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Enhanced inhibition of chalcopyrite in molybdenite flotation by combined oxidation of microwave and H2O2 微波与H2O2复合氧化对辉钼矿浮选中黄铜矿的抑制作用增强
IF 4.7 1区 材料科学 Q1 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-11-01 DOI: 10.1016/S1003-6326(25)66917-2
Ji-wei XUE, Qi-hong LIU, Tong LIU, He WAN, Sen WANG, Xian-zhong BU
The effects of combined microwave and hydrogen peroxide (H2O2) oxidation on the flotation separation of molybdenite and chalcopyrite, as well as the underlying mechanism were investigated via microflotation, zeta potential, contact angle, X-ray photoelectron spectroscopy (XPS), scanning electron microscopy (SEM) and atomic force microscopy (AFM) analyses. The microflotation experiments showed that the effective inhibition of chalcopyrite can be obtained through combined oxidation pretreatments with low microwave power and H2O2 consumption. The zeta potential, contact angle and XPS analyses indicated that the surface hydrophobicity of molybdenite changed minimally after different treatments, whereas significant amounts of hydrophilic oxidation species were formed on the surface of chalcopyrite, thus decreasing its surface hydrophobicity and floatability. Moreover, the SEM and AFM analyses indicated that more uniform oxidative products were formed on the chalcopyrite surface, further significantly increasing the surface roughness.
通过微浮选、zeta电位、接触角、x射线光电子能谱(XPS)、扫描电镜(SEM)和原子力显微镜(AFM)分析,研究了微波与过氧化氢(H2O2)联合氧化对辉钼矿和黄铜矿浮选分离的影响及其机理。微浮选实验表明,采用低微波功率、低H2O2耗量的复合氧化预处理,可以获得对黄铜矿的有效抑制。zeta电位、接触角和XPS分析表明,不同处理后辉钼矿的表面疏水性变化不大,而黄铜矿表面形成了大量的亲水氧化物质,降低了其表面疏水性和可浮性。此外,SEM和AFM分析表明,黄铜矿表面形成了更均匀的氧化产物,进一步显著提高了表面粗糙度。
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引用次数: 0
Microstructural evolution, mechanical properties and corrosion resistance of Ti-12Ni alloy fabricated by laser powder bed fusion 激光粉末床熔合Ti-12Ni合金的组织演变、力学性能及耐蚀性
IF 4.7 1区 材料科学 Q1 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-11-01 DOI: 10.1016/S1003-6326(25)66909-3
Kai HUANG , Yao-jia REN , Qing-ge WANG , Yi LIU , Quan FU , Ning LI , Ian BAKER , Min SONG , Hong WU
The microstructural evolution, mechanical properties, and corrosion behavior of Ti-12Ni (wt.%) specimens produced by laser powder bed fusion (LPBF) using various volume energy density (VED) processing parameter values were investigated. The results showed that the alloy prepared at a low VED of 67 J/mm3 consisted of near-β grains. At a VED of 133 J/mm3 the alloy exhibited coarse primary Ti2Ni and fine eutectoid structure. This eutectoid structure consisted of α laths and two types of nanoscale Ti2Ni, one in the form of short rods and the other with a spherical morphology. Further increase of the VED to 267 J/mm3 led to coarsening of the eutectoid structure. The dispersed Ti2Ni nanoparticles exhibited a significant strengthening effect. The alloy produced at a VED of 133 J/mm3 showed the greatest strength with a nanohardness of (7.8±0.1) GPa and a compressive strength of (1777±27) MPa. However, the presence of Ni segregation and holes produced by the LPBF processing adversely affected the corrosion resistance of the alloy.
研究了不同体积能量密度(VED)工艺参数下激光粉末床熔化(LPBF) Ti-12Ni (wt.%)试样的组织演变、力学性能和腐蚀行为。结果表明,在67 J/mm3的低电压下制备的合金由近β晶粒组成。在133j /mm3的衍射场下,合金表现出粗大的初生Ti2Ni和细小的共晶组织。这种共晶结构由α条和两种纳米Ti2Ni组成,一种是短棒状的,另一种是球形的。进一步增加到267 J/mm3,导致共析结构的粗化。分散的Ti2Ni纳米颗粒表现出明显的强化效果。在133j /mm3下制备的合金强度最高,其纳米硬度为(7.8±0.1)GPa,抗压强度为(1777±27)MPa。然而,镍偏析的存在和LPBF工艺产生的空穴对合金的耐腐蚀性产生不利影响。
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引用次数: 0
Machine learning on glass-forming ability of metallic glasses guided by domain knowledge 基于领域知识的金属玻璃成形能力的机器学习
IF 4.7 1区 材料科学 Q1 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-11-01 DOI: 10.1016/S1003-6326(25)66915-9
Hong BO , Xu-dong CHEN , Li-bin LIU , Xiao-gang FANG , Jian-liang HU , Li-min WANG
To improve the accuracy of machine learning in predicting the glass-forming ability, the atomic size difference, mixing enthalpy and estimated viscosity at liquidus temperature were selected as features from the perspectives of structure, thermodynamics and kinetics. Various algorithms including random forest (RF), extreme gradient boosting (XGBoost), and multilayer perceptron (MLP), were employed to predict the maximum size of the metallic glasses. Results show that the XGBoost models using the original and augmented datasets both exhibit superior performance, with the latter achieving the highest determination coefficient of 0.9148 among all the models. For predicting the maximum sizes of unseen Zr-Cu-Ni-Al-(Y) alloys, the XGBoost model trained on the augmented dataset demonstrates the best agreement with the measured data, indicating excellent generalization ability. By model interpretation, it is found that the kinetic factor correlates more with glass-forming ability compared with the thermodynamic and structural factors.
为了提高机器学习预测玻璃形成能力的准确性,从结构、热力学和动力学的角度选择原子尺寸差、混合焓和液相温度下的估计粘度作为特征。采用随机森林(RF)、极端梯度增强(XGBoost)和多层感知器(MLP)等算法预测金属玻璃的最大尺寸。结果表明,使用原始数据集和增强数据集的XGBoost模型均表现出较好的性能,其中增强数据集的决定系数最高,为0.9148。对于未知Zr-Cu-Ni-Al-(Y)合金的最大尺寸预测,在增强数据集上训练的XGBoost模型与实测数据的一致性最好,表明了良好的泛化能力。通过模型解释,发现动力学因素比热力学因素和结构因素对玻璃形成能力的影响更大。
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引用次数: 0
Impact of γ- and β-radiation on metal-based tunneling junction devices and their restorability γ和β辐射对金属基隧道结器件的影响及其可恢复性
IF 4.7 1区 材料科学 Q1 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-11-01 DOI: 10.1016/S1003-6326(25)66916-0
Zhong-zheng TIAN, Da-cheng YU, Zhong-yang REN, Jiao-jiao TIAN, Li-ming REN, Yun-yi FU
Nanoscale metal-based tunneling junction (MTJ) devices were fabricated using the electromigration method, and their electrical properties were studied after exposure to γ- and β-radiation. Irradiation caused the set threshold voltage (Vset) of the MTJ devices to increase, leading to a transition from a low-resistance state (LRS) to a high-resistance state (HRS). This shift in Vset was due to atom displacement from high-energy electrons excited by γ- and β-radiation. Unlike semiconductor devices, MTJ devices showed resilience to permanent damage and could be restored in-situ through multiple I-V (I is the drain current; V is the drain voltage) sweeps with appropriate configurations. This ability to recover suggests that MTJ devices have promising potential under irradiation. The reparability of irradiated MTJ devices is closely related to nothing-on-insulator (NOI) their structure, providing insights for other NOI and metal-based micro-nanoscale devices.
采用电迁移法制备了纳米金属基隧道结(MTJ)器件,研究了其在γ和β辐射下的电学性能。辐照使MTJ器件的设定阈值电压(Vset)升高,导致MTJ器件从低阻状态(LRS)过渡到高阻状态(HRS)。Vset的这种变化是由于γ-和β-辐射激发的高能电子引起的原子位移。与半导体器件不同,MTJ器件具有对永久性损坏的弹性,并且可以通过适当配置的多次I-V (I为漏极电流,V为漏极电压)扫描在原位恢复。这种恢复能力表明MTJ装置在辐照下具有很好的潜力。辐照MTJ器件的可修复性与其结构NOI密切相关,为其他NOI和金属基微纳器件提供了参考。
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引用次数: 0
Behavior of high-arsenic copper feed mixture in suspension smelting processes 高砷铜料混合物在悬浮熔炼过程中的行为
IF 4.7 1区 材料科学 Q1 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-11-01 DOI: 10.1016/S1003-6326(25)66919-6
Yu-jie CHEN , Yan-jie LIANG , Hui LIU , Pekka TASKINEN , Ari JOKILAAKSO , Zhun-qin DONG , Zhong-bing WANG , Tao CHEN
The suspension stage of copper flash smelting was examined by roasting a high arsenic copper smelting feed mixture at 500-900 °C for 0-20 s in nitrogen and air atmospheres. The enrichment of copper, lead, zinc, arsenic, and sulfur in the quenched calcine was determined via chemical analyses. Pyrite and chalcopyrite were the main minerals in the feed mixture, and about 55 wt.% of arsenic was in tennantite. The stability of the feed and the formation of S2 and SO2 during roasting were surveyed by thermal analysis combined with mass spectrometry. Selected pure impurity sulfides were studied for reference purposes. Results indicated that arsenic was released more easily in inert atmosphere compared to air, in which oxidation products of sulfides captured the released gaseous arsenic. Kinetics analyses showed that the third-order chemical reaction and three-dimensional diffusion models were found as the most suitable mechanism functions of arsenic volatilization in inert and air atmospheres, respectively.
采用高砷铜熔炼料混合物,在氮气和空气气氛中,500 ~ 900℃焙烧0 ~ 20 s,考察了铜闪速熔炼的悬浮阶段。通过化学分析确定了淬火焙烧中铜、铅、锌、砷和硫的富集程度。黄铁矿和黄铜矿是饲料混合物中的主要矿物,约55 wt.%的砷存在于钛矿中。采用热分析与质谱结合的方法考察了焙烧过程中进料的稳定性以及S2和SO2的生成情况。对选定的纯杂质硫化物进行了研究,以供参考。结果表明,砷在惰性气氛中比在空气中更容易释放,在惰性气氛中,硫化物的氧化产物捕获了释放的气态砷。动力学分析表明,三阶化学反应和三维扩散模型分别是砷在惰性气氛和空气气氛中挥发的最合适的机理函数。
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引用次数: 0
Collaborative optimization method for sintering schedule of ternary cathode materials under microscopic coupling constraints 微观耦合约束下三元正极材料烧结工艺协同优化方法
IF 4.7 1区 材料科学 Q1 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-11-01 DOI: 10.1016/S1003-6326(25)66920-2
Jia-yao CHEN , Ning CHEN , Hong-zhen LIU , Zheng-wei XU , Zhi-xing WANG , Wei-hua GUI , Wen-jie PENG
A collaborative optimization method for the sintering schedule of ternary cathode materials was proposed under microscopic coupling constraints. An oxygen vacancy concentration prediction model based on microscopic thermodynamics and a growth kinetics model based on neural networks were established. Then, optimization formulations were constructed in three stages to obtain an optimal sintering schedule that minimized energy consumption for different requirements. Simulations demonstrate that the models accurately predict the oxygen vacancy concentrations and grain size, with root mean square errors of approximately 5% and 3%, respectively. Furthermore, the optimized sintering schedule not only meets the required quality standards but also reduces sintering time by 12.31% and keeping temperature by 11.96%. This research provides new insights and methods for the preparation of ternary cathode materials.
提出了微观耦合约束下三元正极材料烧结工艺的协同优化方法。建立了基于微观热力学的氧空位浓度预测模型和基于神经网络的生长动力学模型。然后,根据不同的烧结要求,分三个阶段构建优化配方,得到能耗最小的最佳烧结工艺。模拟结果表明,该模型能准确预测氧空位浓度和晶粒尺寸,均方根误差分别约为5%和3%。优化后的烧结工艺在满足质量要求的前提下,烧结时间和保温温度分别降低了12.31%和11.96%。本研究为三元正极材料的制备提供了新的思路和方法。
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引用次数: 0
Composition design of high-strength and heat-resistant Al-Si-Fe alloy for powder bed fusion using laser beam 激光粉末床熔合用高强度耐热Al-Si-Fe合金成分设计
IF 4.7 1区 材料科学 Q1 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-11-01 DOI: 10.1016/S1003-6326(25)66899-3
Wen-zhe GAO , Li ZHANG , Kai-yang LI , Xiao-hui YANG , Jin-fang ZHANG , Jian-hong WANG , Hong XU , Pei-kang BAI , Yuan-kui CAO , Bin LIU , Xiao-feng LI
A combination of casting and laser remelting was employed to develop a high-strength and heat-resistant Al-Si-Fe alloy suitable for powder bed fusion using a laser beam (PBF-LB). By clarifying the effects of the incorporated elements and their contents on the microstructure and mechanical performance of Al-Si-Fe alloys, the composition was optimized as Al-11Si-2.5Fe-2Mn-1.2Ni-0.4Cr (in wt.%). The optimized alloy was subsequently validated using PBF-LB, which exhibited favorable machinability, achieving a density of 99.8%. The room-temperature tensile strength of the PBF-LB manufactured Al-Si-Fe alloy reached (512.76±3.26) MPa, with a yield strength of (337.79±2.36) MPa and an elongation of (2.98±0.07)%. The enhanced room-temperature mechanical properties could be mainly attributed to the combined effects of fine-grain strengthening, solid solution strengthening, and precipitation strengthening. At 300 °C, the high-temperature tensile strength of the developed alloy reached (222.47±6.41) MPa, with a yield strength of (164.25±11.40) MPa and an elongation of (8.88±0.33)%, outperforming those of existing alloys documented in the literature. The improved high-temperature mechanical performance was primarily provided by the three-dimensional network comprising cellular heat-resistant Al17(FeMnNiCr)4Si2 and α-Al(FeMn)Si phases.
采用铸造和激光重熔相结合的方法,制备了一种适用于激光粉末床熔炼的高强度耐热Al-Si-Fe合金。通过弄清掺入元素及其含量对Al-Si-Fe合金组织和力学性能的影响,优选出Al-11Si-2.5Fe-2Mn-1.2Ni-0.4Cr (wt.%)。随后用PBF-LB对优化后的合金进行了验证,该合金具有良好的可加工性,密度达到99.8%。PBF-LB法制备的Al-Si-Fe合金室温抗拉强度为(512.76±3.26)MPa,屈服强度为(337.79±2.36)MPa,伸长率为(2.98±0.07)%。室温力学性能的增强主要是细晶强化、固溶强化和析出强化共同作用的结果。在300℃时,合金的高温抗拉强度为(222.47±6.41)MPa,屈服强度为(164.25±11.40)MPa,伸长率为(8.88±0.33)%,优于已有的合金。高温力学性能的提高主要是由胞状耐热Al17(FeMnNiCr)4Si2和α-Al(FeMn)Si相组成的三维网络提供的。
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引用次数: 0
Castability, mechanical, and corrosion properties of Al-Zn-Ca alloys with high thermal conductivity 高导热Al-Zn-Ca合金的浇注性能、机械性能和腐蚀性能
IF 4.7 1区 材料科学 Q1 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-11-01 DOI: 10.1016/S1003-6326(25)66901-9
A.A. LYSKOVICH , V.E. BAZHENOV , I.I. BARANOV , V.A. BAUTIN , A.V. SANNIKOV , A.I. BAZLOV , E.I. TIAN , A.A. STEPASHKIN , A.V. KOLTYGIN , V.D. BELOV
The majority of industrial aluminum casting alloys exhibit low thermal conductivity, which is insufficient for effective heat transfer in electronic devices. The objective of this investigation was to develop new aluminum casting alloys with high thermal conductivity. The impact of alloying elements on the thermal conductivity of pure aluminum was examined, and the relationships among microstructure, thermal conductivity, and the mechanical and corrosion properties of Al-Zn-Ca-(Cu,Mg) alloys were explored. The findings indicate that in the as-cast state, the structure of the alloys consists of α-Al and a eutectic containing the (Al,Zn)4Ca phase. Following the solution heat treatment, the (Al,Zn)4Ca phase is spheroidised, and thermal conductivity of the alloys increases, reaching over 75% that of pure aluminum. However, the heat-treated alloys exhibit low mechanical properties: tensile yield strength <60 MPa, ultimate tensile strength <160 MPa, and elongation at fracture >15%. The alloys demonstrate satisfactory fluidity and low hot tearing susceptibility. With the exception of the alloy containing copper, the alloys exhibit low corrosion rates, estimated at approximately 0.02 mm/a.
大多数工业铝合金的导热性较低,不足以在电子设备中有效地传热。本研究的目的是开发新的高导热铝铸造合金。研究了合金元素对纯铝热导率的影响,探讨了Al-Zn-Ca-(Cu,Mg)合金的显微组织、热导率与力学性能和腐蚀性能之间的关系。结果表明:铸态合金组织由α-Al和含有(Al,Zn)4Ca相的共晶组成;固溶热处理后,(Al,Zn)4Ca相球化,合金导热系数提高,达到纯铝的75%以上。然而,热处理合金表现出较低的力学性能:抗拉屈服强度为60 MPa,极限抗拉强度为160 MPa,断裂伸长率为15%。合金具有良好的流动性和较低的热撕裂敏感性。除含铜合金外,合金的腐蚀速率较低,估计约为0.02 mm/a。
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引用次数: 0
Simultaneously improving intermediate-temperature strength and ductility of Ni-Co-based superalloy by tailoring high-density stacking faults 通过剪裁高密度层错,同时提高镍钴基高温合金的中温强度和塑性
IF 4.7 1区 材料科学 Q1 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-11-01 DOI: 10.1016/S1003-6326(25)66911-1
Yu-bi GAO , Xing-mao WANG , Jia-yu XU , Bo LIU , Bing ZHEN , Yu-tian DING , Bin GAN , Ting-biao GUO , Jun-zhao LIU
High-density stacking faults (SFs) were introduced into a novel Ni-Co-based superalloy through warm rolling at 300-500 °C, and the effects of SFs on its tensile properties at intermediate temperatures (650 and 750 °C) were investigated. The results indicated that all warm rolled specimens have high-density SFs and Lomer-Cottrell locks compared with the initial specimens. Meanwhile, the simultaneous improvement of intermediate-temperature strength and ductility of alloys can be achieved by high-density SFs. In particular, the specimen rolled at 300 °C exhibited a superior combination of high strength (yield and ultimate tensile strengths of (1311±18) and (1462±25) MPa respectively at 650 °C, and (1180±17) and (1293±15) MPa respectively at 750 °C) and high fracture elongation ((26.7±2.5)% at 650 °C and (10.7±1.3)% at 750 °C). The high strengths and facture elongations of all warm-rolled specimens were primarily attributed to the interaction of pre-existing γ′ phases, high-density SFs and Lomer-Cottrell locks with dislocations, as well as to the formation of high-density deformation nano-twins during tensile loading.
通过300 ~ 500℃的温轧,在镍钴基高温合金中引入高密度层错,研究了高密度层错对合金中温(650 ~ 750℃)拉伸性能的影响。结果表明:与初始试样相比,所有热轧试样均具有高密度的SFs和lmer - cottrell锁;同时,高密度SFs可以同时提高合金的中温强度和塑性。特别是,在300℃下轧制的试样表现出优异的高强度组合(650℃时屈服强度和极限抗拉强度分别为(1311±18)和(1462±25)MPa, 750℃时分别为(1180±17)和(1293±15)MPa)和高断裂伸长率(650℃时为(26.7±2.5)%,750℃时为(10.7±1.3)%)。所有热轧试样的高强度和断裂伸长率主要归因于先前存在的γ′相、高密度的SFs和lomo - cottrell锁与位错的相互作用,以及拉伸加载过程中高密度变形纳米孪晶的形成。
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引用次数: 0
Machine learning with center-environment attention mechanism for multi-component Nb alloys 基于中心-环境注意机制的多组分Nb合金机器学习
IF 4.7 1区 材料科学 Q1 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-11-01 DOI: 10.1016/S1003-6326(25)66914-7
Yu-chao TANG , Bin XIAO , Jian-hui CHEN , Shui-zhou CHEN , Yi-hang LI , Fu LIU , Wan DU , Yi-heng SHEN , Xue FAN , Quan QIAN , Yi LIU
The graph-based representation of material structures, along with deep neural network models, often lacks locality and requires large datasets, which are seldom available in specialized materials research. To address this challenge, we developed a more data-efficient center-environment (CE) structure representation that incorporates a predefined attention-focused mechanism. This approach was applied in a machine learning (ML) study to examine the local alloying effects on the structural stability of Nb alloys. In the CE feature model, the atomic environment type (AET) method was utilized, which effectively describes the low-symmetry physical shell structures of neighboring atoms. The optimized ML-CEAET models successfully predicted double-site substitution energies in Nb with a mean absolute error of 55.37 meV and identified Si-M pairs (where M = Ta, W, Re, and lanthanide rare-earth elements) as promising stabilizers for Nb. The ML-CEAET model’s good transferability was further confirmed through accurate prediction of untrained alloying element Nb. Significantly, in cases involving small datasets, non-deep learning models with CE features outperformed deep learning models based on graph features reported in the literature.
基于图的材料结构表示,以及深度神经网络模型,往往缺乏局部性,需要大型数据集,这在专门的材料研究中很少可用。为了应对这一挑战,我们开发了一个数据效率更高的中心环境(CE)结构表示,它包含了一个预定义的注意力集中机制。该方法被应用于机器学习(ML)研究中,以检验局部合金化对Nb合金结构稳定性的影响。在CE特征模型中,采用原子环境类型(AET)方法,有效地描述了相邻原子的低对称性物理壳结构。优化后的ML-CEAET模型成功地预测了Nb中的双位取代能,平均绝对误差为55.37 meV,并确定了Si-M对(其中M = Ta, W, Re和镧系稀土元素)是Nb的稳定剂。通过对未训练合金元素Nb的准确预测,进一步证实了ML-CEAET模型良好的可转移性。值得注意的是,在涉及小数据集的情况下,具有CE特征的非深度学习模型优于文献中基于图特征的深度学习模型。
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引用次数: 0
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Transactions of Nonferrous Metals Society of China
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