Phase Fraction Research Articles

Phase transition kinetics and sublayer optimization of HfO2/ZrO2 superlattice ferroelectric thin films

The sublayer thickness of superlattices, as a key factor affecting lattice integrity, interface defects, and strain, deserves in-depth studies about its impact on improving ferroelectric properties. This study described and analyzed the performance of HfO2/ZrO2 superlattices with various sublayer thicknesses. It can be concluded that the structure of the thicker layers will guide the trend of the phase composition of the entire device: when ZrO2 layers are thicker, the superlattices will exhibit antiferroelectricity due to the higher content of the tetragonal phase (t-phase); when HfO2 layers become thicker, the fraction of the monoclinic phase (m-phase) will increase, leading to a decrease in ferroelectricity and an increase in leakage current. In this way, the device with a 1:1 HfO2/ZrO2 thickness ratio was optimized to have the largest remanent polarization and the lowest leakage current. Maintaining the same thickness ratio of the HfO2/ZrO2 superlattices, it was found that HfO2/ZrO2 superlattices with thinner sublayers exhibited a larger remanent polarization (Pr) value due to increased interlayer distortion. On the contrary, the thicker sublayers reduced leakage current, which was beneficial for improving the device lifespan.

Effect of primary α phase fraction on deformation mechanism of Ti-1023 alloy at room temperature

The fraction and morphology of α phase have important effects on the mechanical properties and deformation mechanism of Ti-1023 alloy. Here, the tensile stress-strain curves and deformation mechanisms with the fraction of α phase are discussed in detail. As α phase fraction decreases from 67.5 % to 12.6 %, there is a negative correlation coefficient between the yield strength and α phase volume fraction of Ti-1023 alloy, and its fitting equation is obtained. When the fraction of α phase is decreased to 12.6 %, the elongation and ultimate tensile strength of the alloy are 31.09 % and 845.52 MPa, as well as a transition from single to double yielding phenomenon, which is caused by stress-induced martensitic transformation (SIMT). When the fraction of α phase is high, the deformation mechanism is dominated by dislocation slip and mechanical twinning of the α phase. When the fraction of α phase is low, the deformation mechanism is dominated by mechanical twinning of the β matrix and stress-induced martensitic transformation (SIMT). The relationship between α phase fraction and deformation mechanism and mechanical properties of Ti-1023 in α+β dual phase region is studied, which provides a template to guide the development of comprehensive mechanical properties of metastable β titanium alloy in α+β dual phase region.

Experimental study on CO2 absorption in aqueous solutions and water–oil emulsions of TEA and blended MEA/DEA–TEA

ABSTRACT The CO2 absorptions in aqueous solutions and water-in-oil (W/O) emulsions of TEA, MEA–TEA, and DEA–TEA were investigated. By applying an experimental setup, the effects of reactant concentration (0.25–1 M for TEA, 0.1–0.3 M for MEA/DEA), temperature (15–35°C), volume fraction of the dispersed phase (0.4–0.6), and pressure (100–400 kPa) on capacity and rate of CO2 absorption were measured and compared. The CO2 absorption capacity in a TEA solution with a low/medium concentration (0.25–0.5 M) is more than the theoretical value while these values are approached to each other in the high concentration (1 M). The CO2 absorption capacity of blended solutions (MEA/DEA–TEA) is higher than that of the TEA solution. By increasing the temperature, the CO2 absorption capacities of the TEA and blended solutions are decreased by increasing the temperature. For the emulsion solutions, increasing the volume fraction of the dispersed phase causes a decrement in the capacity of absorption. In the low concentration of MEA/DEA (0.1 M), the aqueous solution has a higher absorption capacity than that of the emulsion while this trend is reverse in the high concentration of MEA/DEA (0.2–0.3 M). The CO2 absorption rates of emulsions are higher than the rates of their corresponding aqueous solutions. For the TEA solutions, the rate of CO2 absorption is controlled by the reaction rate while the shuttle mechanism enhances the absorption rate for the blended solutions. The CO2 absorption capacity and rate for the TEA and blended solutions are increased by pressure while this increment is more significant for the emulsions.

The influence of mineral inclusion on the effective strength of rock-like geomaterials

The influences of microstructure on the macroscopic mechanical behavior of a composite with a porous matrix reinforced by mineral inclusions are investigated in the present work by both numerical and theoretical methods. The mineral inclusions are embedded at the mesoscopic scale and much bigger than the pores which are located at the microscopic scale. In order to consider the properties of the studied rock-like geomaterials, such as the dissymmetry between tension and compression, the solid phase at the microscopic scale is assumed to obey to a Drucker–Prager criterion. Based on the studied microstructure, the Fast Fourier Transform (FFT) based numerical method is firstly adopted to investigate the macroscopic plastic yield stress of the studied composite. Different microstructure having different volume fraction of inclusion, micro-porosity and frictional coefficient of the solid phase are considered. Based on these numerical results, the existing theoretical yield criterion is estimated. One finds that it should be improved for the case of a microstructure having a high inclusion content. Then, a new macroscopic yield criterion is constructed in the present work by using the modified secant method. This criterion ameliorates fundamentally the one proposed in Shen et al. (2013), specially for the case of a deviatoric loading. It is then estimated and validated by comparing with the FFT based numerical results which were carried out in this work with different volume fractions of heterogeneous phase.

Behavior of Retained Austenite and Carbide Phases in AISI 440C Martensitic Stainless Steel under Cavitation

In this work emphasis was given to determine the evolution of the retained austenite phase fraction via X-ray diffractometry technique in the as-hardened AISI 440C martensitic stainless steel surface subjected to cavitation for increasing test times. Scanning electron microscopy results confirmed the preferential carbide phase removal along the prior/parent austenite grain boundaries for the first cavitation test times on the polished sample surface during the incubation period. Results suggest that the strain-induced martensitic transformation of the retained austenite would be assisted by the elastic deformation and intermittent relaxation action of the harder martensitic matrix on the austenite crystals through the interfaces between both phases. In addition, an estimation of the stacking fault energy value on the order of 15 mJ m−2 for the retained austenite phase made it possible to infer that mechanical twinning and strain-induced martensite formation mechanisms could be effectively presented in the studied case. Finally, incubation period, maximum erosion rate, and erosion resistance on the order of 7.0 h, 0.30 mg h−1, and 4.8 h μm−1, respectively, were determined for the as-hardened AISI 440C MSS samples investigated here.

Use of isotopic (C, Cl) and molecular biology tools to assess biodegradation in a source area of chlorinated ethenes after biostimulation with Emulsified Vegetable Oil (EVO)

Enhanced In Situ Bioremediation (EISB) using Emulsified Vegetable Oil (EVO) as a long-term electron donor has gained prominence for the treatment of groundwater contaminated with chlorinated ethenes (CEs). This study explores the potential of isotopic and molecular biology tools (MBT) to investigate the CEs (PCE, TCE and cis-DCE) bioremediation using EVO in a contaminated site. A multiple approach using C and Cl-CSIA, quantification of Dehalococcoides (Dhc) and specific reductive dechlorination (RD) gene population, and hydrochemical data in microcosm experiments and field samples was applied. Despite the high partitioning of CEs into the EVO phase, the carbon isotopic values of the remaining CEs fraction in the aqueous phase did not exhibit significant changes caused by phase partitioning in laboratory experiments. Both microcosm experiments and field data revealed a rapid RD of PCE and TCE, resulting in the transient accumulation of cis-DCE, which was slowly degraded to vinyl chloride (VC). These results agreed with the presence of Dhc populations and a shift to stronger reducing conditions in the field: i) RD functional genes (tceA, vcrA and bvcA) exhibited a trend to higher values and ii) a substantial increase in Dhc populations (up to 30% of the total bacterial populations) was observed over time. The dual-element isotope slope ΛC-Cl for RD of cis-DCE obtained from field data (ΛC – Cl = 5 ± 3) was similar to the one determined from the microcosm experiments under controlled anoxic conditions (ΛC – Cl = 4.9 ± 0.8). However, ΛC-Cl values differ from those reported so far for laboratory studies with Dhc strains and mixed cultures containing Dhc, i.e., between 8.3 and 17.8. This observation underscores the potential variety of reductive dehalogenases involved during cis-DCE RD and the importance of determining site-specific Λ and ɛ values in order to improve the identification and quantification of transformation processes in the field.

The nonlinear analysis of Portevin-Le Chatelier (PLC) effect: An application to medium Mn steel

The instability of plastic flow in medium manganese steel was investigated through uniaxial tensile tests conducted at room temperature across various strain rates. The Portvin-Le Chatelier (PLC) effect was analyzed using statistical methods and a multifractal approach. The findings indicate that the zigzag stress–strain curves associated with instability plastic flow exhibit typical multifractal characteristics. Furthermore, the multifractal analysis quantifies the influence of strain rate and initial phase composition on the instability characteristics of the stress–strain curves. Specifically, it was observed that lower strain rates and austenite content correspond to a chaotic state, whereas higher strain rates and austenite content result in self-organizing critical dynamics. Finally, the underlying physical mechanisms driving these differing modes of behavior are discussed, with a focus on their relationship to strain rate and the initial austenitic phase fraction.

Realizing enhanced energy storage performance of Na0.47Bi0.47Ba0.06TiO3-based relaxors with weak coupling behavior by manipulating phase fraction

Lead-free dielectric capacitors have attracted considerable attention as the core energy storage element of pulsed power systems due to their advantages of fast charging capability, high power density and environmental friendliness. However, the low recoverable energy storage density (Wrec) and narrow operating temperature range have become the bottleneck technical problems limiting its practical application. In this work, a class of weakly coupled relaxor ferroelectrics with excellent Wrec (9.06 J/cm3) and energy storage efficiency (η ∼ 85.3 %) were designed and prepared by manipulating phase fraction. Moreover, the materials exhibit excellent temperature stability with regard to energy storage, with a change in Wrec and η of less than 8 % over a wide temperature range (25 °C − 200 °C). The introduction of Sm(Mg0.5Hf0.5)O3 (SMH) enhances the insulating properties while refining the grains, effectively increasing the breakdown field strength (Eb) of the material. The emergence of weakly coupled nano-microdomains has the effect of suppressing the nonlinear polarization response of the material, which in turn results in a high polarization difference (ΔP). The preceding work presents a universal strategy for the future design and preparation of BNT-based lead-free dielectric capacitors with high energy storage properties (ESP) and good temperature stability.

Microstructure and Mechanical Properties of As-Cast Al-10Ce-3Mg-xZn Alloys.

The microstructure and mechanical properties of as-cast Al-10Ce-3Mg-xZn (x = 0, 1, 3, 5 wt.%) alloys were systematically investigated, with a focus on the effect of Zn on the Al11Ce3 reinforcing phase in the alloy. The results showed that the Al-10Ce-3Mg alloy consists of α-Al, a Chinese-script Al11Ce3 eutectic phase, and a massive Al11Ce3 primary phase. With the addition of Zn content, most of the Zn atoms are enriched in the Al11Ce3 phase to form the acicular-like Al2CeZn2 phase within the Al11Ce3 phase. Increasing the Zn content can increase the volume fraction of the Al11Ce3 phase. Compared to the alloy without Zn addition, the microhardness and elastic modulus of the Al2CeZn2-reinforced Al11Ce3 phase in the alloy with 5 wt.% Zn increased by 18.9% and 9.0%, respectively. Moreover, the room-temperature mechanical properties of Al-10Ce-3Mg alloys were significantly improved due to the addition of Zn element. The alloy containing 5 wt.% Zn had the best tensile properties with an ultimate tensile strength of 210 MPa and a yield strength of 171MPa, which were 21% and 77% higher than those of the alloy without Zn, respectively. The alloy containing 5 wt.% Zn demonstrated a superior retention ratio of tensile strength at 200-300 °C, indicating that the alloy has excellent heat resistance. The improvement in the mechanical properties is primarily attributed to second-phase strengthening and solid solution strengthening.

Exploring Microstructure and Magnetic Domain Evolution in the As-cast Soft Magnetic Fe74B20Nb2Hf2Si2 Alloy: A Comprehensive Study Using STEM, Lorentz TEM, and LM-STEM DPC Microscopy

This study delves into subtle changes in the microstructure and domain arrangement of a Fe74B20Nb2Hf2Si2 soft magnetic amorphous alloy. Utilizing transmission electron microscopy in Lorentz mode, low-magnification STEM, and differential phase contrast analysis (DPC), the research explores both the as-cast state and annealed samples. The results confirmed the formation of α-Fe, Fe23B6, Fe2(Hf, Nb), and Fe2B crystalline phases with increasing annealing temperature. Consequently, these crystallization stages induce significant alterations in magnetic domain size and spatial distribution due to microstructural changes. As the crystallization temperature rises, the volume fraction of crystalline phases increases, leading to modifications in the arrangement and size of magnetic domains. The decrease in magnetic domain size, associated with the formation of pinning sites during heat treatment, leads to alterations in soft magnetic properties. This includes an increase in coercivity (Hc) up to 40 A/m in the sample annealed at the temperature range of the third crystallization stage compared to the as-cast sample (1.5 A/m). Furthermore, as the annealing temperature rises, there is a corresponding increase in saturation magnetization (Ms), which reached to 1.71 T in the sample annealed within the temperature range of the third crystallization stage. These findings hold substantial implications for the practical applications of the Fe-based soft bulk metallic glasses (BMGs) alloy across various industries.

Real-time screen space rendering method for particle-based multiphase fluid simulation

Existing fluid simulation techniques mainly process single-phase fluids, and they have difficulties in accurately simulating and visualizing multiphase fluid dynamics. This paper proposes a new method for the real-time rendering of multiphase fluid simulations, which uses smoothed particle hydrodynamics in screen space. Meanwhile, the method employs phase fraction textures to differentiate various materials in multiphase fluid simulations, thereby portraying mixing and separation effects more realistically. Besides, efficient texture computation allows it to be integrated seamlessly into real-time simulation rendering workflows. Extensive testing confirms the effectiveness of the proposed method in rendering multiphase fluid behaviors with high visual fidelity and demonstrates its capability to process frames within 0.01 s, even in cases with up to 300,000 particles. This study enhances the fluid dynamics simulation field and provides a more accurate and efficient method for visualizing complex multiphase fluids in simulations.

A comparative study of predicting high entropy alloy phase fractions with traditional machine learning and deep neural networks

Predicting phase stability in high entropy alloys (HEAs), such as phase fractions as functions of composition and temperature, is essential for understanding alloy properties and screening desirable materials. Traditional methods like CALPHAD are computationally intensive for exploring high-dimensional compositional spaces. To address such a challenge, this study explored and compared the effectiveness of random forests (RF) and deep neural networks (DNN) for accelerating materials discovery by building surrogate models of phase stability prediction. For interpolation scenarios (testing on the same order of system as trained), RF models generally produce smaller errors than DNN models. However, for extrapolation scenarios (training on lower-order systems and testing on higher order systems), DNNs generalize more effectively than traditional ML models. DNN demonstrate the potential to predict topologically relevant phase composition when data were missing, making it a powerful predictive tool in materials discovery frameworks. The study uses a CALPHAD dataset of 480 million data points generated from a custom database, available for further model development and benchmarking. Experiments show that DNN models are data-efficient, achieving similar performance with a fraction of the dataset. This work highlights the potential of DNNs in materials discovery, providing a powerful tool for predicting phase stability in HEAs, particularly within the Cr-Hf-Mo-Nb-Ta-Ti-V-W-Zr composition space.

Thermo-mechanical processing characteristics and strain-rate-sensitive degradation properties of Mg-Er-Ni alloys

Hot deformation behavior, the corresponding microstructure evolution, and degradation properties of a weak-textured Mg-Er-Ni alloy containing a high-volume fraction of Ni-LPSO phases, have been investigated. Hot deformation behavior has been carried out in the temperatures range of 370 ∼ 460 °C and strain rates range of 0.001 ∼ 1 s−1. Flow stress-strain curves of high strain rate cases show a continuous increase trend without a steady or a peak stage, while that of low strain rate cases show an obvious dynamic softening after peak stress. Based on flow stress-strain curves, materials constants calculated by an Arrhenius-type constitutive equation, show a high n and Q compared to those of high-volume fraction α-Mg matrix Mg alloys. Optimal processing windows, based on the dynamic material model, is determined as high temperature domains. As for microstructure evolution, a complete recrystallization and dispersive Ni-LPSO fragments for high temperature & low strain rates while a restricted recrystallization and a streamline distribution LPSO phase for high temperature & high strain rates are observed. Varying degrees of continuous dynamic recrystallization, particle induced nucleation mechanism, as well as coordinated deformation of LPSO through kinking and bending account for the strain-rate-dependence hot deformation mechanism. As a result, dispersive Ni-LPSO fragments at low strain rates provide more degradation channels for the α-Mg matrix and thus possess better a degradation rate than the streamlined LPSO at high strain rates.

First-Principles Kinetic Monte Carlo Modeling of Passivation in Ni-Based Alloys

Corrosion by metal oxidation is a major problem for many structural materials, including Ni-based alloys in high-temperature applications. Passivation can be achieved through various alloying strategies, but common theoretical approaches to understanding key factors such as the critical concentration of the minor element are limited in their predictive capability. In particular, existing models often do not explicitly capture competing metal cation migration mechanisms in the oxide. In this study, we examine passivation kinetics of Ni-Cr and Ni-Al alloys by modeling the evolution of initial NiO oxide films as Cr/Al are incorporated. Surrogate models for the energies of various oxide configurations and the migration barriers of metal cations are parameterized from density functional theory calculations. These inputs are used to drive kinetic Monte Carlo simulations over long time scales. By tracking the time-dependent oxidation behavior across alloy composition, we predict critical concentrations of Cr/Al to form continuous passivation layers. Compositional and structural analyses of the simulated oxides are used to quantify fractions of different phases and provide insight into the nature of passivation in each alloy system. The effect of increasing or decreasing the exchange rate of metal atoms near the alloy-oxide interface, which can be related to alloy processing, is also explored. We discuss the applicability of our method to other systems and its incorporation into an existing open-source software package.This work was performed under the auspices of the U.S. Department of Energy by Lawrence Livermore National Laboratory under Contract DE-AC52-07NA27344.

Role of oxygen vacancy enriched m-BiVO4/t-BiVO4 isotype heterojunction for enhanced photocatalytic degradation of rhodamine B dye and in ferroelastic to paraelastic phase transition

Mixed-phase isotype heterojunction oxide materials with superior photocatalytic activities have recently revealed a significant coupling between individual phases with controlled optical properties. Therefore, we focus on synthesizing a mixed-phase monoclinic-tetragonal (m-t) BiVO4 photocatalyst using hydrothermal method. The increased recombination rate of electron-hole (e−-h+) pairs limits the photocatalytic performance of monoclinic (m) BiVO4 photocatalysts. Therefore, effective spatial charge carrier separation can be improved by creating an isotype heterojunction between the phases m-BiVO4 and t-BiVO4. The precursor pH, mechanical grinding, and calcination temperature regulate the formation of m-t BiVO4. The phase fractions of the two phases in m-t BiVO4 sample are 85% monoclinic and 15% tetragonal. Herein, we demonstrate the optical properties and photocatalytic activity based on the crystal chemistry of m-BiVO4 and m-t BiVO4. Temperature-dependent Raman measurements suggest a second order ferroelastic monoclinic to paraelastic tetragonal phase transition above 530 K owing to optical phonon anharmonic coupling interactions. The small increase (5 °C) in Tc in m-t BiVO4 compared to m-BiVO4 is due to the coexistence of tetragonal and monoclinic phases. The optical band gap of m-t BiVO4 is larger than that of m-BiVO4. Additionally, the evaluation of BiVO4 photocatalytic activity over rhodamine-B (Rh-B) dye suggests that the m-t BiVO4 with 97.5% degradation efficiency is superior compared to m-BiVO4 with 89% degradation efficiency. This is because, the two phases (m and t) of BiVO4 form an isotype heterojunction interface, which results in a high charge separation efficiency, as demonstrated by photocurrent studies and electrochemical impedance spectroscopy. Moreover, oxygen vacancies tune the charge carrier dynamics through the modification of band edges. These findings regarding the isotype phase-junction mechanism provide possibilities for innovative ideas for highly efficient mixed-phase isotype heterojunction photocatalysts for wastewater remediation.

Structural characterization of an unprecedented mixture of H4Nb2O7 and TT-Nb2O5 phases obtained by hydrothermal synthesis

Several crystal structures of niobium-based materials are currently being studied. In this work, for the first-time a mixture of H4Nb2O7 and Nb2O5 materials was obtained from ammonium niobate oxalate using the urea hydrolysis reaction in a hydrothermal synthesis. The techniques used for characterization, such as X-ray diffraction (XRD), Rietveld refinement, Scanning Electron Microscopy (SEM), Scanning Transmission Electron Microscopy (STEM), and High-Resolution Transmission Electron Microscopy (HRTEM), confirmed a combination of pyrochlore-type H4Nb2O7 and pseudohexagonal TT-Nb2O5 phases, with distinct nanostructures and anisotropic growth in the TT- Nb2O5 phase, in addition to controlling phase fractions by synthesis time. These discoveries suggest potential applications in various environmental applications due to the material’s adsorptive capacity.

Comparative study of the experimentally observed and GAN-generated 3D microstructures in dual-phase steels

ABSTRACT In a deep-learning-based algorithm, generative adversarial networks can generate images similar to an input. Using this algorithm, an artificial three-dimensional (3D) microstructure can be reproduced from two-dimensional images. Although the generated 3D microstructure has a similar appearance, its reproducibility should be examined for practical applications. This study used an automated serial sectioning technique to compare the 3D microstructures of two dual-phase steels generated from three orthogonal surface images with their corresponding observed 3D microstructures. The mechanical behaviors were examined using the finite element analysis method for the representative volume element, in which finite element models of microstructures were directly constructed from the 3D voxel data using a voxel coarsening approach. The macroscopic material responses of the generated microstructures captured the anisotropy caused by the microscopic morphology. However, these responses did not quantitatively align with those of the observed microstructures owing to inaccuracies in reproducing the volume fraction of the ferrite/martensite phase. Additionally, the generation algorithm struggled to replicate the microscopic morphology, particularly in cases with a low volume fraction of the martensite phase where the martensite connectivity was not discernible from the input images. The results demonstrate the limitations of the generation algorithm and the necessity for 3D observations.

A prediction model for austenite grain size distribution of casting slab in thermal rebound process: Considering α-ferrite precipitation and re-austenization

The precipitation and re-austenitization behavior of α-ferrite during thermal rebound process of casting slab are crucial to the austenite grain size distribution. Accurately obtaining austenite grain size distribution plays an important guiding role for avoiding the formation of slab cracks and effectively improving the quality of steel. In this work, a quantitative model to calculate α-ferrite precipitation at different temperatures has been constructed by employing high-temperature expansion test and peak area method. On this basis, a prediction model for the austenite grain size distribution of casting slab in the thermal rebound process has been theoretically derived with consideration of the α-ferrite precipitation and re-austenitization. Then, the accuracy of the quantitative model for α-ferrite precipitation and the prediction model for austenite grain size distribution have been evaluated by high-temperature quenching experiments. The results show that the maximum error between the calculation values of the prediction model and the experimental values is only 3.67 %, which can reliably predict the austenite grain size distribution of slab under different phase fractions of precipitated α-ferrite and initial austenite grain sizes. When the phase fraction of precipitated α-ferrite reaches about 70 %, the average grain size after re-austenitization comes to nearly 50 % of the initial size, which achieves the best refining effect. The reduction in initial austenite grain size is beneficial to the refinement of austenite grain after thermal rebound. Reasonable control of thermal rebound temperature and multiple cycles of phase transformation are effective means of obtaining austenite microstructure with smaller average grain size and more uniform distribution.

Non-equilibrium solidification behavior and mechanical properties of undercooled Fe7(CoNi)77B16 muti-principal element alloy

Multi-principal element alloys (MPEAs) have attracted growing attention owing to the vast compositional field and the comprehensive properties. In this work, Fe7(CoNi)77B16 MPEA was undercooled by vacuum melting furnace with low (61 K, 95 K), medium (115 K, 148 K), and high undercoolings (200 K). The maximum growth velocity of the alloy was 0.21 m/s due to the sluggish kinetics effect. The regular eutectic transformed to anomalous eutectic and the primary dendrite refined from 9.1 μm to 3.5 μm with the increase of undercooling. Meanwhile, the phase selection behavior at high undercooling was observed between the stable (Fe, Co, Ni) phase and the metastable (Fe, Co, Ni)23B6 phase. The hardness of primary phase and compressive strength of the undercooled MPEAs were increased to 952.19 HV and 2061.72 MPa, which is much higher than the as-cast alloy. The enhancement of the mechanical properties was attributed to microstructure evolution. The decrease in plasticity resulted from the increasing volume fraction of brittle intermetallic phases. This study helps to theoretically understand the solidification mechanism of the Fe-Co-Ni-B MPEAs and provides a promising way to enhance the mechanical properties of the novel MPEAs.

Nanostructuring of AlSiCrMnFeNiCu High‐Entropy Alloy via Cryomilling: Exploring Structural, Magnetic, and Thermoelectric Properties

Efforts are made to understand the influence of milling intensity on structure, morphology, magnetic and thermoelectric properties of nonequiatomic nanostructured AlSiCrMnFeNiCu high‐entropy alloy (HEA) powders prepared by cryomilling. These powders are cryomilled with different ball‐to‐powder ratios (BPR) and present a dual‐phase structure containing a major B2‐type and a minor Cr5Si3‐type phase. An increase in BPR enhances the refinement of crystallite size, grain size, and particle size accompanied by a decrease in the phase fraction of the minor Cr5Si3‐type phase. Magnetic measurements revealed that at room temperature, sufficient increase in BPR leads to a transition from multi‐domain behavior to single‐domain behavior which leads to enhancement in soft magnetic properties. Thermal measurements show the presence of different magnetic phase transitions which vary with an increase in BPR. A change of charge carrier type from p to n‐type was observed as the grain size is reduced. The figure of merit decreases with the decrease in grain size from 2 × 10–5 for as‐cast powders and is lowest for the smallest grain‐sized sample due to a decrease in electrical conductivity. This study shows the possibility of exploring nonequiatomic low‐density HEAs whose functional properties can be tailored, offering flexibility in material design for specific applications.