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A Self-Sacrifice Template Method to Produce FeS Encapsulated into N, S Co-Doped Carbon for Improved Lithium Storage Performance 一种自我牺牲模板法制备包裹在N, S共掺杂碳中的FeS以提高锂存储性能
IF 3.9 2区 材料科学 Q2 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-06-18 DOI: 10.1007/s40195-025-01883-5
Xu Liu, Lan-Yun Yang, Li-Ting Zeng, Yun Peng, Chen-Xi Xu, Lei Li, Jia-Le Sun, Yang-Yang Chen, Liang Chen, Zhao-Hui Hou

The development of high-performance transition metal sulfide (TMS)/carbon composites to replace conventional graphite anode remains a critical challenge for advancing lithium-ion batteries (LIBs). In this study, a facile self-sacrifice template method is developed to prepare FeS encapsulated into N, S co-doped carbon (FeS/NSC) composite using melamine-cyanuric acid (MCA) supermolecule as a multifunctional template precursor. The function of MCA supermolecule for material synthesis is explored, revealing its special function as a dispersant, dopant and pore-forming agent. Furthermore, the effect of Fe source dosage on the morphology, structure and composition of the final products is explored. The resultant FeS/NSC-0.1 (where 0.1 represents the mass of added Fe source) exhibits the most optimal proportion, characterized by a good dispersion status of FeS within the NSC matrix, effective N, S co-doping and ample porosity. Benefiting from these merits, the FeS/NSC-0.1 anode demonstrates significantly improved cycling stability and rate capability when compared to the counterparts. Undoubtedly, this work offers a universal method to produce advanced transition metal sulfide/carbon composite electrodes for energy storage and conversion systems.

开发高性能的过渡金属硫化物(TMS)/碳复合材料来取代传统的石墨阳极仍然是锂离子电池(LIBs)发展的关键挑战。本研究以三聚氰胺-三聚氰尿酸(MCA)超分子作为多功能模板前驱体,开发了一种简便的自我牺牲模板方法,将FeS封装到N, S共掺杂碳(FeS/NSC)复合材料中。探讨了MCA超分子在材料合成中的作用,揭示了其作为分散剂、掺杂剂和成孔剂的特殊功能。进一步探讨了铁源用量对最终产物形貌、结构和组成的影响。得到的FeS/NSC-0.1(其中0.1表示添加的Fe源质量)表现出最优的比例,其特点是FeS在NSC基体内具有良好的分散状态,有效的N, S共掺杂和充足的孔隙率。得益于这些优点,与同类阳极相比,FeS/NSC-0.1阳极具有显着提高的循环稳定性和速率能力。毫无疑问,这项工作为生产用于储能和转换系统的先进过渡金属硫化物/碳复合电极提供了一种通用方法。
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引用次数: 0
Hot Deformation Behavior of CoNiV Medium-Entropy Alloy: Constitutive Model, Convolutional Neural Network, Hot Processing Map, and Microstructure Evolution CoNiV中熵合金的热变形行为:本构模型、卷积神经网络、热加工图和显微组织演化
IF 3.9 2区 材料科学 Q2 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-06-17 DOI: 10.1007/s40195-025-01885-3
Biao Zhang, Yuntian Du, Huishuang Jia, Yuanyi Zhou, Liguang Wang, Minghe Zhang, Yunli Feng, Weimin Gao, Ning Xu

This study systematically investigates the hot deformation behavior and microstructural evolution of CoNiV medium-entropy alloy (MEA) in the temperature range of 950–1100 °C and strain rates of 0.001–1 s−1. The Arrhenius model and machine learning model were developed to forecast flow stresses at various conditions. The predictive capability of both models was assessed using the coefficients of determination (R2), average absolute relative error (AARE), and root mean square error (RMSE). The findings show that the osprey optimization algorithm convolutional neural network (OOA-CNN) model outperforms the Arrhenius model, achieving a high R2 value of 0.99959 and lower AARE and RMSE values. The flow stress that the OOA-CNN model predicted was used to generate power dissipation maps and instability maps under different strains. Finally, combining the processing map and microstructure characterization, the ideal processing domain was identified as 1100 °C at strain rates of 0.01–0.1 s−1. This study provided key insights into optimizing the hot working process of CoNiV MEA.

本研究系统地研究了CoNiV中熵合金(MEA)在950 ~ 1100℃、应变速率为0.001 ~ 1 s−1范围内的热变形行为和显微组织演变。建立了Arrhenius模型和机器学习模型来预测不同条件下的流动应力。采用决定系数(R2)、平均绝对相对误差(AARE)和均方根误差(RMSE)评估两种模型的预测能力。结果表明,鱼鹰优化算法卷积神经网络(OOA-CNN)模型优于Arrhenius模型,R2值较高,达到0.99959,AARE和RMSE值较低。利用OOA-CNN模型预测的流变应力,生成不同应变下的功率耗散图和失稳图。最后,结合加工图和微观组织表征,确定了理想的加工区域为1100℃,应变速率为0.01 ~ 0.1 s−1。该研究为优化CoNiV MEA的热加工工艺提供了重要的见解。
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引用次数: 0
Corrosion Behavior of 304LN Stainless Steel in High-Temperature Supercritical Carbon Dioxide: Oxidation and Carburization 304LN不锈钢在高温超临界二氧化碳中的腐蚀行为:氧化和渗碳
IF 3.9 2区 材料科学 Q2 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-06-16 DOI: 10.1007/s40195-025-01889-z
Nanfu Li, Bin Wu, Jiazhen Wang, Ming Shu, Yusheng Zhang, Yifeng Li, Jianqiu Wang, En-Hou Han, Hongliang Ming

The corrosion behavior of 304LN austenitic stainless steel in supercritical CO2 at 650 °C was investigated. The results show that 304LN follows Wagner’s law kinetics, forming a protective oxide film consisting of SiO2, (Cr, Mn)3O4, and Cr2O3 from the inner to outer layers. A shallow carburization depth of approximately 130 nm indicates excellent resistance to carburization. The roles of key elements in 18/8 austenitic stainless steel represented by 304LN, such as Cr, Ni, and Si, were analyzed, highlighting their contributions to anti-carburization performance and corrosion resistance under harsh conditions.

研究了304LN奥氏体不锈钢在650℃超临界CO2中的腐蚀行为。结果表明:304LN遵循Wagner动力学定律,由内到外形成由SiO2、(Cr, Mn)3O4和Cr2O3组成的氧化保护膜;约130 nm的浅渗碳深度显示出优异的抗渗碳能力。分析了以304LN为代表的18/8奥氏体不锈钢中Cr、Ni、Si等关键元素的作用,强调了它们对抗渗碳性能和恶劣条件下耐腐蚀性能的贡献。
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引用次数: 0
A Novel Nano-Structured Die Steel with High Strength and High Thermal Stability 一种新型高强度高热稳定性纳米结构模具钢
IF 3.9 2区 材料科学 Q2 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-06-12 DOI: 10.1007/s40195-025-01881-7
Xinhao Li, Jieli Ma, Yiren Wang, Yong Jiang

A novel oxide-dispersion-strengthened (ODS) die steel was fabricated by mechanical alloying and hot consolidation. Annealing and quench-tempering treatments both obtained an ultra-fine grain structure (mean size: 310–330 nm) with an ultra-high density of ultra-fine Y-Al-O nano-oxides (number density: ~ (1–1.5) × 1023 m−3, mean size: 5.1–7.2 nm). Prolonged thermal exposure further induced the new, highly dense precipitation of ultra-fine Y-Zr-O nano-oxides. Both nano-oxides tended to be wrapped up with a B2-NiAl nano-shells. Although the quench-tempered sample showed much higher room-temperature strength (yield strength = 1393 ± 40 MPa and ultimate tensile strength = 1774 ± 11 MPa) and slightly lower elongation (elongation = 13.6% ± 0.6%) than the annealed sample (YS = 988 ± 7 MPa, UTS = 1490 ± 12 MPa, and EL = 15.2% ± 1.1%), both samples exhibited better strength-ductility synergy at room temperature and much higher thermal stabilities at high temperatures (600–700 °C) than all those conventional hot-work die steels, which makes the new ODS steel highly promising for advanced hot-work mold and die applications at high temperatures above 600 °C.

采用机械合金化和热固结法制备了一种新型氧化分散强化模具钢。退火和调质处理均获得了超细晶粒结构(平均尺寸310 ~ 330 nm)和超高密度的超细Y-Al-O纳米氧化物(数密度~ (1 ~ 1.5)× 1023 m−3,平均尺寸5.1 ~ 7.2 nm)。长时间的热暴露进一步诱导了超细Y-Zr-O纳米氧化物的高密度析出。两种纳米氧化物都倾向于包裹在B2-NiAl纳米壳层中。经调质后的试样室温强度(屈服强度= 1393±40 MPa,极限抗拉强度= 1774±11 MPa)明显高于退火后的试样(YS = 988±7 MPa, UTS = 1490±12 MPa, EL = 15.2%±1.1%),伸长率(13.6%±0.6%)略低于退火后的试样;两种样品在室温下表现出更好的强度-塑性协同作用,在高温(600 - 700°C)下比所有传统热工模具钢具有更高的热稳定性,这使得新的ODS钢在600°C以上高温下的高级热工模具和模具应用中非常有前景。
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引用次数: 0
Anisotropic Mechanical Behavior in an Extruded AZ31 Magnesium Alloy: Experimental and Crystal Plasticity Modeling 挤压AZ31镁合金的各向异性力学行为:实验和晶体塑性建模
IF 3.9 2区 材料科学 Q2 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-06-12 DOI: 10.1007/s40195-025-01882-6
Shudong Yang, Xiaoqian Guo, Chao Ma, Lu Shen, Lingyu Zhao, Wei Zhu

The mechanical anisotropy on extruded AZ31 magnesium alloy bar has been investigated by combining experimental measurement and crystal plasticity modeling. Monotonic tension and compression are conducted in four loading directions with the oblique angle φ of 0°, 30°, 60° and 90° from extrusion radial direction to extrusion direction, and are also simulated by visco-plastic self-consistent model with considering twinning and detwinning scheme at the first time. The simulation results are well in agreement with the corresponding experimental data. Combined with the Schmid factor (SF), the anisotropic mechanical behaviors including yield strength, ultimate strength and strain hardening rate are interpreted with the predicted relative activities of deformation modes, texture evolution and twin volume fraction. With the loading angle varying from 0° to 90°, it is found that prismatic slip becomes the primary deformation mode with the decreasing relative activities of basal slip and extension twinning in tension. While the deformation mechanism is more complex in compression: Extension twinning gets great activation at the beginning of the deformation, especially under compression along 90°; basal slip and pyramidal < c + a > slip dominate the late deformation of compression along 0° and 30°, while basal slip and prismatic slip are dominated modes in compression along 60° and 90°. Additionally, different ({{{10}stackrel{{-}}{1}{{2}}}}) twinning behaviors with two or three and one or two pairs of twin variants being activated in tension along 30° and compression along 90°, respectively, have a close correlation with the texture evolution to coordinate plastic deformation. The activation of ({{{10}stackrel{{-}}{1}{{2}}}}) twinning, which varies with the loading angle φ, results in the increased trend of strain hardening rate. Following the exhausting of twinning, non-basal slips with the highest SF become the primary deformation mode subsequently, contributing to the decreasing trend in hardening behavior and the anisotropy of ultimate strength.

采用实验测量和晶体塑性建模相结合的方法研究了挤压AZ31镁合金棒材的力学各向异性。从挤压径向到挤压方向在4个加载方向上分别以0°、30°、60°和90°的斜角φ进行单调拉伸和压缩,并采用粘塑性自一致模型进行模拟,首次考虑了孪生和脱孪生方案。仿真结果与相应的实验数据吻合较好。结合施密德因子(SF),用预测的变形模式、织构演化和孪晶体积分数的相对活度来解释屈服强度、极限强度和应变硬化率等各向异性力学行为。在加载角度从0°到90°范围内,随着基底滑移和拉伸孪晶的相对活动减弱,柱状滑移成为主要的变形模式。而压缩变形机制更为复杂:拉伸孪晶在变形开始时得到了极大的激活,特别是在90°方向压缩时;0°和30°压缩后期变形以基底滑移和锥体滑移为主,60°和90°压缩后期变形以基底滑移和棱柱滑移为主。此外,在沿30°拉伸和沿90°压缩条件下分别激活2对或3对和1对或2对孪晶的({{{10}stackrel{{-}}{1}{{2}}}})孪晶行为与织构演化密切相关,以协调塑性变形。随着加载角度φ的变化,({{{10}stackrel{{-}}{1}{{2}}}})孪晶的活化率呈增加趋势;孪晶耗尽后,SF最高的非基底滑移成为主要变形模式,导致硬化行为和极限强度的各向异性呈下降趋势。
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引用次数: 0
Cobalt–Nickel Cyano Coordination Polymer-Derived Square CoSe2@NiSe2 Nanosheets for Advanced Na+/K+ Batteries 用于先进Na+/K+电池的钴镍氰基配位聚合物衍生方形CoSe2@NiSe2纳米片
IF 3.9 2区 材料科学 Q2 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-06-12 DOI: 10.1007/s40195-025-01870-w
Peng Yang, Jian Zhou, Yufei Zhang, Haosen Fan

Sodium-ion batteries are receiving more and more attention due to their low cost and abundant sodium storage capacity, and are considered to be a promising alternative to lithium-ion batteries. A large number of studies have shown that constructing heterostructures are considered an effective strategy to solve the hysteresis problem of electronic and ion dynamics in sodium-ion battery anode materials. Herein, a nickel–cobalt bimetallic coordination polymer (NiCoCP) was synthesized using a coprecipitation method, and a CoSe2@NiSe2 cross-stacked structure was obtained through high-temperature carbonization and selenization processes. CoSe2@NiSe2 has a unique heterostructure and carbon film, which synergistically increases a large number of adsorption sites and alleviates the diffusion energy barrier, thereby improving the rapid diffusion kinetics of Na+ ions. It has superior rate performance and long-lasting cycle life. For sodium-ion batteries (SIBs), the specific capacity of CoSe2@NiSe2 is around 460 mA h g−1 after 400 cycles at 1.0 A g−1. For potassium-ion batteries (PIBs), CoSe2@NiSe2 also exhibits excellent cycling stability, maintaining a specific capacity of 160 mA h g−1 after 700 cycles at 1.0 A g−1. This study provides a new way to prepare metal selenide heterostructure as the promising anode material for SIBs.

钠离子电池因其低廉的成本和丰富的储钠容量而受到越来越多的关注,被认为是锂离子电池的一个有前途的替代品。大量研究表明,构建异质结构被认为是解决钠离子电池负极材料中电子和离子动力学滞后问题的有效策略。本文采用共沉淀法合成了镍钴双金属配位聚合物(NiCoCP),并通过高温碳化和硒化工艺得到了CoSe2@NiSe2交叉堆叠结构。CoSe2@NiSe2具有独特的异质结构和碳膜,协同增加了大量的吸附位点,缓解了扩散能垒,从而改善了Na+离子的快速扩散动力学。它具有优越的速率性能和持久的循环寿命。对于钠离子电池(sib),在1.0 A g−1下循环400次后,CoSe2@NiSe2的比容量约为460 mA h g−1。对于钾离子电池(PIBs), CoSe2@NiSe2也表现出优异的循环稳定性,在1.0 a g - 1下循环700次后保持160 mA h g - 1的比容量。该研究为金属硒化物异质结构作为sib极材料的制备提供了一条新的途径。
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引用次数: 0
Modelling Microsegregation of Binary Alloy During Solidification 二元合金凝固过程的微观偏析模拟
IF 3.9 2区 材料科学 Q2 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-06-04 DOI: 10.1007/s40195-025-01884-4
Tongzhao Gong, Shuting Cao, Weiye Hao, Weiqi Fan, Yun Chen, Xing-Qiu Chen, Dianzhong Li

This work studies the impact of the carbon diffusion on the growth kinetics of austenite and the solute segregation, by utilizing the phase-field (PF) method to simulate the solidification of a Fe–C binary alloy. It is revealed that increasing the ratio of the carbon diffusion coefficient in solid to that in liquid is advantageous in reducing the solute segregation, and a novel microsegregation model is developed based on the quantitative analysis of the results from PF simulations. The simplified one-dimensional diffusion simulation is employed to analyse the quantitative relationship between the parameters of the proposed microsegregation model and the properties of materials. The universality and reliability of the new microsegregation model are then validated by comparing with the experimental data of various alloy systems. These findings contribute to our comprehension of the fundamental theory of solidification and also provide a potential and promising approach to controlling the solidification microstructure.

本文利用相场法模拟了Fe-C二元合金凝固过程,研究了碳扩散对奥氏体生长动力学和溶质偏析的影响。结果表明,增大碳在固液中的扩散系数有利于减少溶质偏析,并在定量分析微偏析模拟结果的基础上建立了一种新的微偏析模型。采用简化的一维扩散模拟方法分析了微偏析模型参数与材料性能之间的定量关系。通过与不同合金体系的实验数据对比,验证了新模型的通用性和可靠性。这些发现有助于我们理解凝固的基本理论,也为控制凝固组织提供了一种潜在的和有前途的方法。
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引用次数: 0
Improving Ductility of a 3Mn Medium-Mn Steel by Manipulating the Austenite Reversion Path 通过控制奥氏体还原路径提高3Mn中mn钢的延展性
IF 3.9 2区 材料科学 Q2 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-06-04 DOI: 10.1007/s40195-025-01886-2
Qinyuan Zheng, Yi Lu, Chengwu Zheng, Peng Liu, Tian Liang, Yikun Luan, Dianzhong Li

In the present study, a simple but effective two-step annealing processing strategy via manipulating the austenite reversion path is proposed to obtain a large fraction of retained austenite in low-Mn medium-Mn steels. Initially, the Fe–3Mn–0.2C–1.5Si (wt%) steel is intercritically annealed to form Mn-enriched lamellar martensite precursors. Subsequently, the austenite reversion transformation is manipulated to occur within the martensite lamellae during the second annealing process, resulting in an ultra-fine duplex microstructure of laminated austenite and ferrite. This process can not only allow a large fraction of austenite to be retained in low-Mn medium-Mn steels, but also increase the elongation by up to 41% without sacrificing the strength level compared to the conventional annealing.

在本研究中,提出了一种简单而有效的通过控制奥氏体还原路径的两步退火处理策略,以在低锰中锰钢中获得大量残余奥氏体。首先,对Fe-3Mn-0.2C-1.5Si (wt%)钢进行临界退火,形成富mn片层马氏体前体。随后,在第二次退火过程中,控制奥氏体逆转转变发生在马氏体片层内,形成奥氏体和铁素体层状的超精细双相组织。该工艺不仅可以在低锰中锰钢中保留大量奥氏体,而且与传统退火相比,在不牺牲强度水平的情况下,伸长率可提高41%。
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引用次数: 0
Breaking Strength-Ductility Trade-off Relation in Ti-38644 Alloy with Heterogeneous Bi-Grain Bi-Lamella Structure 非均相双晶双片层Ti-38644合金断裂强度与塑性的权衡关系
IF 3.9 2区 材料科学 Q2 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-05-30 DOI: 10.1007/s40195-025-01874-6
Zihao Qiu, Chenwei Shao, Shuaijie Han, Yang Lu, Zhiqin Wang, Hanzhong Liu, Zhenjun Zhang, Zhefeng Zhang

Metastable β titanium alloy is an ideal material for lightweight and high strength due to its excellent comprehensive mechanical properties. However, overcoming the trade-off relation between strength and ductility remains a significant challenge. In this study, the mechanical properties of Ti-38644 alloy were optimized by introducing a heterogeneous bi-grain bi-lamella (BG-BL) structure through a well-designed combination of rolling, drawing and heat treatment. The results demonstrate that the present BG-BL Ti-38644 alloy shows a tensile strength of ~ 1500 MPa and a total elongation of 18%. In particular, the high strength-elongation combination of the BG-BL Ti-38644 alloy breakthroughs the trade-off relation in all the titanium alloys available. The recrystallized grains with low dislocation enhance the ductility of the Ti-38644 alloy, while the highly distorted elongated grains mainly contribute to the high strength. The present study provides a new principle for designing Ti alloys with superior strength and ductility.

亚稳态β钛合金具有优异的综合力学性能,是实现轻量化、高强度的理想材料。然而,克服强度和延性之间的权衡关系仍然是一个重大挑战。在本研究中,通过精心设计的轧制、拉伸和热处理相结合,引入非均匀双晶双片层(BG-BL)组织,优化了Ti-38644合金的力学性能。结果表明:制备的BG-BL Ti-38644合金抗拉强度为~ 1500mpa,总伸长率为18%。特别是BG-BL Ti-38644合金的高强度延伸组合,突破了所有钛合金中的权衡关系。低位错的再结晶晶粒增强了Ti-38644合金的塑性,而高度变形的拉长晶粒则是提高合金强度的主要因素。本研究为设计高强度、高延展性钛合金提供了新的思路。
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引用次数: 0
Thermal Stability and Mechanical Properties of Nanotwinned Ni–W Alloyed Films 纳米双晶Ni-W合金薄膜的热稳定性和力学性能
IF 3.9 2区 材料科学 Q2 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-05-26 DOI: 10.1007/s40195-025-01880-8
Shuyi Ren, Jiao Li, Kai Wu, Xiaoge Li, Yaqiang Wang, Jinyu Zhang, Gang Liu, Jun Sun

Nanocrystalline alloys often exhibit unusual thermal stability as a consequence of kinetic and thermodynamic barriers to grain growth. However, the physical mechanisms governing alloy stability need to be identified. In this work, we found that grain boundary (GB) relaxation renders Ni–W alloyed films relatively stable at low annealing temperature, while twinning-mediated grain growth occurs via dislocation-GB/twin boundary (TB) interactions as the annealing temperature increases. At a relatively low temperature, TB strengthening plays a dominant role in plastic deformation, whereas precipitation strengthening gradually controls the deformation mechanism with the increase of annealing temperature. Our findings provide evidence for improving mechanical property through alloying and microstructure design, and have a crucial guiding significance in material selection and miniaturized applications such as Micro Electro Mechanical Systems.

由于晶粒生长的动力学和热力学障碍,纳米晶合金通常表现出不同寻常的热稳定性。然而,控制合金稳定性的物理机制需要确定。在这项工作中,我们发现晶界(GB)弛豫使Ni-W合金薄膜在低退火温度下相对稳定,而随着退火温度的升高,孪晶介导的晶粒生长通过位错-GB/孪晶界(TB)相互作用发生。在较低温度下,TB强化在塑性变形中起主导作用,而随着退火温度的升高,析出强化逐渐控制变形机制。研究结果为通过合金化和微观结构设计来改善材料的力学性能提供了依据,对材料选择和微型化应用(如微电子机械系统)具有重要的指导意义。
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引用次数: 0
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