity. Here, in this study, the role of Na:TM stoichiometry is systematically resolved by tuning the NaOH:precursor ratio during solid-state synthesis. The stoichiometric condition (Na:TM = 1.00) yields minimized microstrain, enabling uniform O3–P3 phase evolution and homogeneous multi-metal redox with preserved octahedral symmetry. In contrast, Na-excess compositions inherit disordered intermediates and heterogeneous distortion fields that trigger abrupt multiphase transitions and promote localized charge redistribution. In situ XRD captures the divergence in phase-transition pathways, TXM resolves particle-level redox heterogeneity, and XANES corroborates a stronger and more reversible Fe redox contribution at stoichiometry, shifting to diminished Fe participation and spatially inhomogeneous redox at higher Na content. These results establish Na:TM stoichiometry as a critical synthesis parameter controlling both structural coherence and redox stability. Electrochemically, the stoichiometric composition exhibits smooth voltage profiles with minimal polarization growth and retains nearly 80% of its initial capacity after 100 cycles even at an extended 4.2 V cutoff, whereas Na-excess compositions show significantly reduced initial coulombic efficiency and rapid voltage fade. Precise stoichiometric tuning provides a scalable route to defect-suppressed O3 frameworks, enabling structurally resilient, high-voltage sodium-layered cathodes.

36 MATERIALS SCIENCE↗
DOE OSTI2026

Electronic Origin of Delicate Antiferromagnetism in Fe 𝑥 ⁢NbS 2

Among the family of intercalated transition-metal dichalcogenides (TMDs), Fe 𝑥 ⁢NbS 2 is found to possess unique current-induced resistive switching behaviors, tunable antiferromagnetic states, and a commensurate charge order, all of which are tied to a critical Fe doping of 𝑥 𝑐 = 1/3. However, the electronic origin of such extreme stoichiometry sensitivities remains unclear. Combining angle-resolved photoemission spectroscopy (ARPES) with density functional theory (DFT) calculations, we identify and characterize a dramatic eV-scale electronic restructuring that occurs across the 𝑥𝑐. Moment-carrying Fe 3⁢𝑑 𝑧 2 electrons manifest as narrow bands within 200 meV of the Fermi level, distinct from other transition metal intercalated TMD magnets. These states strongly hybridize with itinerant electrons in the TMD layer and rapidly lose coherence above 𝑥 𝑐 due to correlation-driven effects. This sudden quasiparticle decoherence collapses the Fe-Nb hybridization, which explicitly suppresses the out-of-plane effective Fe-Fe exchange interaction, driving the transformation of the magnetic ground state from an antiferromagnetic stripe phase to a zigzag phase. Furthermore, these observations resemble the exceptional electronic and magnetic sensitivity of strongly correlated systems, and demonstrate that quantifying orbital-specific hybridization via ARPES offers an alternative pathway to evaluate effective magnetic exchange in metallic magnets, complementing inelastic neutron and resonant x-ray scattering probes.

Angle-resolved photoemission spectroscopy↗
DOE OSTI2024

The Role of Interfacial Interactions and Oxygen Vacancies in Tuning Magnetic Anisotropy in LaCrO 3 /LaMnO 3 Heterostructures

The interplay of lattice, electronic, and spin degrees of freedom at epitaxial complex oxide interfaces provides a route to tune their magnetic ground states. Unraveling the competing contributions is critical for tuning their functional properties. The relationship between magnetic ordering and magnetic anisotropy and the lattice symmetry, oxygen content, and film thickness in compressively strained LaMnO 3 (LMO)/LaCrO 3 (LCO) superlattices is investigated. Mn–O–Cr antiferromagnetic superexchange interactions across the heterointerface result in a net ferrimagnetic magnetic structure. Bulk magnetometry measurements reveal isotropic in-plane magnetism for as-grown oxygen-deficient thin samples due to equal fractions of orthorhombic a+a-c-, and a-a+c- twin domains. As the superlattice thickness is increased, in-plane magnetic anisotropy emerges as the fraction of the a+a-c- domain increases. On annealing in oxygen, the suppression of oxygen vacancies results in a contraction of the lattice volume, and an orthorhombic to rhombohedral transition leads to isotropic magnetism independent of the film thickness. The complex interactions are investigated using high-resolution synchrotron diffraction and X-ray absorption spectroscopy. These results highlight the role of the evolution of structural domains with film thickness, interfacial spin interactions, and oxygen-vacancy-induced structural phase transitions in tuning the magnetic properties of complex oxide heterostructures.

36 MATERIALS SCIENCE↗
DOE OSTI2021

Many-body forces and nucleon clustering near the QCD critical point

It has been proposed that one can look for the QCD critical point (CP) by the Beam Energy Scan accurately monitoring event-by-event fluctuations. This experimental program is under way at the BNL RHIC collider. Separately, it has been studied how clustering of nucleons at freeze out affects proton multiplicity distribution and light nuclei production. It was found that even a minor increase of the range of nuclear forces dramatically increases clustering, while large correlation length ξ near CP makes attraction due to binary forces unrealistically large. Here, in this paper, we show that repulsive many-body forces near CP should overcome the binary ones and effectively suppress clustering. We also discuss current experimental data and point out locations at which a certain drop in clustering may already be observed.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2023

Staged cooling of a fusion-grade plasma in a tokamak thermal quench

Abstract In tokamak disruptions where the magnetic connection length becomes comparable to or even shorter than the plasma mean-free-path, parallel transport can dominate the energy loss and the thermal quench of the core plasma goes through four phases (stages) that have distinct temperature ranges and durations. The main temperature drop occurs while the core plasma remains nearly collisionless, with the parallel electron temperature T e ∥ dropping in time t as T e ∥ ∝ t − 2 and a cooling time that scales with the ion sound wave transit time over the length of the open magnetic field line. These surprising physics scalings are the result of effective suppression of parallel electron thermal conduction in an otherwise bounded, quasineutral, and collisionless plasma, which is different from what are known to date on electron thermal conduction along the magnetic field in a nearly collisionless and quasineural plasma.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2023

Influence of atomic ordering and cerium doping on magnetostrictive Fe-Al alloys

Magnetostrictive iron-aluminum alloys can be a low-cost, mechanically stable alternative to iron-gallium and rare earth-iron alloys. The magnetostrictive performance of polycrystalline Fe-Al (alfenol) with 13–24 at. % Al was investigated, studying the role of compositional variation and thermal history. It was found that rapid cooling enhances the magnetostrictive response, and peak magnetostriction was found in Fe 78 Al 22 by high temperature annealing followed by quenching. Synchrotron diffraction enabled a direct correlation of magnetostrictive behavior and the transition from short-range order to long-range ordered cluster domains in the material which can be suppressed by rapid cooling. Following recent success of doping Fe-Ga with rare earth elements, we investigated the influence of Ce doping on improving magnetostriction and found that Fe-Al shows negligible solubility for cerium, inhibiting potential magnetostriction enhancement. In conclusion, our results illustrate the complex interplay between phase stability, ordering, and optimized magnetostrictive response.

36 MATERIALS SCIENCE↗
DOE OSTI2022

Tuning charge density wave order and superconductivity in the kagome metals KV 3 Sb 5 – x Sn x and RbV 3 Sb 5 – x Sn x

The family of AV 3 Sb 5 (A = K, Rb, Cs) kagome metals exhibits charge density wave (CDW) order, proposed to be chiral, followed by a lower temperature superconducting state. Recent studies have proposed the importance of band structure saddle points proximal to the Fermi energy in governing these two transitions. Here we show the effects of hole doping achieved via chemical substitution of Sn for Sb on the CDW and superconducting states in both KV 3 Sb 5 and RbV 3 Sb 5 and generate a phase diagram. Furthermore, hole doping lifts the Γ pocket and van Hove singularities toward E F causing the superconducting T C in both systems to increase to about 4.5 K, while rapidly suppressing the CDW state.

36 MATERIALS SCIENCE↗
NASA NTRS1982

Containerless processing of Nb-Ge alloys in a long drop tube

The thirty-two meter drop tube at the Marshall Space Flight Center was used to study the effect of zero gravity containerless processing on the structure and properties of materials. The concept involves the suppression of heterogeneous nucleation of solid in liquid and, therefore, solidification accompanied by large degrees of undercooling. Under these conditions metastable phases can be formed or, at the very least, unique nonequilibrium microstructures (containing equilibrium phases) with unique properties can be produced. The drop tube solidification was applied to niobium base alloys with emphasis on the Nb-Ge binary system in an effort to produce metastable phases with high superconducting transition temperatures in bulk specimens. In the past, only lower Ge alloys (Nb-13 a/o, Nb-18 a/o, and Nb-22 a/o) could be undercooled. Higher Ge alloys (e.g., Nb-25 a/o Ge and Nb-27 a/o Ge) can now be undercooled on a routine basis.

Bayuzick, R. J.↗
DOE OSTI2020

Nematicity and superconductivity: Competition versus cooperation

Electronic nematic behavior has been identified and studied in iron-based superconductors for some time, particularly in the well-known BaFe 2 As 2 system, where it is well known to compete with superconductivity. On the other hand, it has been shown recently that FeSe displays a negligible effect of nematicity on superconductivity near the superconducting transition, and actual cooperation between the two orders when the system is doped with S. Recently it has also been proposed that LiFeAs undergoes a nematic transition in the superconducting state itself. Generally, we expect superconductivity to be anisotropic when it coexists with nematic order, but it is not clear under what circumstances the two orders compete or cooperate, nor how the anisotropy of the superconducting state correlates with that in the nematic state. To address this, we study a simple mean-field model of a d-wave Pomeranchuk instability together with a mixed s,d pairing interaction, and identify when nematicity is enhanced or suppressed by superconductivity. Here, we show that the competition or cooperation depends significantly on the distortion of the Fermi surface due to nematicity relative to the anisotropy of the superconducting gap function. Further, we discuss the implications of our results for FeSe and LiFeAs.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2026

Aerosol Can Fireball Tests: Commodity Hazards in the Transportation Environment Phase 1 Report

This report describes a series of tests performed at Sandia’s burn site to better understand the behavior of aerosol commodities and their hazards in the transportation environment. This comes on the tail of a prior study on the use cases and historical hazards associated with aerosol commodities in the shipping environment (Cambridge Systematics Incorporated, CSI, 2020). It is also mindful of the National Fire Protection Agency NFPA30B standard for safe warehousing of aerosol commodities. Warehousing is different from transit because warehousing typically involves active suppression and mitigation measures not practical or relevant to the shipping environment. Transit also typically involves tighter packing and smaller enclosure spaces. The transportation hazard space has not been heavily studied in prior testing specifically aimed towards the ground, rail, and nautical shipping environments.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2023

Wet compaction to a blue nugget: a critical phase in galaxy evolution

ABSTRACT We utilize high-resolution cosmological simulations to reveal that high-redshift galaxies tend to undergo a robust ‘wet compaction’ event when near a ‘golden’ stellar mass of $\sim \!\!10^{10}\, \rm M_\odot$ . This is a gaseous shrinkage to a compact star-forming phase, a ‘blue nugget’ (BN), followed by central quenching of star formation to a compact passive stellar bulge, a ‘red nugget’ (RN), and a buildup of an extended gaseous disc and ring. Such nuggets are observed at cosmic noon and seed today’s early-type galaxies. The compaction is triggered by a drastic loss of angular momentum due to, e.g. wet mergers, counter-rotating cold streams, or violent disc instability. The BN phase marks drastic transitions in the galaxy structural, compositional, and kinematic properties. The transitions are from star forming to quenched inside-out, from diffuse to compact with an extended disc or ring and a stellar envelope, from dark matter to baryon central dominance, from prolate to oblate stellar shape, from pressure to rotation support, from low to high metallicity, and from supernova to AGN feedback. The central black hole growth, first suppressed by supernova feedback when below the golden mass, is boosted by the compaction, and the black hole keeps growing once the halo is massive enough to lock in the supernova ejecta.

Lapiner, Sharon (ORCID:0009000409733232)↗