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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 811 records · Page 45
All sourcesNASA NTRSDOE OSTI
DOE OSTI2020

Giant Magnetoelectric Coupling and Magnetic-Field-Induced Permanent Switching in a Spin Crossover Mn(III) Complex

We investigate giant magnetoelectric coupling at a Mn 3+ spin crossover in [Mn III L]BPh 4 (L = (3,5-diBr-sal) 2 323) with a field-induced permanent switching of the structural, electric, and magnetic properties. An applied magnetic field induces a first-order phase transition from a high spin/low spin (HS-LS) ordered phase to a HS-only phase at 87.5 K that remains after the field is removed. We observe this unusual effect for DC magnetic fields as low as 8.7 T. The spin-state switching driven by the magnetic field in the bistable molecular material is accompanied by a change in electric polarization amplitude and direction due to a symmetry-breaking phase transition between polar space groups. The magnetoelectric coupling occurs due to a γη 2 coupling between the order parameter γ related to the spin-state bistability and the symmetry-breaking order parameter η responsible for the change of symmetry between polar structural phases. We also observe conductivity occurring during the spin crossover and evaluate the possibility that it results from conducting phase boundaries. We perform ab initio calculations to understand the origin of the electric polarization change as well as the conductivity during the spin crossover. Thus, in this work, we demonstrate a giant magnetoelectric effect with a field-induced electric polarization change that is 1/10 of the record for any material.

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

Recycling of additively printed anisotropic Nd-Fe-B bonded magnets

A high potential cost-effective and environmentally friendly method has been applied for recycling anisotropic Nd-Fe-B bonded magnets. Waste additively printed Hydrogenation-Disproportionation-Desorption-Recombination (HDDR) Nd-Fe-B anisotropic bonded magnet was pulverized into composite powder containing Nd-Fe-B particles and nylon binder through cryomilling at a liquid nitrogen temperature (~77 K) under Ar inert atmosphere. Then, the cryomilled composite powder was warm compacted into a bonded magnet. Further, the magnetic particles were aligned during post-compaction annealing under a magnetic field of 30 kOe. The recycled bonded magnets have a higher density (3% enhancement), but slightly inferior magnetic properties compared to the original magnets, i.e., the magnetic remanence, coercivity and maximum energy product are reduced by 2%, 3% and 8%, respectively. The scanning electron microscopy revealed that some HDDR Nd-Fe-B powder crumbled into fine particles during cryomilling. Powder X-ray diffraction showed a small amount of Nd-oxide impurity in the cryomilled powder. The slightly deteriorated magnetic properties are ascribed to the oxidation of Nd-Fe-B particles due to formation of fresh fracture surface during cryomilling. The approach enables the direct reuse of end-of-life bonded magnets in an economical and environmentally friendly way.

36 MATERIALS SCIENCE↗
DOE OSTI2017

Comparative analysis of the structural and morphological features of biogenic and synthesized goethite nanoparticles

A comparative analysis of the relationship between the morphological forms and magnetic properties of natural goethite particles from the crust of weathering of the Far East and Vietnam basalts and pure, chemically synthesized goethite particles was performed using Mössbauer spectroscopy, X-ray diffraction analysis, and scanning electron microscopy. It is shown how the shape of biogenic goethite particles affects their magnetic properties, which significantly differ from the magnetic properties of chemically synthesized samples.

36 MATERIALS SCIENCE↗
DOE OSTI2018

Effect of Strain on Magnetic Coupling in Ga-Doped WS{sub 2} Monolayer: Ab Initio Study

Magnetic properties of Ga-doped WS{sub 2} monolayer under strain are investigated by ab initio methods. Without strain, the Ga-doped WS{sub 2} monolayer is a magnetic nanomaterial, and the total magnetic moment is about 0.82 μ{sub B}. We applied strain to Ga-doped WS{sub 2} monolayer from − 10 to 10%. The magnetic properties are modified under different strains, and a maximum magnetic moment reaches 3.09 μ{sub B} at − 3% compressive strain. However, the magnetic moment of system decreases to zero sharply when compressive strain arrived at − 10%. The coupling among Ga 3d, W 5d, and S 3p states is responsible for the strong strain effect on the magnetic properties. Our studies predict Ga-doped WS{sub 2} monolayer under strain to be candidates for application in spintronics.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2016

Magnetic-field-induced changes in superparamagnetic cluster dynamics in the martensitic phase of Ni 43 Co 7 Mn 40 Sn 10

The off-stoichiometric Heusler alloys, such as Ni 50 Mn 25+y X 25-y (X = Sn, In, Ga, etc.), have been extensively investigated using a variety of experimental techniques to probe their interesting and potentially useful magnetic properties. Recent 55 Mn nuclear magnetic resonance (NMR) experiments, carried out largely in zero field (ZF) and making use of the large internal hyperfine field at the nuclear sites, have demonstrated the power of this approach in determining the ground state magnetic characteristics of these materials. In particular, the results reveal that distinct nanoscale ferromagnetic and antiferromagnetic phases coexist. A key parameter used in interpreting the NMR data is the transverse relaxation time T 2 which, inter alia , determines the NMR blocking temperature T$N\atop{B}$ MR of magnetic regions. The present experiments on a polycrystalline sample of a specific illustrative alloy, Ni 43 Co 7 Mn 40 Sn 10 , which has received considerable attention, show that the application of relatively small external fields, comparable to or greater than the local anisotropy field in the ferromagnetic cluster regions, produces dramatic changes in T 2 and hence T$N\atop{B}$ MR . The experimental findings are discussed using an extended version of a recently proposed nanocluster model for superparamagnetic systems. It is thus demonstrated that the field and temperature induced changes in T 2 provide a significant test of the model and lead to a notable advance in applying the NMR technique to the investigation of the magnetic properties of this type of alloy.

36 MATERIALS SCIENCE↗
DOE OSTI2019

Molecular Magnets Based on a Modular Approach: Investigation of Coupling, Anisotropy and Electronic Factors on Bistability (Final Report)

The research in this DOE funded period led to the design of new molecular materials with enhanced magnetic properties for mononuclear Single Molecule Magnets (SMMs) owing to strong single-ion anisotropy and improved magnetic coupling in transition and rare earth complexes. We based experimental efforts on verifying/refuting results of theorists who made predictions about compounds that would be excellent candidates for behaving as single molecule magnets. This phase of the project was aimed at advancing the knowledge gained from our recent synthetic and magnetic studies and taking the work to a new level by applying more extensive theory at the ab initio and DFT levels. Students and postdoctoral researches on the project synthesized all of the compounds and determined their structures as well as their magnetic properties. Along with the PI, the co-workers interpreted the data and wrote publications. Twenty-one publications acknowledging DOE support have been published or are in press.

36 MATERIALS SCIENCE↗
DOE OSTI2018

Effect of anti-site disorder on magnetism in La 2 NiMnO 6

La 2 NiMnO 6 has been reported to exhibit a paramagnetic to ferromagnetic transition with a transition temperature of ~ 260 K. However, most of its magnetic properties, such as the saturation magnetization and even the transition temperature, appear to vary considerably among different reports. This is possibly because the crystallographic structure as well as the extent of the anti-site disorder (ASD) at the Ni/Mn sites are strongly influenced by the choice of synthesis routes. There are diverse reports connecting the extent of ASD to the valencies of Ni and Mn ions, such as Ni 2+ -Mn 4+ and Ni 3+ -Mn 3+ , including suggestions of thermally induced valence transitions. Consequently, these reports arrive at very different conclusions on the mechanism behind the magnetic properties of La 2 NiMnO 6 . To address the correlation between ASD and valency, we have carried out a comparative study of two monoclinic La 2 NiMnO 6 polycrystals with different degrees of ASD. Using a combination of x-ray absorption spectroscopy, x-raymagnetic circular dichroism, andmagnetometry, we conclude that the valency of the transition metal ions, and the transition temperature, are insensitive to the extent of ASD. Furthermore, we find the magnetic moment decreases strongly with an increasing ASD. We attribute this effect to the introduction of antiferromagnetic interactions in the anti-site disordered regions.

36 MATERIALS SCIENCE↗
DOE OSTI2018

On spinodal decomposition in alnico - A transmission electron microscopy and atom probe tomography study

Here, alnico is a prime example of a finely tuned nanostructure whose magnetic properties are intimately connected to magnetic annealing (MA) during spinodal transformation and subsequent lower temperature annealing (draw) cycles. Using a combination of transmission electron microscopy and atom probe tomography, we show how these critical processing steps affect the local composition and nanostructure evolution with impact on magnetic properties. The nearly 2-fold increase of intrinsic coercivity (H ci ) during the draw cycle is not adequately explained by chemical refinement of the spinodal phases. Instead, increased Fe-Co phase (α 1 ) isolation, development of Cu-rich spheres/rods/blades and additional α 1 rod precipitation that occurs during the MA and draw, likely play a key role in Hci enhancement. Chemical ordering of the Al-Ni-phase (α 2 ) and formation of Ni-rich (α 3 ) may also contribute. Unraveling of the subtle effect of these nano-scaled features is crucial to understanding on how to improve shape anisotropy in alnico magnets.

36 MATERIALS SCIENCE↗
DOE OSTI2025

High-performance permanent-magnet materials based on CeFe 12

We perform first-principles calculations on the Mo/Zr-alloyed ThMn 12 -structure prototype CeFe 12 to explore its electronic and magnetic properties and potential for permanent magnet applications. A recent experiment has shown that the Mo/Zr-alloyed CeFe 12 phase with the symmetry 𝐼⁢4/𝑚⁢𝑚⁢𝑚 can be stabilized in bulk. It encourages an investigation into the intrinsic magnetic characteristics of the base structure CeFe 12 and the effect of transition metal alloying in it. Our calculations reveal that the base structure prototype CeFe 12 in its tetragonal phase exhibits uniaxial magnetic anisotropy with a magnetic anisotropy energy (𝐾 1 ) ∼ 1 MJ/m −3 and a substantial magnetic moment of ∼ 1.8T, showing its promise as a permanent magnet. The introduction of the stabilizing transition metals Zr, Mo, and W reduces these values but still keeps the materials very promising. Notably, when 50% of Ce is substituted by Sm in Mo-alloyed CeFe 12 , the 𝐾 1 is significantly enhanced, accompanied by a fairly decent magnetic moment of ∼ 1.2T. These findings establish this alloy as a strong candidate for high-performance permanent magnet applications. In conclusion, this study emphasizes the importance of strategic element substitution and site selection in transition metal-alloyed CeFe 12 to achieve both structural stability and remarkable magnetic properties.

Density of states↗
DOE OSTI2022

Violation of the rule of parsimony: Mixed local moment and itinerant Fe magnetism in Fe 3 GeN

Ternary iron nitrides are of considerable interest due to their diverse magnetic properties. We find, based on first principles calculations, that the relatively minor structural distortion from the cubic antiperovskite structure in Fe$_3$GeN, consisting of octahedral rotations, leads to unusual magnetic behavior. In particular, there is a separation into Fe sites with very different magnetic behaviors, specifically a site with Fe atoms having a stable local moment and a site where the Fe shows characteristics of much more itinerant behavior. This shows a remarkable flexibility of the Fe magnetic behavior in these nitrides and points towards the possibility of systems where minor structural and chemical changes can lead to dramatic changes in magnetic properties. The results suggest that, analogously to oxide perovskite materials, modulation of magnetic properties via chemical or strain control of octahedral rotation may be feasible. Furthermore, this may then lead to approaches for tuning magnetism to realize properties of interest, for example tuning magnetic transitions to quantum critical regimes or to proximity to metamagnetic transitions of interest for devices.

36 MATERIALS SCIENCE↗
DOE OSTI2018

Low-Temperature Short-Time SPS Processes to Produce Fine-Grained High-Coercivity Barium Hexaferrite Ceramics from Polyol Nanoparticles

Barium hexaferrite (BaFe{sub 12}O{sub 19}) ceramics were obtained by combination of polyol-synthesized precursors subsequently consolidated by spark plasma sintering (SPS) at a low temperature (800 {sup ∘}C). X-ray powder diffraction studies showed the influence of the experimental parameters to produce a virtually single- or multiphase material. The room temperature magnetic properties exhibited interesting variety of properties, including exchange coupling (spring magnet) between hexaferrite and other magnetic phases. The saturation magnetization and coercive field, at room temperature, are in the 34–70 emu/g and 4.1–5.0 kOe ranges, respectively. The combination of strong coercive field and magnetization resulted in a maximum energy product [(BH)max] = 10.9 kJ/m{sup 3} for the sample with the highest BaFe{sub 12}O{sub 19} content.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2018

Spin Glass in a Geometrically Frustrated Magnet of ZnFe{sub 2}O{sub 4} Nanoparticles

We investigated the magnetic properties of a geometrically frustrated magnet of ZnFe{sub 2}O{sub 4} nanoparticles by carrying out the comprehensive measurements of dc magnetization and ac susceptibility. Spin glass is confirmed to occur in this weakly Fe(Zn)-ionic-inversed sample. The common characteristics of spin glass including the aging, the memory, and the rejuvenation effects were observed. By using the critical-power law to study the spin dynamics, the spin-glass transition temperature T{sub g} is obtained to be 18 K and the dynamic exponent zν is 8.0. The weak exchange interaction disorder introduced by the ferrimagnetic J{sub AB} interaction, together with the weak nonmagnetic dilute disorder induced by the ionic inversion, is responsible for the formation of spin glass in the ZnFe{sub 2}O{sub 4} nanoparticles.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2016

Structural and magnetic characteristics of PVA/CoFe{sub 2}O{sub 4} nano-composites prepared via mechanical alloying method

Highlights: • Single phase CoFe{sub 2}O{sub 4} nano-particles synthesized in one step by mechanical alloying. • PVA/CoFe{sub 2}O{sub 4} magnetic nano-composites were fabricated via mechanical milling. • FTIR confirmed the interaction between PVA and magnetic CoFe{sub 2}O{sub 4} particles. • Increasing in milling time and PVA amount led to well dispersion of CoFe{sub 2}O{sub 4}. - Abstract: In this research, polyvinyl alcohol/cobalt ferrite nano-composites were successfully synthesized employing a two-step procedure: the spherical single-phase cobalt ferrite of 20 ± 4 nm mean particle size was synthesized via mechanical alloying method and then embedded into polymer matrix by intensive milling. The results revealed that increase in polyvinyl alcohol content and milling time causes cobalt ferrite particles disperse more homogeneously in polymer matrix, while the mean particle size and shape of cobalt ferrite have not been significantly affected. Transmission electron microscope images indicated that polyvinyl alcohol chains have surrounded the cobalt ferrite nano-particles; also, the interaction between polymer and cobalt ferrite particles in nano-composite samples was confirmed. Magnetic properties evaluation showed that saturation magnetization, coercivity and anisotropy constant values decreased in nano-composite samples compared to pure cobalt ferrite. However, the coercivity values of related nano-composite samples enhanced by increasing PVA amount due to domain wall mechanism.

36 MATERIALS SCIENCE↗
DOE OSTI2019

Unique Phenomena in Transverse Ising Nanoislands

The phase diagrams and magnetizations in four transverse Ising nanoislands with an antiferromagnetic configuration and a ferromagnetic spin configuration are examined by the use of the effective field theory with correlations. They exhibit the same behaviors for the magnetic properties. Some characteristic phenomena, such as the reentrant phenomena, are found in the magnetic properties. The phenomena come from the frustration induced by the finite size of the systems.

77 NANOSCIENCE AND NANOTECHNOLOGY↗
DOE OSTI2019

Easy Controlled Properties of Quaternary FeNiCrCd Thin Films Deposited from a Single dc Magnetron Sputtering Under the Influence of Deposition Rate

The quaternary FeNiCrCd thin films were produced from a single FeNiCrCr source on a commercial flexible polymer substrate using one dc magnetron sputtering technique. For that, a series of the films with a thickness of 50 nm were produced at different deposition rates of 0.02, 0.04, 0.06, and 0.08 nm/s, separately. In this study, as far as concerned, this was the first time that structural and magnetic properties of FeNiCrCd thin films were investigated. According to compositional analysis, the Fe and Cr contents slightly decreased with increasing deposition rate while Ni was almost constant, whereas those of the amount of Cd atoms increased. However, the atomic amounts of Fe and Cd in the films are quite different from those of the source material. The change of the atomic contents in the films from the source may be attributed to the relatively different bond energy/melting point of metals which have different contents sputtered from source material since this physical parameter is very significant for the sputtering process. For crystal structural analysis, a combination of hexagonal close-packed (hcp) and body-centered cubic (bcc) were observed. The peak intensity of the bcc-dominated planes decreased while the hcp-dominant plane increased since the change in peak intensities is compatible with the compositional analysis with increasing deposition rate. And, the grain sizes decreased gradually from 40.1 to 23.4 nm, with increasing deposition rate from 0.02, to 0.08 nm/s. Also, the film surfaces transformed from a rough to smooth surfaces with decreasing grain sizes as deposition rate increased. For magnetic analysis, the saturation magnetization M{sub s} values decreased as 1030, 773, 730, and 217 emu/cm{sup 3} with increasing deposition rate as 0.02, 0.04, 0.06, and 0.08 nm/s, respectively. In the same manner, the coercivity H{sub c} values were found as 11, 7, 6, and 2 Oe with the deposition rate of 0.02, 0.04, 0.06, and 0.08 nm/s, respectively. The decrease of the H{sub c} may have primarily come from the transformation of rough to smooth surface of the films. It may also be said that the films showed soft magnetic properties due to their low H{sub c} values with increasing deposition rate. Thus, the magnetic properties of the quaternary FeNiCrCd alloy films were seen to be easily improved with the deposition rate parameter for potential use in different industrial applications.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2017

Analysis of the exchange magnetic structure in Pb{sub 3}Mn{sub 7}O{sub 15}

The indirect-coupling model is used to analyze the exchange magnetic structure of Pb{sub 3}Mn{sub 7}O{sub 15} in the hexagonal setting. The ratios of manganese ions Mn{sup 4+}/Mn{sup 3+} in each nonequivalent position are determined. Pb{sub 3}(Mn{sub 0.95}Ge{sub 0.05}){sub 7}O{sub 15} and Pb{sub 3}(Mn{sub 0.95}Ga{sub 0.05}){sub 7}O{sub 15} single crystals are grown by the solution–melt method in order to test the validity of the proposed model. The structural and magnetic properties of the single crystals are studied. The magnetic properties of the grown single crystals are compared with those of nominally pure Pb{sub 3}Mn{sub 7}O{sub 15}.

36 MATERIALS SCIENCE↗
DOE OSTI2024

High-temperature concomitant metal-insulator and spin-reorientation transitions in a compressed nodal-line ferrimagnet Mn 3 Si 2 Te 6

Symmetry-protected band degeneracy, coupled with a magnetic order, is the key to realizing novel magnetoelectric phenomena in topological magnets. While the spin-polarized nodal states have been identified to introduce extremely-sensitive electronic responses to the magnetic states, their possible role in determining magnetic ground states has remained elusive. Here, taking external pressure as a control knob, we show that a metal-insulator transition, a spin-reorientation transition, and a structural modification occur concomitantly when the nodal-line state crosses the Fermi level in a ferrimagnetic semiconductor Mn 3 Si 2 Te 6 . These unique pressure-driven magnetic and electronic transitions, associated with the dome-shaped Tc variation up to nearly room temperature, originate from the interplay between the spin-orbit coupling of the nodal-line state and magnetic frustration of localized spins. Our findings highlight that the nodal-line states, isolated from other trivial states, can facilitate strongly tunable magnetic properties in topological magnets.

36 MATERIALS SCIENCE↗
DOE OSTI2019

Magnetic, Magnetocaloric Properties, and Phenomenological Model in Amorphous Ni{sub 80−x}Fe{sub x}(SiB){sub 20} Alloys with (x = 0, 2.4, 8, and 16)

Amorphous Ni{sub 80−x}Fe{sub x}(SiB){sub 20} ribbons with different Fe concentrations (0 ≤ x ≤ 16) were fabricated by melt spinning technique, and their magnetic and magnetocaloric properties were investigated and a phenomenological model was also applied. The Curie temperature (T{sub C}), magnetic moment of transition metal and maximum magnetic entropy change (− ΔS{sub M}) increase with increasing Fe content. At a magnetic field change of 2 T, the (− ΔS{sub M}) and relative cooling power (RCP) show the highest values of 0.53 J/kg K and 85 J kg{sup −1} respectively for Fe{sub 16}Ni{sub 64}(SiB){sub 20} alloys. In addition, a satisfactory agreement between the experimental and Hamad’s phenomenological model is reported.

36 MATERIALS SCIENCE↗