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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 1,459 records · Page 81
All sourcesNASA NTRSDOE OSTI
DOE OSTI2019

STEM Study of Structure and Local Short-Range Orders in the Fe 5- x GeTe 2 Crystals with Ferromagnetism Near Room Temperature

Van der Waals (vdW) bonded materials have historically attracted intense attention, due to their promise for advanced electronic and optical functionalities. Recently, magnetically-active vdW materials have been recognized as an important class of materials for realizing new physics and functionalities. Of the magnetic vdW materials, ferromagnetic Fe 3 GeTe 2 has garnered significant attention for its high Curie temperature T C ~230 K. Recently, a Fe 5-x GeTe 2 compound with thicker Fe-Ge slabs and stronger magnetism has been successfully obtained. As viewed by bulk diffraction, the material has a relatively large unit cell and contains intrinsic disorder. The nature of the local structure is anticipated to impact the Curie temperature, which ranges from 270–310K depending on processing conditions. As such, an atomic-scale probe of the local structures and compositions is essential for understanding the intrinsic magnetism in this vdW material.

36 MATERIALS SCIENCE↗
DOE OSTI2013

Synthesis and characterization of mixed phases in the Ca–Co–O system using the Pechini method

Highlights: ► We have prepared mixed Ca–Co–O phases using the Pechini method. ► Reaction times are reduced relative to conventional solid-state synthesis. ► Products have high surface area suitable for ceramic processing. ► Product composition is dictated by both kinetic and thermodynamic control. ► A revised phase diagram of the Ca–Co–O system is proposed. - Abstract: The synthesis of mixed phases in the Ca–Co–O system using the Pechini method was investigated. The phases CaCo{sub 2}O{sub 4}, Ca{sub 3}Co{sub 4}O{sub 9} and Ca{sub 3}Co{sub 2}O{sub 6}, which can be expressed in terms of the molar ratios of the binary oxides (CaO:Co{sub 2}O{sub 3}) as (1:1), (3:2) and (3:1) respectively, were obtained in pure form. Powder X-ray diffraction data showed they are comparable with materials obtained by conventional solid-state synthesis. The mild synthesis conditions of the Pechini method allowed the evolution of the Ca–Co–O phases to be studied as a function of temperature and heating time. Both variables have a strong influence on the composition of the products, indicating that both kinetic and thermodynamic factors play a role, with the former being of more importance at lower temperatures. The (1:1) phase, previously not identified in the phase diagram of the Ca–Co–O system, was obtained preferentially across the composition range below ca. 650 °C. The (3:2) phase was preferred until ca. 800 °C. At even higher temperatures, the (3:1) phase is obtained. The upper thermal stability limit of mixed phases in the Ca–Co–O system increases with the Ca:Co ratio. An updated phase diagram for the Ca–Co–O system is proposed.

36 MATERIALS SCIENCE↗
DOE OSTI2023

Procedures for Assessing the Stability of Proposed Topological Materials

Here, we investigate the stability of MnPb 2 Bi 2 Te 6 (MPBT), which is predicted to be a magnetic topological insulator (TI), using density functional theory calculations. Our analysis includes various measures such as enthalpies of formation, Helmholtz free energies, defect formation energies, and dynamical stability. Our thermodynamic analysis shows that the phonon contribution to the energy gain from finite temperature is estimated to be less than 10 meV/atom, which may not be sufficient to stabilize MPBT at high temperatures, even with the most favorable reactions starting from binaries. While MPBT is generally robust against the formation of various defects, we find that the anti-site defect formation of MnPb is the most likely to occur, with a corresponding energy less than 60 meV. This can be attributed to the significant energy cost from compressive strain at the PbTe layer. Our findings suggest that MPBT is on the brink of stability in terms of thermodynamics and defect formation, underscoring the importance of conducting systematic analyses of the stability of proposed TIs, including MPBT, for their practical utilization. This study offers valuable insights into the design and synthesis of desirable magnetic TI materials with robust stabilities.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2016

Magnetic properties of electrospun non-woven superconducting fabrics

Non-woven superconducting fabrics were prepared by the electrospinning technique, consisting of Bi{sub 2}Sr{sub 2}CaCuO{sub 8} (Bi-2212) nanowires. The individual nanowires have a diameter of ∼150-200 nm and lengths of up to 100 μm. A non-woven fabric forming a network with a large number of interconnects results, which enables the flow of transport currents through the entire network. We present here magnetization data [M(T) and M(H)-loops] of this new class of superconducting material. The magnetic properties of these nanowire networks are discussed including the irreversibility line and effects of different field sweep rates, regarding the microstructure of the nanowire networks investigated by electron microscopy.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2017

Detection of magnetic circular dichroism in amorphous materials utilizing a single-crystalline overlayer

Physicists are fascinated with topological defects in solid-state materials, because by breaking the translational symmetry they offer emerging properties that are not present in their parental phases. For example, edge dislocations—the 2π phase-winding topological defects—in antiferromagnetic NiO crystals can exhibit ferromagnetic behaviors. Herein, we study how these defects could give rise to exotic topological orders when they interact with a high energy electron beam. To probe this interaction, we formed a coherent electron nanobeam in a scanning transmission electron microscope and recorded the far-field transmitted patterns as the beam steps through the edge dislocation core in [001] NiO. Surprisingly, we found the amplitude patterns of the <020> Bragg disks evolve in a similar manner to the evolution of an annular solar eclipse. Using the ptychographic technique, we recovered the missing phase information in the diffraction plane and revealed the topological phase vortices in the diffracted beams. Through atomic topological defects, the wave function of electrons can be converted from plane wave to electron vortex. This approach provides a new perspective for boosting the collection efficiency of magnetic circular dichroism spectra with high spatial resolution and understanding the relationship between symmetry breaking and exotic property of individual topological defect at atomic level.

36 MATERIALS SCIENCE↗
DOE OSTI2014

Materials, Strands, and Cables for Superconducting Accelerator Magnets. Final Report

This report focuses on Materials, Strands and Cables for High Energy Physics Particle accelerators. In the materials area, work has included studies of basic reactions, diffusion, transformations, and phase assemblage of Nb 3 Sn. These materials science aspects have been married to results, in the form of flux pinning, B c2 , B irr , and transport J c , with an emphasis on obtaining the needed J c for HEP needs. Attention has also been paid to the “intermediate-temperature superconductor”, magnesium diboride emphasis being placed on (i) irreversibility field enhancement, (ii) critical current density and flux pinning, and (iii) connectivity. We also report on studies of Bi-2212. The second area of the program has been in the area of “Strands” in which, aside from the materials aspect of the conductor, its physical properties and their influence on performance have been studied. Much of this work has been in the area of magnetization estimation and flux jump calculation and control. One of the areas of this work was strand instabilities in high-performance Nb 3 Sn conductors due to combined fields and currents. Additionally, we investigated quench and thermal propagation in YBCO coated conductors at low temperatures and high fields. The last section, “Cables”, focussed on interstrand contact resistance, ICR, it origins, control, and implications. Following on from earlier work in NbTi, the present work in Nb 3 Sn has aimed to make ICR intermediate between the two extremes of too little contact (no current sharing) and too much (large and unacceptable magnetization and associated beam de-focussing). Interstrand contact and current sharing measurements are being made on YBCO based Roebel cables using transport current methods. Finally, quench was investigated for YBCO cables and the magnets wound from them, presently with a focus on 50 T solenoids for muon collider applications.

43 PARTICLE ACCELERATORS↗
DOE OSTI2020

Frustrated magnetism in the layered triangular lattice materials K 2 Co(SeO 3 ) 2 and Rb 2 Co(SeO 3 ) 2

A study of the layered triangular lattice materials K 2 Co(SeO 3 ) 2 and Rb 2 Co(SeO 3 ) 2 is reported here. These isostructural compounds crystallize in the trigonal space group R-3m (No. 166). The magnetic Co 2+ ions form a spin-1/2 triangular lattice and display strongly frustrated magnetism. We find no evidence in the susceptibility or heat capacity for in-plane ordering of the spins; rather the in-plane inverse susceptibility is typical of that seen for frustrated magnets. At around 10 K, a ferromagnetic component appears in the magnetic susceptibility perpendicular to the triangular planes. The heat capacity at low applied fields does not show sharp features, but in larger applied fields a sharp ferromagneticlike transition appears. Field- and direction-dependent magnetization measurements at 2 K indicate that both materials have a magnetic easy axis perpendicular to the triangular planes. The magnetic properties are sensitive to the field applied perpendicular to the triangular planes, which induces a metamagnetization transition at 0.75 T. Spin polarization develops along with the increasing out-of-plane field, resulting in a saturated ferromagnetic state at high fields. In contrast, the magnetic properties are resistant to the in-plane field. Our results suggest that these materials are embodiments of Ising spins on triangular lattices with easy-axis anisotropy.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2025

Distinct effect of Kondo physics on crystal field splitting in electron and spin spectroscopies

Magnetic anisotropy is a key feature of rare earth materials from permanent magnets to heavy fermions. Here we explore the complex interplay of Kondo physics and anisotropy, and their effect on different experimental probes of magnetic anisotropy in a minimal 𝐽=3/2 Anderson impurity model using the numerical renormalization group. While anisotropy suppresses Kondo screening, virtual valence fluctuations enhance the anisotropy. We find distinct renormalization of the magnetic anisotropy measured via dynamical spin response (inelastic neutron scattering) versus electronic excitations in the impurity spectral function (resonant inelastic x-ray and scanning tunneling spectroscopy). The two measurement types have different responses and dependencies on the temperature and Kondo scales.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2014

Effect of calcination temperature on microstructure and magnetic properties of Ni{sub 0.5}Zn{sub 0.25}Cu{sub 0.25} Fe{sub 2}O{sub 4} nanoparticles synthesized by sol-gel method

This paper examines the effect of calcination process on the structural and magnetic properties material nanostructure composite of Ni{sub 0Ð}œ‡{sub 5}Zn{sub 0Ð}œ‡{sub 25}Cu{sub 0.25} Fe{sub 2}O{sub 4} ferrites. The samples were successfully prepared by sol-gel method at different calcination temperature, which are 600°C, 700°C, 800°C and 900°C. Morphological investigation, average crystallite size and microstructure of the material were examined by using X-ray diffraction (XRD) and confirmed by high resolution transmission electron microscope (HRTEM) and field emission scanning electron microscope (FESEM). The effects of calcination temperature on the magnetic properties were calculated by using vibrating sample magnetometer (VSM). The XRD result shows single-phase cubic spinel structure with interval average size 5.9-38 nm, and grain size microstructure of the material was increasing with temperature increases. The highest magnetization saturation was reached at a temperature 800°C with value 53.89 emu/g, and the value coercive force (Hc) was inversely with the grain size.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2015

Relation between magnetization and Faraday angles produced by ultrafast spin-flip processes within the three-level Λ-type system

Ultrafast magneto-optical (MO) experiments constitute a powerful tool to explore the magnetization dynamics of diverse materials. Over the last decade, there have been many theoretical and experimental developments on this subject. However, the relation between the magnetization dynamics and the transient MO response still remains unclear. In this work, we calculate the magnetization of a material, as well as the magneto-optical rotation and ellipticity angles measured in a single-beam experiment. Then, we compare the magnetization to the MO response. The magnetic material is modeled by a three-level Λ-type system, which represents a simple model to describe MO effects induced by an ultrafast laser pulse. Our calculations use the density matrix formalism, while the dynamics of the system is obtained by solving the Lindblad equation taking into account population relaxation and dephasing processes. Furthermore, we consider the Faraday rotation of the optical waves that simultaneously causes spin-flip. We show that the Faraday angles remain proportional to the magnetization only if the system has reached the equilibrium-state, and that this proportionality is directly related to the population and coherence decay rates. For the non-equilibrium situation, the previous proportionality relation is no longer valid. We show that our model is able to interpret some recent experimental results obtained in a single-pulse experiment. We further show that, after a critical pulse duration, the decrease of the ellipticity as a function of the absorbed energy is a characteristic of the system.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2025

Electron Beam-Induced Phase Transformations in Different Crystal Orientations of a 2D van der Waals Magnet

To control materials properties at the nanoscale, the well-focused electron beam of the scanning transmission electron microscope (STEM) can be used as a tool to engineer structure with atomic precision. For 2D magnets, especially the highly anisotropic materials AgCrP2S6 and CrSBr, we find here that the STEM serves as a powerful tool for sculpting the arrangement of atoms, with the potential to modulate local magnetic properties.

Park, Eugene [Massachusetts Inst. of Technology (M↗
DOE OSTI2025

Q3 Report for FY25 Theory and Simulation Performance Target: Development of an integrated modeling framework for fusion reactor design and assessment

This report describes the work and activities carried out towards the completion of each of the following milestones in FY25 Q3: 1. Demonstrate workflow for generating self-consistent CESOL plasma profiles + first wall and divertor loading prediction and generate the CAT plasma and neutron loading needed for further engineering analysis. • Benchmark between two first wall heat flux mapping methods, identify importance of various heat flux sources and physics impact of using fully coupled CESOL vs post-analysis evaluation. 2. Generate medium fidelity parametrized CAD. • Generate parametrized CAD components for the CAT example case via either user-defined modules called within the geometry generation or by defeatured/parametrized CAD, including DCLL blanket matched to divertor boundary and magnets. Define materials, labels, and boundary conditions for passing the mesh to CFD tools. 3. Demonstrate multiphysics magnet analysis. • Demonstrate magnet analysis workflow called from the FREDA workflow, and 4. Demonstrate nuclear analysis. • Add model to OpenFOAM and/or other codes possibly including Diablo to account for tritium diffusion in solids.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2025

Inhomogeneity in electronic phase and flat band in magnetic kagome metal Co 3 Sn 2 S 2

Co 3 Sn 2 S 2 has been reported to be a Weyl semimetal with c-axis ferromagnetism below a Curie temperature of 177 K. Despite the large interest in Co 3 Sn 2 S 2 , the magnetic structure is still unclear. Recent studies have challenged the magnetic phase diagram of Co 3 Sn 2 S 2 by reporting unusual magnetic phases including the presence of exchange bias. Here we show, using X-ray Magnetic Circular Dichroism, a shift in the magnetization hysteresis loop, reminiscent of exchange bias and establish that the magnetic moment in Co arises from the spin, with negligible orbital moment. At 6 K, using spatially-resolved angle-resolved photoemission spectroscopy, we detect a butterfly-shaped electronic band structure at small regions of the sample distinct from the known ferromagnetic band structure. Our density functional theory calculations suggest that the butterfly bands correspond to an antiferromagnetic phase. Separately, we detect a sharp flat band at the Fermi level at some regions in the sample, which we attribute to a surface state. These different electronic states found in a stoichiometric intermetallic invite further efforts to explore the origin and nature of the electronic inhomogeneity associated to magnetism on the mesoscale.

Electronic properties and materials↗
DOE OSTI2018

Magnetic and Electrical Properties of Hg{sub 1–x–}Mn{sub x}Fe{sub y}Te{sub 1–z}S{sub z} Crystals

Electrical and magnetic properties of the semimagnetic semiconductor Hg{sub 1–x–y}Mn{sub x}Fe{sub y}Te{sub 1–z}S{sub z} solid solutions were studied in the ranges of temperatures 77–320 K and magnetic fields 0.25–6 kOe. In the crystals under study, the effect of giant magnetoresistance was observed that reached 75% at low temperatures. This is due to the fact that charge carriers that participate in the current transfer interact with a magnetized ferromagnetic cluster subsystem (Fe–Fe–Fe) and become spin-polarized. It is these spin-polarized charge carriers that are strongly scattered on antiferromagnetic Mn–S–Mn–S and Mn–Te–Mn–Te clusters, since the magnetic moments inside the clusters and the resulting magnetic moments of these clusters are randomly oriented.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2012

Magnetic properties and magnetocaloric effect in La{sub 0.7}Nd{sub 0.3}Fe{sub 13-x}Si{sub x} compounds

The structural, magnetic and magnetocaloric properties in the cubic NaZn{sub 13}-type La{sub 0.7}Nd{sub 0.3}Fe{sub 13-x}Si{sub x} compounds with x=1.2, 1.4, 1.6 and 1.8 are reported. All of the investigated samples are ferromagnetically ordered. The Fe saturation moment at 5 K is independent of Si concentration, having a value of 2.05{+-}0.09 {mu}{sub B}, which suggests a high degree of localization. The Curie temperatures increase almost linearly with the increase in silicon concentration. The large {Delta}S{sub M} values obtained for samples with low Si content are mainly due to the first-order character of the transition at T{sub C}. The field-induced transition above T{sub C} causes an asymmetric broadening of the {Delta}S{sub M} peak towards higher temperatures for higher applied fields. With increasing Si content, the first-order character of the transition at T{sub C} is diminished, leading to lower {Delta}S{sub M} values. The potential use of these materials in magnetic refrigeration is discussed. - Graphical abstract: Transition from a first-order to a second-order magnetic phase transition at T{sub C} on La{sub 0.7}Nd{sub 0.3}Fe{sub 13-x}Si{sub x}. Highlights: Black-Right-Pointing-Pointer Magnetic properties and magnetocaloric effect in La{sub 0.7}Nd{sub 0.3}Fe{sub 13-x}Si{sub x} compounds are reported. Black-Right-Pointing-Pointer Transition from a first-order to a second-order type magnetic phase transition at T{sub C} with increasing silicon content. Black-Right-Pointing-Pointer Itinerant electronic metamagnetic transition above the Curie temperature. Black-Right-Pointing-Pointer High values of the magnetic entropy changes in 2 T magnetic field.

36 MATERIALS SCIENCE↗
DOE OSTI2017

Fe-Cluster Compounds of Chalcogenides: Candidates for Rare-Earth-Free Permanent Magnet and Magnetic Nodal-Line Topological Material

Here, Fe-cluster-based crystal structures are predicted for chalcogenides Fe 3 X 4 (X = S, Se, Te) using an adaptive genetic algorithm. Topologically different from the well-studied layered structures of iron chalcogenides, the newly predicted structures consist of Fe clusters that are either separated by the chalcogen atoms or connected via sharing of the vertex Fe atoms. Additionally, using first-principles calculations, we demonstrate that these structures have competitive or even lower formation energies than the experimentally synthesized Fe 3 X 4 compounds and exhibit interesting magnetic and electronic properties. In particular, we show that Fe 3 X 4 can be a good candidate as a rare-earth-free permanent magnet and Fe 3 X 4 can be a magnetic nodal-line topological material.

36 MATERIALS SCIENCE↗
DOE OSTI2023

3-D Printed Electro-Magnetic Objects for THz Communications

Advanced materials and manufacturing techniques will pave the path towards high quality electro-magnetic circuits that operate up through THz and into optics regime. Digital additive manufacturing (AM) techniques offer game-changing potential for large scale manufacturing of Radio-frequency (RF) circuits and system in custom 2D/3D geometries. The technical collaboration will explore the design flexibility and product customization capabilities of additive manufacturing techniques to process magnetic materials in custom 3D geometries with tailored dielectric properties and frequency response characteristics. Transformation of an RF circuit design idea into a 3D printed system using additive manufacturing techniques will bring together the elements of advanced materials, additive integration, and low-cost manufacturing for future advanced wireless communication systems.

36 MATERIALS SCIENCE↗