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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 1,549 records · Page 86
All sourcesNASA NTRSDOE OSTI
DOE OSTI2025

First-Principles Statistical Mechanics Study of Magnetic Fluctuations and Order–Disorder in the Spinel LiNi 0.5 Mn 1.5 O 4 Cathode

While significant magnetic interactions exist in lithium transition metal oxides, commonly used as Li-ion cathodes, the interplay between magnetic couplings, disorder, and redox processes remains poorly understood. In this work, we focus on the high-voltage spinel LiNi 0.5 Mn 1.5 O 4 (LNMO) cathode as a model system on which to apply a computational framework that uses first principles-based statistical mechanics methods to predict the finite temperature magnetic properties of materials and provide insights into the complex interplay between magnetic and chemical degrees of freedom. Density functional theory calculations on multiple distinct Ni–Mn orderings within the LNMO system, including the ordered ground-state structure (space group P4332), reveal a preference for a ferrimagnetic arrangement of the Ni and Mn sublattices due to strong antiferromagnetic superexchange interactions between neighboring Mn 4+ and Ni 2+ ions and ferromagnetic Mn–Mn and Ni–Ni couplings, as revealed by magnetic cluster expansions. These results are consistent with qualitative predictions using the Goodenough-Kanamori-Anderson rules. Simulations of the finite temperature magnetic properties of LNMO are conducted using Metropolis Monte Carlo. We find that a “semiclassical” Monte Carlo sampling method based on the Heisenberg Hamiltonian accurately predicts experimental magnetic transition temperatures observed in magnetometry measurements. This study highlights the importance of a robust computational toolkit that accurately captures the complex chemomagnetic interactions and predicts finite temperature magnetic behavior to help analyze experimental magnetic and magnetic resonance spectroscopy data acquired ex situ and operando.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2019

Controlling the Magnetic Anisotropy of the van der Waals Ferromagnet Fe 3 GeTe 2 through Hole Doping

Identifying material parameters affecting properties of ferromagnets is key to optimized materials that are better suited for spintronics. Magnetic anisotropy is of particular importance in van der Waals magnets, since it not only influences magnetic and spin transport properties, but also is essential to stabilizing magnetic order in the two-dimensional limit. Here, we report that hole doping effectively modulates the magnetic anisotropy of a van der Waals ferromagnet and explore the physical origin of this effect. We report Fe 3–x GeTe 2 nanoflakes show a significant suppression of the magnetic anisotropy with hole doping. Electronic structure measurements and calculations reveal that the chemical potential shift associated with hole doping is responsible for the reduced magnetic anisotropy by decreasing the energy gain from the spin–orbit induced band splitting. Our findings provide an understanding of the intricate connection between electronic structures and magnetic properties in two-dimensional magnets and propose a method to engineer magnetic properties through doping.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2026

Chirality Transfer to the Magnetic Sublattice in the Hybrid Perovskite (R)-/(S)-3-Fluoropyrrolidinium Copper(II) Chloride

Incorporating chiral organic cations into organic–inorganic hybrid materials has been shown to enable the inorganic sublattice to display chiroptical properties. We report a new two-dimensional magnetic (S = 1/2) chiral metal halide perovskite, (R)- and (S)-(C 4 H 9 FN) 2 CuCl 4 (where (C 4 H 9 FN) + is 3-fluoropyrrolidinium), which consists of Cu–Cl inorganic layers separated by (C 4 H 9 FN) + organic cations. The presence of the chiral (C 4 H 9 FN) + organic cation induces the formation of chiral magnetic order, even though the inorganic sublattice itself is nearly structurally centrosymmetric. We also report the racemic variant, containing an equal amount of (R)- and (S)- cations, which shows no evidence of chiral magnetic order. When the magnetic susceptibility is measured perpendicular to the inorganic Cu–Cl layer propagation direction, an antiferromagnetic phase transition at Néel temperature T N = 2.23 K is observed in both the chiral and racemic materials, and the existence of the magnetic phase transition is supported by specific heat capacity measurements. Field-induced magnetic chirality is observed through the existence of a second-order magnetoelectric effect in the chiral variant, while no magnetoelectric signal is observed for the racemic material, indicating the absence of magnetic chirality. Our findings demonstrate that materials exhibiting chiral magnetic order can be created through the incorporation of a chiral cation into an organic–inorganic hybrid magnetic material, potentially allowing for the design of tailored materials that combine chiral magnetism with other desirable optical and electronic properties that come from structural chirality.

Cations↗
DOE OSTI2017

Giant coercivity and high magnetic blocking temperatures for N 2 3- radical-bridged dilanthanide complexes upon ligand dissociation

Increasing the operating temperatures of single-molecule magnets—molecules that can retain magnetic polarization in the absence of an applied field—has potential implications toward information storage and computing, and may also inform the development of new bulk magnets. Progress toward these goals relies upon the development of synthetic chemistry enabling enhancement of the thermal barrier to reversal of the magnetic moment, while suppressing alternative relaxation processes. Here in this paper, we show that pairing the axial magnetic anisotropy enforced by tetramethylcyclopentadienyl (Cp Me4H ) capping ligands with strong magnetic exchange coupling provided by an N 2 3- radical bridging ligand results in a series of dilanthanide complexes exhibiting exceptionally large magnetic hysteresis loops that persist to high temperatures. Significantly, reducing the coordination number of the metal centers appears to increase axial magnetic anisotropy, giving rise to larger magnetic relaxation barriers and 100-s magnetic blocking temperatures of up to 20 K, as observed for the complex [K(crypt-222)][(Cp Me4H 2 Tb) 2 (μ-N∙ 2</sub)].

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2021

Creation and observation of Hopfions in magnetic multilayer systems

Among topological solitons, magnetic skyrmions are two-dimensional particle-like objects with a continuous winding of the magnetization, and magnetic Hopfions are three-dimensional objects that can be formed from a closed loop of twisted skyrmion strings. Theoretical models suggest that magnetic Hopfions can be stabilized in frustrated or chiral magnetic systems, and target skymions can be transformed into Hopfions by adapting their perpendicular magnetic anisotropy, but their experimental verification has been elusive so far. Here, we present an experimental study of magnetic Hopfions that are created in Ir/Co/Pt multilayers shaped into nanoscale disks, known to host target skyrmions. To characterize three-dimensional spin textures that distinguish Hopfions from target skyrmions magnetic images are recorded with surface-sensitive X-ray photoemission electron microscopy and bulk-sensitive soft X-ray transmission microscopy using element-specific X-ray magnetic circular dichroism effects as magnetic contrast. These results could stimulate further investigations of Hopfions and their potential application in three-dimensional spintronics devices.

36 MATERIALS SCIENCE↗
DOE OSTI2025

Interwoven magnetic kagome metal overcomes geometric frustration

Magnetic kagome materials provide a platform for exploring magneto-transport phenomena, symmetry breaking and charge ordering driven by the intricate interplay among electronic structure, topology and magnetism. Yet geometric frustration in conventional kagome magnets limits their tunability. Here we propose a design strategy for interweaving quasi-one-dimensional magnetic Tb zigzag chains with non-magnetic Ti-based kagome bilayers in TbTi 3 Bi 4 . Comprehensive spectroscopic analyses reveal coexisting elliptical-spiral magnetic and spin-density-wave orders accompanied by a large ~90 meV band-folding gap. The combined magnetic and electronic state leads to a giant anomalous Hall conductivity of 10 5 Ω −1 cm −1 , which exceeds that observed in frustrated kagome analogues. These results establish TbTi 3 Bi 4 as a model system of magnetic kagome metals with strong electron–magnetism interactions and underscore the necessity of interweaving designed magnetic and charge layers separately to achieve tunable transport properties. This design strategy will enable the discovery of emergent quantum states and next-generation electronic materials.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2018

Probing the localization of magnetic dichroism by atomic-size astigmatic and vortex electron beams

We report localization of a magnetic dichroic signal on atomic columns in electron magnetic circular dichroism (EMCD), probed by beam distorted by four-fold astigmatism and electron vortex beam. With astigmatic probe, magnetic signal to noise ratio can be enhanced by blocking the intensity from the central part of probe. However, the simulations show that for atomic resolution magnetic measurements, vortex beam is a more effective probe, with much higher magnetic signal to noise ratio. For all considered beam shapes, the optimal SNR constrains the signal detection at low collection angles of approximately 6–8 mrad. Irrespective of the material thickness, the magnetic signal remains strongly localized within the probed atomic column with vortex beam, whereas for astigmatic probes, the magnetic signal originates mostly from the nearest neighbor atomic columns. Due to excellent signal localization at probing individual atomic columns, vortex beams are predicted to be a strong candidate for studying the crystal site specific magnetic properties, magnetic properties at interfaces, or magnetism arising from individual atomic impurities.

36 MATERIALS SCIENCE↗
DOE OSTI2015

The influence of magnetic fields on the wake field and stopping power of an ion-beam pulse in plasmas

We performed two-dimensional particle-in-cell simulations to investigate how a magnetic field affects the wake field and stopping power of an ion-beam pulse moving in plasmas. The corresponding density of plasma electrons is investigated. At a weak magnetic field, the wakes exhibit typical V-shaped cone structures. As the magnetic field strengthens, the wakes spread and lose their typical V-shaped structures. At a sufficiently strong magnetic field, the wakes exhibit conversed V-shaped structures. Additionally, strengthening the magnetic field reduces the stopping power in regions of low and high beam density. However, the influence of the magnetic field becomes complicated in regions of moderate beam density. The stopping power increases in a weak magnetic field, but it decreases in a strong magnetic field. At high beam density and moderate magnetic field, two low-density channels of plasma electrons appear on both sides of the incident beam pulse trajectory. This is because electrons near the beam pulses will be attracted and move along with the beam pulses, while other electrons nearby are restricted by the magnetic field and cannot fill the gap.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2016

Magnetized jets driven by the Sun: The structure of the heliosphere revisited—Updates

As the solar system moves through the interstellar medium, the solar wind is deflected forming the heliosphere. The standard picture of the heliosphere is a comet-shape like structure with the tail extending for 1000s of astronomical units. This standard picture stems from a view where magnetic forces are negligible and the solar magnetic field is convected passively down the tail. Recently, we showed that the magnetic tension of the solar magnetic field plays a crucial role on organizing the solar wind in the heliosheath into two jet-like structures. The two jets are separated by the interstellar medium that flows between them. The heliosphere then has a “croissant”-like shape where the distance to the heliopause downtail is almost the same as towards the nose. This new view of the heliosphere is in agreement with the energetic neutral atoms maps taken by the Interstellar Boundary Explorer and INCA/CASSINI. We developed as well an analytic model of the heliosheath in the axisymmetric limit that shows how the magnetic tension force is the driver for the north and south jets. We confirmed that the formation of these jets with magnetohydrodynamic (MHD) simulations. The main reason why previous global MHD simulations did not see these jets is due to spurious magnetic dissipation that was present at the heliospheric current sheet. We instead kept the same polarity for the interplanetary (solar) magnetic field in both the northern and southern hemispheres, eliminating spurious magnetic dissipation effects at the heliospheric current sheet. In this paper, we extend these previous results to include additional cases where we used: (a) weaker solar magnetic field; (b) solar magnetic field that reverses polarity at the solar equator in the axisymmetric limit; and (c) slower motion through the interstellar system. We discuss as well future challenges regarding the structure of the heliosphere.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2016

Dynamics of magnetized plasma sheaths around a trench

Considering a magnetized plasma sheath, the temporal evolution of the ion properties (the incident ion flux, the ion impact angle, and the incident ion dose) around a rectangular trench is studied numerically. Our results show that the ion flux along the bottom surface greatly reduces in the presence of magnetic field and its uniformity improves, but the magnetic field does not considerably affect the ion flux along the sidewall. In addition, the thickness of the plasma sheath increases by increasing the magnetic field while its conformality to the target surface reduces faster. Moreover, it is shown that any increase in the magnitude (inclination angle) of the magnetic field causes a decrease (an increase) in the angle of incidence of ions on the bottom and sidewall surfaces. Furthermore, in the presence of magnetic field, the ions strike nearly normal to the surface of the bottom while they become less oblique along the sidewall surface. In addition, contrary to the corners of the trench, it is found that the magnetic field greatly affects the incident ion dose at the center of the trench surfaces. Also, it is shown that the incident ion dose along the sidewall is the highest near the center of the sidewall in both magnetized and magnetic-free cases. However, uniformity of the incident ion dose along the sidewall is better than that along the bottom in both magnetized and unmagnetized plasma sheath.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2021

Tailoring magnetization reversal of a single-domain bar nanomagnet via its end geometry

Nanoscale single-domain bar magnets are building blocks for a variety of fundamental and applied mesoscopic magnetic systems, such as artificial spin ices, magnetic shape-morphing microbots, and magnetic majority logic gates. The magnetization reversal switching field of the bar nanomagnets is a crucial parameter that determines the physical properties and functionalities of their constituted artificial systems. Previous methods on tuning the magnetization reversal switching field of a bar nanomagnet usually relied on modifying its aspect ratio, such as its length, width, and/or thickness. Here, we show that the switching field of a bar nanomagnet saturates when extending its length beyond a certain value, preventing further tailoring of the magnetization reversal via aspect ratios. We showcase a highly tunable switching field of a bar nanomagnet by tailoring its end geometry without altering its size. This provides an easy method to control the magnetization reversal of a single-domain bar nanomagnet. It would enable new research and/or applications, such as designing artificial spin ices with additional tuning parameters, engineering magnetic microbots with more flexibility, and developing magnetic quantum-dot cellular automata systems for low power computing.

36 MATERIALS SCIENCE↗
DOE OSTI2025

Numerical investigation of magneto-inertial fusion targets magnetized by dynamic enforcement of helical current flow

Magnetized Liner Inertial Fusion (MagLIF) targets require premagnetization to reduce thermal conduction losses from the laser-heated fuel to the liner material during implosion. MagLIF targets are typically magnetized by external magnetic field coils which are technologically limited to providing <20 T axial magnetic fields in the fusion fuel. We present a novel target design, AutoMag-D, which employs dynamic enforcement of helical current in the liner, resulting in >20 T axial magnetic field in the fuel region prior to implosion without the need of external magnetic field coils. These self-magnetizing liners are made of helically oriented alternating electrically conductive material and electrically insulating material surrounded by a thin, conductive outer radial layer. As the liner is pulsed with a ∼ 20 MA, ∼ 100 ns rise time drive current from Z, the outer layer of conductive material is shocked and intensely Joule heated, causing it to melt, vaporize, and turn to plasma. This allows the magnetic drive field to diffuse radially inward which dynamically enforces current flow in the helical conduction paths in the liner and produces axial magnetic field in the fuel region prior to implosion of the inner liner surface. AutoMag-D liner designs do not require dielectric breakdown of electrically insulating material (as in traditional auto-magnetizing helical liners) and do not require helical return current geometries (as in dynamic screw pinches). We present results from three-dimensional radiation-magnetohydrodynamic simulations of MagLIF implosions employing AutoMag-D liner designs. Simulated AutoMag-D targets demonstrate improved fuel conditions and thermonuclear yield compared to traditional MagLIF.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2015

EIGENMODES OF THREE-DIMENSIONAL MAGNETIC ARCADES IN THE SUN’S CORONA

We develop a model of coronal-loop oscillations that treats the observed bright loops as an integral part of a larger three-dimensional (3D) magnetic structure comprised of the entire magnetic arcade. We demonstrate that magnetic arcades within the solar corona can trap MHD fast waves in a 3D waveguide. This is accomplished through the construction of a cylindrically symmetric model of a magnetic arcade with a potential magnetic field. For a magnetically dominated plasma, we derive a governing equation for MHD fast waves and from this equation we show that the magnetic arcade forms a 3D waveguide if the Alfvén speed increases monotonically beyond a fiducial radius. Both magnetic pressure and tension act as restoring forces, instead of just tension as is generally assumed in 1D models. Since magnetic pressure plays an important role, the eigenmodes involve propagation both parallel and transverse to the magnetic field. Using an analytic solution, we derive the specific eigenfrequencies and eigenfunctions for an arcade possessing a discontinuous density profile. The discontinuity separates a diffuse cylindrical cavity and an overlying shell of denser plasma that corresponds to the bright loops. We emphasize that all of the eigenfunctions have a discontinuous axial velocity at the density interface; hence, the interface can give rise to the Kelvin–Helmholtz instability. Further, we find that all modes have elliptical polarization with the degree of polarization changing with height. However, depending on the line of sight, only one polarization may be clearly visible.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2015

MAGNETIC GAMES BETWEEN A PLANET AND ITS HOST STAR: THE KEY ROLE OF TOPOLOGY

Magnetic interactions between a star and a close-in planet are postulated to be a source of enhanced emissions and to play a role in the secular evolution of the orbital system. Close-in planets generally orbit in the sub-alfvénic region of the stellar wind, which leads to efficient transfers of energy and angular momentum between the star and the planet. We model the magnetic interactions occurring in close-in star–planet systems with three-dimensional, global, compressible magnetohydrodynamic numerical simulations of a planet orbiting in a self-consistent stellar wind. We focus on the cases of magnetized planets and explore three representative magnetic configurations. The Poynting flux originating from the magnetic interactions is an energy source for enhanced emissions in star–planet systems. Our results suggest a simple geometrical explanation for ubiquitous on/off enhanced emissions associated with close-in planets, and confirm that the Poynting fluxes can reach powers of the order of 10{sup 19} W. Close-in planets are also shown to migrate due to magnetic torques for sufficiently strong stellar wind magnetic fields. The topology of the interaction significantly modifies the shape of the magnetic obstacle that leads to magnetic torques. As a consequence, the torques can vary by at least an order of magnitude as the magnetic topology of the interaction varies.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2015

LONG-TERM VARIATION IN THE SUN’S ACTIVITY CAUSED BY MAGNETIC ROSSBY WAVES IN THE TACHOCLINE

Long-term records of sunspot number and concentrations of cosmogenic radionuclides (10Be and 14C) on the Earth reveal the variation of the Sun's magnetic activity over hundreds and thousands of years. We identify several clear periods in sunspot, 10Be, and 14C data as 1000, 500, 350, 200, and 100 years. We found that the periods of the first five spherical harmonics of the slow magnetic Rossby mode in the presence of a steady toroidal magnetic field of 1200–1300 G in the lower tachocline are in perfect agreement with the timescales of observed variations. The steady toroidal magnetic field can be generated in the lower tachocline either due to the steady dynamo magnetic field for low magnetic diffusivity or due to the action of the latitudinal differential rotation on the weak poloidal primordial magnetic field, which penetrates from the radiative interior. The slow magnetic Rossby waves lead to variations of the steady toroidal magnetic field in the lower tachocline, which modulate the dynamo magnetic field and consequently the solar cycle strength. This result constitutes a key point for long-term prediction of the cycle strength. According to our model, the next deep minimum in solar activity is expected during the first half of this century.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2022

Revealing room temperature ferromagnetism in exfoliated Fe 5 GeTe 2 flakes with quantum magnetic imaging

Van der Waals (vdW) material Fe 5 GeTe 2 , with its long-range ferromagnetic ordering near room temperature, has significant potential to become an enabling platform for implementing novel spintronic and quantum devices. To pave the way for applications, it is crucial to determine the magnetic properties when the thickness of Fe 5 GeTe 2 reaches the few-layers regime. However, this is highly challenging due to the need for a characterization technique that is local, highly sensitive, artifact-free, and operational with minimal fabrication. Prior studies have indicated that Curie temperature T C can reach up to close to room temperature for exfoliated Fe 5 GeTe 2 flakes, as measured via electrical transport; there is a need to validate these results with a measurement that reveals magnetism more directly. Here, we investigate the magnetic properties of exfoliated thin flakes of vdW magnet Fe 5 GeTe 2 via quantum magnetic imaging technique based on nitrogen vacancy centers in diamond. Through imaging the stray fields, we confirm room-temperature magnetic order in Fe 5 GeTe 2 thin flakes with thickness down to 7 units cell. The stray field patterns and their response to magnetizing fields with different polarities is consistent with previously reported perpendicular easy-axis anisotropy. Furthermore, we perform imaging at different temperatures and determine the Curie temperature of the flakes at ≈300 K. These results provide the basis for realizing a room-temperature monolayer ferromagnet with Fe 5 GeTe 2 . This work also demonstrates that the imaging technique enables rapid screening of multiple flakes simultaneously as well as time-resolved imaging for monitoring time-dependent magnetic behaviors, thereby paving the way towards high throughput characterization of potential two-dimensional (2D) magnets near room temperature and providing critical insights into the evolution of domain behaviors in 2D magnets due to degradation.

2D magnet↗
DOE OSTI2020

Noncollinear magnetic structure and magnetoelectric coupling in buckled honeycomb Co 4 Nb 2 O 9 : A single-crystal neutron diffraction study

Through an analysis of single-crystal neutron diffraction data, we present the magnetic structure and magnetoelectric properties of Co 4 Nb 2 O 9 under various magnetic fields. In zero field, neutron diffraction experiments below T N =27K reveal that the Co 2+ moments order in the (ab) plane without any spin canting along the c axis, manifested by the magnetic symmetry C2/c'. Along each Co chain parallel to the c axis, the moments of nearest-neighbor Co atoms order ferromagnetically with a small cant away from the next-nearest-neighbor Co moments. Under the applied magnetic field H ∥ a, three magnetic domains were aligned with their major magnetic moments perpendicular to the magnetic field with no other observable magnetic transitions. The influences of magnetic fields on the magnetic structures associated with the observed magnetoelectric coupling are discussed.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2019

Synthesis, magnetization, and heat capacity of triangular lattice materials NaErSe 2 and KErSe 2

In this paper we report the synthesis, magnetization, and heat capacity of the frustrated magnets A ErSe 2 ( A = Na , K ) which contain perfect triangular lattices of Er 3 + . The magnetization data suggests no long-range magnetic order exists in A ErSe 2 ( A = Na , K ), which is consistent with the heat capacity measurements. Large anisotropy is observed between the magnetization within the a b plane and along the c axis of both compounds. When the magnetic field is applied along the a b plane, anomalies are observed at 1.8 μ B in NaErSe 2 at 0.2 T and 2.1 μ B in KErSe 2 at 0.18 T. Unlike NaErSe 2 , a plateaulike field-induced metamagnetic transition is observed for H ∥ c below 1 K in KErSe 2 . Two broad peaks are observed in the heat capacity below 10 K indicating possible crystal electric field (CEF) effects and magnetic entropy released under different magnetic fields. All results indicate that A ErSe 2 are strongly anisotropic, frustrated magnets with field-induced transition at low temperature. The lack of signatures for long-range magnetic order implies that these materials are candidates for hosting a quantum spin liquid ground state.

36 MATERIALS SCIENCE↗