Body-centered Tetragonal Structure Research Articles

Structural, electronic and optical properties of CdTiX2 (X = N and P): A first principles density functional theory investigation

In the present paper, we have proposed new ternary materials CdTiN2 and CdTiP2 with body centered tetragonal structure. We have studied the structural, electronic, and optical properties of the proposed compounds with the help of the first principles density functional theory. The calculated electronic band structure shows that these compounds show indirect band gap of 1.089 eV and 0.359 eV for the compounds CdTiN2 and CdTiP2 respectively and hence it is concluded that these compounds are semiconducting nature. The optical properties such as the reflectivity, absorption, refractive index, real and imaginary part of dielectric function, optical conductivity, electronic energy loss function shows that studied compounds CdTiN2 and CdTiP2 may be promising materials for optoelectronic devices and the photoelectric solar cells.

Short-Period Skyrmion Crystals in Itinerant Body-Centered Tetragonal Magnets

In this study, we investigate the stability of a magnetic skyrmion crystal with short-period magnetic modulations in a centrosymmetric body-centered tetragonal system. By performing the simulated annealing for the spin model, incorporating the effects of the biquadratic interaction and high-harmonic wave–vector interaction in momentum space, we find that the double-Q square skyrmion crystal consisting of two spin density waves is stabilized in an external magnetic field. We also show that double-Q states appear in both low- and high-field regions; the low-field spin configuration is characterized by an anisotropic double-Q modulation consisting of a superposition of the spiral wave and sinusoidal wave, while the high-field spin configuration is characterized by an isotropic double-Q modulation consisting of a superposition of two sinusoidal waves. Furthermore, we show that the obtained multiple-Q instabilities can be realized for various ordering wave vectors. The results provide the possibility of realizing the short-period skyrmion crystals under the body-centered tetragonal lattice structure.

Failure Behavior and Mechanism of Vat Photopolymerization Additively Manufactured Al2O3 Ceramic Lattice Structures

Vat photopolymerization additive manufacturing produces lightweight load-bearing ceramic lattice structures that have flexibility, time-efficiency, and high precision, compared to conventional technology. However, understanding the compression behavior and failure mechanism of such structures under loading remains a challenge. In this study, considering the correlation between the strut angle and bearing capacity, body-centered tetragonal (BCT) lattice structures with varying angles are designed based on a body-centered cubic (BCC) structure. BCT Al2O3 ceramic lattice structures with varying angles are fabricated by vat photopolymerization. The mechanical properties, deformation process, and failure mechanism of the Al2O3 ceramic lattice structures are characterized through a combination of ex- and in-situ X-ray computed tomography (X-CT) compression testing and analyzed using a finite element method (FEM) at macro- and micro-levels. The results demonstrate that as the angle increases, the stress concentration gradually expands from the node to the strut, resulting in an increased load-bearing capacity. Additionally, the failure mode of the Al2O3 ceramic lattice structures is identified as diagonal slip shear failure. These findings provide a greater understanding of ceramic lattice structure failures and design optimization approaches.

Dilution induced magnetic localization in Rb(Co[formula omitted]Ni[formula omitted])2Se2 single crystals

We report experimental studies on a series of Rb(Co1−xNix)2Se2 (0.02 ≤x≤ 0.9) powder and single crystal samples using x-ray diffraction, neutron diffraction, magnetic susceptibility, and electronic transport measurements. All compositions are metallic and adopt the body-centered tetragonal structure with I4/mmm space group. Anisotropic magnetic susceptibilities measured on single crystal samples suggest that Rb(Co1−xNix)2Se2 undergo an evolution from ferromagnetism to antiferromagnetism, and finally to paramagnetism with increasing Ni concentration. Neutron diffraction measurements on the samples with x = 0.1, 0.4, and 0.6 reveal an A-type antiferromagnetic order with moments lying in the ab plane. The moment size changes from 0.69 (x=0.1) to 2.80μB (x=0.6) per Co ions. Our results demonstrate that dilution of the magnetic Co ions by substitution of nonmagnetic Ni ions induces magnetic localization and evolution from itinerant to localized magnetism in Rb(Co1−xNix)2Se2.

Martensitic phase mechanism of ternary FeCrMn thin films influenced by the substrate rotation speeds: structural and magnetic properties

In order to investigate the martensitic phase mechanism of the ternary FeCrMn thin films sputtered under the effect of substrate rotation speeds, the structural and related magnetic properties were studied. A range of thin films were deposited at varying rotational speeds of 0, 15, 30, and 45 rpm on flexible amorphous polymer substrates through the use of DC magnetron sputtering. The films were 50 nm thick and were produced at 0.09 nm s−1. The crystal structures showed that all films have a mixture of the body-centred tetragonal (bct) and tetragonal structure. The peak intensity of bct (110) martensitic α’phase increased with the increase of the rotation speeds whereas the tetragonal (430) and (333) peaks stayed almost stable. And, the morphologic surface analysis displayed that the smooth surface turned into a rough surface with the increase of the rotation speeds. After the measurements of hysteresis loops, the films obtained by sputtering of austenitic target have ferromagnetic character with increasing saturation magnetization, MS and coercivity, HC as the substrate rotation speeds increase. With increasing rotation speeds, the increase of the MS from 148 to 242 emu cm−3 and the rise of the HC of the films from 21 to 185 Oe might be explained by the increase of the grain sizes with the increase of % martensitic α’phase caused by increasing rotation speeds. The ternary FeCrMn thin films exhibit increasing % martensitic α’phase and corresponding ferromagnetic properties with increasing substrate rotation speeds. It is concluded that the nanostructured films of FeCrMn have different properties from those of their bulk counterparts under the influence of substrate rotation speeds. Therefore, the martensitic mechanism of the films can easily be controlled by changing rotation speed for potentially flexible new device applications such as spintronics, magnetic hetero-structures, magnetic separators, etc.

Ball milling and annealing effect in structural and magnetic properties of copper ferrite by ceramic synthesis

This study aims to better understand the relationship between the microstructure and magnetic properties of copper ferrite, which is an inverse spinel that present a body-centered tetragonal structure associated with a remarkable Jahn–Teller (JT) effect. For this goal, a sample has been synthesized by the ceramic route from a stoichiometric mixture of high-purity CuO and Fe2O3 powders activated mechanically in a high-energy planetary ball mill. This sample was calcined in air furnace at 1000 ºC for 6 h. As synthetized sample with a cubic structure was divided into two parts and one of them was annealed at 650 ºC for 3 h and slowly cooled to room temperature to obtain a pure tetragonal spinel sample. Furthermore, these two samples were subjected to the same processes of severe plastic deformation by milling for up to 70 h and subsequent annealing at temperatures ranging between 300 and 600 ºC to obtain samples with a mixture of phases in different proportions. For the cubic one, there is no change in its structure due to milling, always remaining 100 % cubic, and the evolution in the saturation magnetization was related to the changes in the density of defects present. On the other hand, copper cations are always found in the octahedral sites of spinel with a tetragonal structure. The small decrease in the degree of inversion to 0.95 induced by milling in this sample is capable of breaking the JT distortion, giving rise to the appearance of a cubic phase. This work demonstrates how the structure, microstructure, defects like stacking faults and deformation twins, and degree of inversion of the different phases are related to changes in magnetic properties.

Challenge of fabricating difficult-to-nitride materials: Formation of martensitic phase in (Fe0.8Co0.2)8N foil based on industrially suitable gas-nitriding process

Nitrogen-martensitic phase (Fe0.8Co0.2)8N was successfully synthesized by using an industrially suitable gas-nitriding process of a bulk foil. So far, the nitrogen-martensitic phase of the bulk material has not been synthesized at such a high Co content. We found that this is because the nitride was easily denitrided by elevating temperature. In this work, by exploiting a NH3 gas-nitriding process combined with quenching at a rapid cooling rate (>800 °C/s) in NH3 atmosphere, we found that nitrogen stayed at the surface layer of the foil. By using cross-sectional laser microscopy, the nitride region was observed as a 7-μm-thick layered shape at the surface of the 100-μm-thick foil. An x-ray diffraction technique revealed that the nitride layer was a martensitic phase that was characterized as a body-centered tetragonal structure with c/a = 1.04. These findings can be applied to nitriding and surface treatments for alloy systems in which a nitrogen solid solution is hardly formed. Our developed method is promising because the martensitic phase is expected to be formed in whole bulk by further optimizing parameters clarified in this work.

Strain-Assisted Phase Transformation in Two-Dimensional Transition-Metal Dichalcogenides.

Two-dimensional polymorphic transition-metal dichalcogenides have drawn attention for their diverse applications. This work explores the complex interplay between strain-induced phase transformation and crack growth behavior in annealed nanocrystalline MoS2. Employing molecular dynamics (MD) simulations, this research focuses on the effect of grain size, misorientation, and annealing on phase evolution and their effects on the mechanical behavior of MoS2. First, examining phase transformation in monocrystalline MoS2 under various stress states reveals distinct behaviors depending on the initial phase (1T or 2H) and crystallographic orientation with respect to loading directions. Notably, transformation from a layered hexagonal to a body-centered tetragonal structure is more noticeable when strain in a zigzag direction is applied to the 1T sample. As such, single crystalline MoS2 with a 1T phase exhibits a 16% lower fracture stress in the armchair direction compared to that with a 2H phase. On the other hand, the 1T phase shows a 5% higher phonon lifetime compared to the 2H phase with similar phonon group velocities. Next, the influence of thermal energy and mechanical stress on the phase transformation of nanocrystalline MoS2 is investigated through annealing and quenching cycles, uncovering 60 and 44% irreversibility of phase transformation for an average grain size of 3 and 11 nm, respectively. Besides, the evolution of nanocrystalline samples with different initial phases and grain sizes is studied under uniaxial and biaxial stress. This study shows an inverse pseudo-Hall-Petch effect with exponents of 0.11 and 0.09 for 2H and 1T, respectively. The study reveals that phase transformation can occur concurrently with crack initiation and propagation with the 1T phase exhibiting a 19% lower grain size sensitivity of fracture stress compared to the 2H phase.

The effect of f-electrons on the structural phase transition, mechanical and electronic properties in light rare-earth bismuthides

ABSTRACT The electronic structure, phase transition pressure and mechanical properties of light rare-earth bismuthides (PrBi, NdBi, PmBi and SmBi) have been investigated by full geometry optimization using Vienna Ab-Initio Simulation Package (VASP) which has been used in combination with the projector augmented wave (PAW) method and the generalized gradient approximation (GGA) over the local density approximation (LDA) for exchange-correlation functional. We focus our attention on the lattice constants and elastic constants of these compounds. These compounds undergo a phase transition from the NaCl (B1) structure to the body-centered tetragonal (BCT) structure. We also report the density of states (DOS) of these rare earth bismuthides. In the case of PrBi and NdBi, the 4f states are treated as valence states. The effects of on-site Coulomb repulsion and the spin-orbit coupling (SOC) on the electronic structure are also studied.

Effects of ultrasonic cavitation on microstructure and surface properties of Mn–Cu alloy

In the presented study, the effects of ultrasonic vibration on microstructure and surface properties of Mn–Cu alloy were investigated. At the early stage of ultrasonic cavitation treatment, grains of Mn–Cu alloy are refined, nanocrystals and amorphous bands are produced. As the ultrasonic cavitation treatment proceeds, the face-centered cubic structure is transformed into the body-centered tetragonal structure, and the martensitic phase transformation arises. The transformation is accompanied by plastic deformation and the formation of dislocations. The generation of martensite is caused by the stress and strain. Due to grain refinement, dislocations, and generation of martensite, the surface hardness of Mn–Cu alloy is enhanced, and the friction coefficient decreases. The resistance to wear is thereby improved.

Fluoromethane and chloromethane adsorption studies on hydrogenated C8 nanosheets – A first-principles study

We studied the structural stability of hydrogenated C8 (H-C8) sheets which exhibit body-centered tetragonal (BCT) structure and found to be stable in its structure. The energy gap of H-C8 sheets is observed to be 3.517 eV. The structural firmness of H-C8 is verified with formation energy, which is recorded as −5.947 eV/atom. Besides, fluoromethane and chloromethane, two predominant halomethanes are adsorbed on H-C8 nanosheets. The effectiveness of the H-C8 sheets for the detection of fluoromethane and chloromethane is explored in the current work with the help of density functional theory (DFT) calculations. In addition, the electronic properties and adsorption attributes of fluoromethane and chloromethane on H-C8 sheets were investigated through the band structure, DOS spectrum, and electron density difference diagrams. Moreover, the charge transfer and adsorption energy calculations were also determined to ascertain halomethane adsorption. The results show that halomethanes are physisorbed (-0.429 eV to −0.823 eV) as well as chemisorbed (-1.574 eV) on H-C8 sheets. Thus, H-C8 nanosheets can be used as a sensing element towards fluoromethane and chloromethane molecules.

Formation of a Body-Centered Tetragonal Structure With High Magnetic Anisotropy and Coercivity in Fe–Co–V Films With High C Contents

A high amount of C (0–20 at.%) was added to Fe–Co–V films via sputtering to transform their body-centered cubic (bcc) structure to a face-centered cubic (fcc) lattice through a body-centered tetragonal (bct) structure. The Fe–Co films without V retained a bcc or bct crystal structure with an axial ratio ( <italic xmlns:mml="http://www.w3.org/1998/Math/MathML" xmlns:xlink="http://www.w3.org/1999/xlink">c/a</i> ) of 1.03 even at high C contents close to 20 at.%. Meanwhile, in the Fe–Co films containing 10 at.% of V, a bct structure with 1.06 ≤ <italic xmlns:mml="http://www.w3.org/1998/Math/MathML" xmlns:xlink="http://www.w3.org/1999/xlink">c/a</i> ≤ 1.30 was formed after adding 5–12 at.% of C, which was subsequently transformed to an fcc structure with increasing C content. The saturation magnetization of the Fe–Co–V–C films with the bct structure was approximately 1000–1500 kA/m, and their uniaxial magnetic anisotropy constant ( <italic xmlns:mml="http://www.w3.org/1998/Math/MathML" xmlns:xlink="http://www.w3.org/1999/xlink">K</i> <sub xmlns:mml="http://www.w3.org/1998/Math/MathML" xmlns:xlink="http://www.w3.org/1999/xlink">u</sub> ) was approximately 10 <sup xmlns:mml="http://www.w3.org/1998/Math/MathML" xmlns:xlink="http://www.w3.org/1999/xlink">6</sup> J/m <sup xmlns:mml="http://www.w3.org/1998/Math/MathML" xmlns:xlink="http://www.w3.org/1999/xlink">3</sup> (the films with high Fe contents exhibited high <italic xmlns:mml="http://www.w3.org/1998/Math/MathML" xmlns:xlink="http://www.w3.org/1999/xlink">K</i> <sub xmlns:mml="http://www.w3.org/1998/Math/MathML" xmlns:xlink="http://www.w3.org/1999/xlink">u</sub> values). The bct Fe–Co–V–C films with high <italic xmlns:mml="http://www.w3.org/1998/Math/MathML" xmlns:xlink="http://www.w3.org/1999/xlink">K</i> <sub xmlns:mml="http://www.w3.org/1998/Math/MathML" xmlns:xlink="http://www.w3.org/1999/xlink">u</sub> were microfabricated into nanodot array patterns via electron beam lithography. The coercivity of the pattern increased with decreasing dot size, and that of the pattern with a dot diameter of 85 nm was nearly an order of magnitude higher than that of the continuous film.

Unraveling the Atomic Shuffles of Twinning Nucleation in Hexagonal Close-Packed Rhenium Nanocrystals.

Reining in deformation twinning is crucial for the mechanical properties of hexagonal close-packed (HCP) metals and hinges on an explicit understanding of the twinning nucleation mechanism. Unfortunately, it is often suggested rather than conclusively demonstrated that twinning nucleation can be mediated by pure atomic shuffles. Herein, by utilizing in situ high-resolution transmission electron microscopy, we have dissected the atomic shuffling mechanism during the {101̅2} twinning nucleation in rhenium nanocrystals, which revealed the emergence of an intermediate body-centered tetragonal (BCT) structure. Specifically, the double-layered prismatic planes initially shuffle into single-layered {11̅0}BCT planes; subsequently, adjacent {22̅0}BCT planes shuffle in opposite directions to form the basal planes of the twin embryo. This shuffling mechanism is further corroborated by molecular dynamic simulations. The finding provides direct evidence of shuffle-dominated twinning nucleation with atomic details that may lead to better control of this critical twinning mode in HCP metals.

High Capacity Sn Metal Anode for Aqueous Proton-Based Batteries

Aqueous proton-based batteries (APBs) as a good choice to respond battery diversity, delivering safety, cost, environmental friendliness and high-power necessary for renewable energy storage.1 However, most promising conventional aqueous battery anodes have relatively poor compatibility in acid. The limited existing anode options like Pb and MoO3 can hardly match the high-performance of advanced cathodes, leading low-voltage and unsatisfactory energy density of APBs.2-4 Therefore, the exploration of high-performance anode materials is thus of critical issue for the APB assembling.Sn metal should be one of the most suitable APB anode choices due to its relatively high hydrogen evolution reaction (HER) overpotential, large theoretical capacity (451.6 mAh g−1) and negative redox potential (−0.14 V vs. SHE). With a body-centered tetragonal crystal structure and similar facet surface energy, Sn metal deposit in polyhedral morphology isotropically. This may cause serious “dead Sn” issue when deposition capacity increases because large Sn particle has limited contact with the substrate and easily to shed from the electrode, resulting in low Coulombic efficiency and short lifespan.We will present our efforts of developing Sn anode with high capacity and long lifespan by an interfacial alloying regulation approach. Smaller grain size and more uniform Sn deposition can be achieved by higher propensity for nucleation and Sn migration energy barrier. Extra interfacial interaction suppresses shedding of Sn polyhedron particles, thus prohibiting the formation of “dead” Sn. Based on the optimized Sn metal anode, we propose several promising designs for APBs, with high performance such as high output voltages, good specific energy densities, fast kinetics, and long life. References X. Wu, J. J. Hong, W. Shin, L. Ma, T. Liu, X. Bi, Y. Yuan, Y. Qi, T. W. Surta, W. Huang, J. Neuefeind, T. Wu, P. A. Greaney, J. Lu, X. Ji. Nat. Energy 2019, 4, 123-130.W. Chen, G. Li, A. Pei, Y. Li, L. Liao, H. Wang, J. Wan, Z. Liang, G. Chen, H. Zhang, J. Wang, Y. Cui. Nat. Energy 2018, 3, 428-435.Y. Liang, Y. Jing, S. Gheytani, K. Y. Lee, P. Liu, A. Facchetti, Y. Yao. Nat. Mater. 2017, 16, 841-848.X. Wang, Y. Xie, K. Tang, C. Wang, C. Yan. Angew. Chem. Int. Ed. 2018, 57, 11569-11573.

The structural diversity and properties of NbxMo1-xO2

We synthesized NbxMo1-xO2 series compounds and determined the structure of each component through x-ray diffraction and selected area electron diffraction techniques. For x=0.05, 0.1, 0.2, they possess room temperature MoO2 monoclinic structure (P21/c); for x=0.25, 0.3, they become to body-centered tetragonal structure (I41/a); for x=0.33, 0.6, 0.65, they further turn to TiO2 rutile-type structure (P42/mnm). Nb0.25Mo0.75O2 has transport and magnetic properties similar to those of NbMoO4 as paramagnetic metal. Moreover, the UV–vis spectra indicate the metallic property of Nb0.05Mo0.95O2, Nb0.25Mo0.75O2, and Nb0.6Mo0.4O2. X-ray absorption spectra at the Mo-L3 and Nb-L3 edges present Mo4+/Nb4+ and Mo4+/Nb5+ valence state for Nb0.25Mo0.75O2 and Nb0.05Mo0.95O2, respectively. This means the latter can be descripted as Nb0.05Mo0.95O2+δ with δ = 0.025.

Constituent phases, microstructures, and martensitic transformation of β-type Zr-Nb-Sn alloys

Constituent phases, shape memory and superelastic properties and microstructure in β-type Zr–(6–10.5)Nb–(2–5)Sn (at.%) alloys were investigated. Zr–(8–10.5)Nb–(2–4)Sn alloys exhibited shape memory effect and partial superelastic recovery. Zr–(8–9)Nb–5Sn alloys exhibited distinct superelasticity. The alloys with low Nb content (x < 8 at.%) exhibited an α” phase and a β phase. For the alloys with high Nb content (x ≥ 8 at.%), in addition to the matrix of a β phase, a β′ phase with a body-centered tetragonal structure was observed. Lattice deformation strains were calculated based on the lattice parameters of the β phase and the α” phase. The distribution of the β′ phase showed no significant Nb content dependence, whereas the addition of Sn caused a sparse distribution of the β′ phase. In situ X-ray diffraction measurements under heating and cooling revealed that transformation between the β phase and the β′ phase is reversible. The β′ phase was absent in the deformation-induced α” phase, suggesting that β’→α” phase transformation occurred during the deformation together with β → α” phase transformation. TEM observation revealed that dislocations remained in the deformation-induced α” phase closed to the β′ phase. The presence of the β′ phase was considered to be the cause for a larger stress hysteresis and a smaller superelastic recovery strain in the Zr-based superelastic alloys than those in Ti-based superelastic alloys. The effect of the β’ phase on the superelastic properties of Zr-based alloys was discussed in comparison with Ti-based alloys.

A first-principles study on the early-stage corrosion of a NiWNb alloy in a chloride salt environment

In this work a representative nickel superalloy, Ni70W20Nb10, was investigated in the presence of chlorine to quantify its early-stage dissolution behavior. Surface structures were generated from a bulk configuration sampled in equilibrium using a multi-cell Monte Carlo method for phase prediction. The predicted solid-phase at 800∘C was Ni72W19Nb9 in a body-centered tetragonal crystal structure closely resembling the Ni4W structure. Chlorine adsorption onto the energetically favored (110) surface showed preference to niobium which acted as a trapping sink on the top surface of the slab model. Our findings suggested that niobium and tungsten enhanced the corrosion resistance of nickel as their presence created regions that were thermodynamically preferred by the incoming chlorine and less susceptible to chlorine-facilitated dissolution from the alloy. Nickel, niobium, and tungsten resisted chlorine-induced dissolution from the surface model up to a 1/3 monolayer coverage of chlorine indicating that all constituents of this alloy possessed superior resistance to localized surface degradation such as corrosive pitting. Further analysis and comparisons between the corrosion resistance of the three metallic species was performed. This work may provide insights that aid in the development of improved structural materials for molten salt reactors.

Atomic, electronic, and superconducting properties of Zr[formula omitted]Ir compound

We have investigated the structural, electronic, mechanical, phononic, and superconducting properties of the Zr2Ir compound with a body-centered tetragonal crystal structure using first-principles calculations. Our analysis reveals that the Zr2Ir compound shows mechanical and dynamically stable by using with and without spin–orbit coupling (SOC) effect. After calculating some properties such as elastic constants, Bulk modulus, Young’s modulus, Poisson ratio, Debye temperature, and sound velocity, we found that Zr2Ir is ductile. When the elastic constants C11 and C33 are compared, it is determined that the situation changes in the opposite direction under the effect of SOC, that is, more compressibility along the x-axis turns into the z-axis. Here, the electronic band structure and intensity of the states calculated for the compound show a metallic character. The superconducting critical temperature (Tc) and electron–phonon coupling constant (λ) were found to be 7.50 K and 0.93 without SOC and 7.62 K and 0.96 with SOC, respectively. We determined that although the Zr2Ir compound has a strong electron–phonon coupling regime, the inclusion of SOC slightly reduces its critical temperature and electron–phonon coupling constant.

Pressure-induced Structural Phase Transition and New Superconducting Phase in UTe2

We report on the crystal structure and electronic properties of the heavy fermion superconductor UTe2 at high pressure up to 11 GPa, as investigated by X-ray diffraction and electrical resistivity experiments. The X-ray diffraction measurements under high pressure using a synchrotron light source reveal anisotropic linear compressibility of the unit cell up to 3.5 GPa, while a pressure-induced structural phase transition is observed above PO–T ∼ 3.5–4 GPa at room temperature, where the body-centered orthorhombic crystal structure with the space group Immm changes into a body-centered tetragonal structure with the space group I4/mmm. The molar volume drops abruptly at PO–T, while the distance between the first-nearest neighbor of U atoms, dU–U, increases, implying a switch from the heavy electronic states to the weakly correlated electronic states. Surprisingly, a new superconducting phase at pressures higher than 7 GPa was detected at Tsc > 2 K with a relatively low upper-critical field, Hc2(0). The resistivity above 3.5 GPa, thus, in the high-pressure tetragonal phase, shows a large drop below 230 K, which may also be related to a considerable change from the heavy electronic states to the weakly correlated electronic states.

Investigation of the body-centred tetragonal structure of Fe–Co–V–N Bulk foils using the rolling and ammonia-gas-nitriding method

Improving the properties of permanent magnets is essential for the advancement of electric motors in reducing energy consumption and carbon emissions. This study investigated the effect of V and N addition to FeCo foils on the stability of tetragonally distorted FeCo-based bulk magnets. The incorporation of these two elements stabilised the body-centred tetragonal structure in thin-film and bulk systems. Fe–Co–V ingots were rolled and nitrided by ammonia gas at 650 °C for 5 h. A body-centred tetragonal lattice with an axial ratio of c/a ≈ 1.1 was observed by transmission electron microscopy, and the collected data suggested the induction of a large uniaxial magnetic anisotropy. This study is expected to improve our understanding of rare-earth-free magnets.