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Wear-resistant CoCrNi multi-principal element alloy at cryogenic temperature
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作者 Yue Ren Qing Zhou +7 位作者 Dongpeng Hua Zhuobin Huang Yulong Li Qian Jia Peter Gumbsch Christian Greiner Haifeng Wang Weimin Liu 《Science Bulletin》 SCIE EI CAS CSCD 2024年第2期227-236,共10页
Traditional high strength engineering alloys suffer from serious surface brittleness and inferior wear performance when servicing under sliding contact at cryogenic temperature.Here,we report that the recently emergin... Traditional high strength engineering alloys suffer from serious surface brittleness and inferior wear performance when servicing under sliding contact at cryogenic temperature.Here,we report that the recently emerging CoCrNi multi-principal element alloy defies this trend and presents dramatically enhanced wear resistance when temperature decreases from 273 to 153 K,surpassing those of cryogenic austenitic steels.The temperature-dependent structure characteristics and deformation mechanisms influencing the cryogenic wear resistance of CoCrNi are clarified through microscopic observation and atomistic simulation.It is found that sliding-induced subsurface structures show distinct scenarios at different deformation temperatures.At cryogenic condition,significant grain refinement and a deep plastic zone give rise to an extended microstructural gradient below the surface,which can accommodate massive sliding deformation,in direct contrast to the strain localization and delamination at 273 K.Meanwhile,the temperature-dependent cryogenic deformation mechanisms(stacking fault networks and phase transformation)also provide additional strengthening and toughening of the subsurface material.These features make the CoCrNi alloy particularly wear resistant at cryogenic conditions and an excellent candidate for safety–critical applications. 展开更多
关键词 multi-principal element alloy Cryogenic temperature WEAR CoCrNi
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An efficient scheme for accelerating the calculation of stacking fault energy in multi-principal element alloys
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作者 Haoran Sun Zhigang Ding +4 位作者 Hao Sun Junjun Zhou Ji-Chang Ren Qingmiao Hu Wei Liu 《Journal of Materials Science & Technology》 SCIE EI CAS CSCD 2024年第8期204-211,共8页
We present the High-Throughput Computing and Statistical Analysis(HCSA)scheme,which efficiently and accurately predicts the stacking fault energies(SFEs)of multi-principal element alloys(MPEAs).Our approach estimates ... We present the High-Throughput Computing and Statistical Analysis(HCSA)scheme,which efficiently and accurately predicts the stacking fault energies(SFEs)of multi-principal element alloys(MPEAs).Our approach estimates the SFE of a single complex supercell by averaging numerous SFEs from small supercells,resulting in superior accuracy compared to traditional density functional theory(DFT)calculations.To validate our scheme,we applied it to NiFe and Ni_(10)Co_(60)Cr_(25)W_(5)alloys,achieving an SFE error of only 11%,in contrast to the 45%error obtained from traditional DFT calculations for NiFe.We observed a strong correlation between the average SFEs of samples with the same valence electron concentration as that of the experimental data.Our scheme provides an efficient and reliable tool for predicting SFEs in MPEAs and holds the potential to significantly accelerate materials design and discovery processes. 展开更多
关键词 multi-principal element alloys Stacking fault energy Density functional theory High-throughput calculation
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Atomistic study of inverse size effect induced by interfacial plasticity in pearlitic multi-principal element alloy
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作者 Chen Yang Qiao-Sheng Xia +1 位作者 Cun-Hong Yin Dong-Peng Hua 《Rare Metals》 SCIE EI CAS CSCD 2024年第7期3341-3355,共15页
Owing to the fine nano-laminated structure,the pearlitic multi-principal element alloy(PMPEA) exhibits excellent mechanical and tribological properties.However,the incomplete understanding of the size effect of its la... Owing to the fine nano-laminated structure,the pearlitic multi-principal element alloy(PMPEA) exhibits excellent mechanical and tribological properties.However,the incomplete understanding of the size effect of its lamella thickness and the unclear understanding of the plasticity-interface interaction mechanism limit further optimization of PMPEAs.In this study,the FeCoNi/Ni_3Ti interface-mediated plastic deformation behavior in PMPEA and the variation of mechanical and tribological properties with lamella thickness within the nanoscale range using molecular dynamics(MD) simulation were explored.The results indicate that the mechanical and tribological properties of the PMPEA with lamella thicknesses below 10 nm have a significant inverse size effect,i.e.,the smaller the lamella thickness,the weaker the properties.This is because the plastic carrier-interface interaction mechanism changes from a strengthening mechanism that hinders dislocations to a weakening mechanism that promotes dislocations with the decreases in the lamella thickness,and the weakening effect becomes more pronounced as the lamella thickness decreases and the number of interfaces increases.In particular,the deformation behavior of Ni_3Ti lamellae changes from crystal-like to amorphous-like with decreasing lamella.Moreover,in the sample with larger lamella thickness,the occurrence of hierarchical slips in the body-centered cubic(BCC) phase due to the multiprincipal elements effect can better alleviate the stress concentration caused by the dislocation accumulation at the interface,so that the phase interface exhibits outstanding load-bearing effects.And the dislocation pattern in BCC phase shows a firm high-density cell,which makes the substrate exhibit a stable tribological response. 展开更多
关键词 multi-principal element alloy Nano-laminated structure Molecular dynamics simulation Nanoindentation and nanoscratch
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Local chemical ordering and its impact on radiation damage behavior of multi-principal element alloys 被引量:2
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作者 Leqing Liu Xiongjun Liu +4 位作者 Qing Du Hui Wang Yuan Wu Suihe Jiang Zhaoping Lu 《Journal of Materials Science & Technology》 SCIE EI CAS CSCD 2023年第4期13-25,共13页
Multi-principal element alloys(MPEAs)have attracted much attention as future nuclear materials due to their extraordinary radiation resistances.In this work,we have elucidated the development of local chemical orderin... Multi-principal element alloys(MPEAs)have attracted much attention as future nuclear materials due to their extraordinary radiation resistances.In this work,we have elucidated the development of local chemical orderings(LCOs)and their influences on radiation damage behavior in the typical CrFeNi MPEA by hybrid-molecular dynamics and Monte Carlo simulations.It was found that considerable LCOs consist-ing of the Cr-Cr and Ni-Fe short-range orders existed in the ordered configuration with optimized system energy.Through modeling the accumulation cascades up to 1000 recoils,we revealed that the size of de-fect clusters and dislocation loops is smaller in the ordered configuration than those in the random one,although the former formed more Frenkel pairs(i.e.,self-interstitials and vacancies).In addition,the dis-tribution of dislocation loops is relatively more dispersed in the ordered configuration,and the stair-rod dislocations related to irradiation swelling are also smaller,implying that the existence of LCOs is con-ducive to enhancing radiation damage tolerance.To understand the underlying mechanism,the effects of LCOs on the formation and evolution of defects and radiation resistance were discussed from the aspects of atomic bonding,migration path,and energy of defect diffusion,which provides theoretical guidance for the design of MPEAs with enhanced radiation resistance. 展开更多
关键词 multi-principal element alloys Local chemical ordering Radiation damage Dislocation evolution Molecular dynamics simulation
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Effect of interstitial carbon and nitrogen on corrosion of FeCoCrNi multi-principal element alloys made by selective laser melting 被引量:2
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作者 Wenyu Chen Rui Zhou +6 位作者 Wanpeng Li Yen-Hsiang Chen Tzu-Hsiu Chou Xu Wang Yong Liu Yuntian Zhu J.C.Huang 《Journal of Materials Science & Technology》 SCIE EI CAS CSCD 2023年第17期52-63,共12页
The corrosion behaviors of selective laser melted(SLMed)FeCoCrNi multi-principal element alloys(MPEAs)with carbon or nitrogen addition in 0.5 M H_(2)SO_(4) solution were investigated.Both C and N ad-dition refined the... The corrosion behaviors of selective laser melted(SLMed)FeCoCrNi multi-principal element alloys(MPEAs)with carbon or nitrogen addition in 0.5 M H_(2)SO_(4) solution were investigated.Both C and N ad-dition refined the grains and introduced a heterogeneous structure in SLMed FeCoCrNi MPEA,but they had opposite effects on the corrosion behavior.The doped carbon participated as nano-sized carbides in SLMed MPEA,and localized galvanic corrosion occurred,degrading the corrosion resistance.The doped nitrogen was gathered with chromium and formed CrN chemical clusters in SLMed MPEA,and a protec-tive passive film with a higher Cr_(2)O_(3)/Cr(OH)_(3) ratio formed,which improved corrosion resistance. 展开更多
关键词 Selective laser melting Interstitial element multi-principal element alloys Acid corrosion
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Design and characterization of a novel Cu_(2.3)Al_(1.3)Ni_(1.7)SnCr_(0.3) multi-principal element alloy coating on magnesium alloy by laser cladding 被引量:1
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作者 Lipeng Jiang Xiufang Cui +4 位作者 Guo Jin Zhimin Tian Xin Wen Haoliang Tian Erbao Liu 《Journal of Materials Science & Technology》 SCIE EI CAS CSCD 2023年第21期220-236,共17页
The evaporation and dilution of substrate seriously limit the performance of laser cladding coatings on magnesium alloys.In order to overcome the above shortcomings,a multi-step ultrasonic assisted laser remelting tec... The evaporation and dilution of substrate seriously limit the performance of laser cladding coatings on magnesium alloys.In order to overcome the above shortcomings,a multi-step ultrasonic assisted laser remelting technology was proposed to improve the performance of the coating.In this work,a novel Cu_(2.3)Al_(1.3)Ni_(1.7)SnCr_(0.3) multi-principal element alloy coating(MPEAC)was prepared on the surface of mag-nesium alloy.Characterization techniques such as transmission electron microscopy(TEM),electron back scatter diffraction(EBSD)and scanning electron microscopy(SEM)were employed to characterize the microstructure and phase composition of the coatings.And the phase structure and morphology at the interface between the coating and the substrate were also studied via focus ion beam(FIB)and TEM method.In addition,the corrosion and wear resistance ability of the coatings were monitored by potentiodynamic polarization(PDP),and electrochemical impedance spectroscopy(EIS),hardness and friction tests.The results show that Cu_(2.3)Al_(1.3)Ni_(1.7)SnCr_(0.3) MPEAC with ultrasonic assisted is composed of FCC phase and eutectic phases(Cu_(10)Sn_(3) and Cu_(2)Ni_(3)Sn_(3)).Due to the forced convection generated by ultrasonic waves,some Cu and Ni phases are precipitated around Cu_(2)Ni_(3)Sn_(3) phases,which is beneficial to enhance the corrosion resistance.Because of the grain refinement effect caused by ultrasonic,the wear resistance of the coating is also improved.Furthermore,ultrasonic vibration can effectively weaken and eliminate the texture density of the Cu_(2.3)Al_(1.3)Ni_(1.7)SnCr_(0.3) MPEAC fabricated by laser cladding. 展开更多
关键词 Magnesium alloy multi-principal element alloy coating Ultrasonic assisted laser cladding Corrosion resistance Wear resistance
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Excellent strength-ductility combination in Co_(36)Cr_(15)Fe_(18)Ni_(18)Al_(8)Ti_(4)Mo_(1)multi-principal element alloys by dual-morphology B2 precipitates strengthening 被引量:1
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作者 X.S.Liu R.Li +11 位作者 X.F.Fan Q.Q.Liu X.Tong A.X.Li S.Xu H.Yang S.B.Yu M.H.Jiang C.Huo P.F.Yu M.T.Dove G.Li 《Journal of Materials Science & Technology》 SCIE EI CAS CSCD 2023年第3期60-66,共7页
Precipitation strengthening provides one of the most widely-used mechanisms for strengthen-ing multi-principal-element alloys(MPEAs).Here,we report dual-morphology B2 precipitates in Co_(36)Cr_(15)Fe_(18)Ni_(18)Al_(8)... Precipitation strengthening provides one of the most widely-used mechanisms for strengthen-ing multi-principal-element alloys(MPEAs).Here,we report dual-morphology B2 precipitates in Co_(36)Cr_(15)Fe_(18)Ni_(18)Al_(8)Ti_(4)Mo_(1)MPEA obtained by thermo-mechanical processing.Electron microscopy charac-terization reveals that the dual-morphology B2 precipitates are either recrystallized B2 particles formed at the grain boundaries or triple junctions with recrystallization process,or rod-like within the non-recrystallized FCC matrix.The dual-morphology B2 precipitates enhance the yield strength and ultimate tensile strength up to 1120 MPa and 1480 MPa,respectively.This work suggests the mechanical proper-ties of the alloy can be optimized by B2 precipitation strengthening to meet the needs of engineering applications. 展开更多
关键词 multi-principal element alloys B2 precipitates Heterogeneous nucleation Precipitation strengthening
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Composition design of high yield strength points in single-phase Co-Cr-Fe-Ni-Mo multi-principal element alloys system based on electronegativity,thermodynamic calculations,and machine learning 被引量:1
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作者 Jiao-Hui Yan Zi-Jing Song +6 位作者 Wei Fang Xin-Bo He Ruo-Bin Chang Shao-Wu Huang Jia-Xin Huang Hao-Yang Yu Fu-Xing Yin 《Tungsten》 EI CSCD 2023年第1期169-178,共10页
A method which combines electronegativity difference,CALculation of PHAse Diagrams(CALPHAD) and machine learning has been proposed to efficiently screen the high yield strength regions in Co-Cr-Fe-Ni-Mo multi-componen... A method which combines electronegativity difference,CALculation of PHAse Diagrams(CALPHAD) and machine learning has been proposed to efficiently screen the high yield strength regions in Co-Cr-Fe-Ni-Mo multi-component phase diagram.First,the single-phase region at a certain annealing temperature is obtained by combining CALPHAD method and machine learning,to avoid the formation of brittle phases.Then high yield strength points in the single-phase region are selected by electronegativity difference.The yield strength and plastic deformation behavior of the designed Co_(14)Cr_(30)Ni_(50)Mo_(6)alloy are measured to evaluate the proposed method.The validation experiments indicate this method is effective to predict high yield strength points in the whole compositional space.Meanwhile,the interactions between the high density of shear bands and dislocations contribute to the high ductility and good work hardening ability of Co_(14)Cr_(30)Ni_(50)Mo_(6)alloy.The method is helpful and instructive to property-oriented compositional design for multi-principal element alloys. 展开更多
关键词 High entropy alloys multi-principal element alloys Yield strength Electronegativity difference CALculation of PHAse Diagrams Machine learning
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Nanoscale fluctuation of stacking fault energy strengthens multi-principal element alloys
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作者 Zongrui Pei Markus Eisenbach +1 位作者 Peter K.Liaw Mingwei Chen 《Journal of Materials Science & Technology》 SCIE EI CAS CSCD 2023年第27期218-225,共8页
Chemical randomness and the associated energy fluctuation are essential features of multi-principal ele-ment alloys(MPEAs).Due to these features,nanoscale stacking fault energy(SFE)fluctuation is a natural and indepen... Chemical randomness and the associated energy fluctuation are essential features of multi-principal ele-ment alloys(MPEAs).Due to these features,nanoscale stacking fault energy(SFE)fluctuation is a natural and independent contribution to strengthening MPEAs.However,existing models for conventional alloys(i.e.,alloys with one principal element)cannot be applied to MPEAs.The extreme values of SFEs required by such models are unknown for MPEAs,which need to calculate the nanoscale volume relevant to the SFE fluctuation.In the present work,we developed an analytic model to evaluate the strengthening ef-fect through the SFE fluctuation,profuse in MPEAs.The model has no adjustable parameters,and all parameters can be determined from experiments and ab initio calculations.This model explains available experimental observations and provides insightful guidance for designing new MPEAs based on the SFE fluctuation.It generally applies to MPEAs in random states and with chemical short-range order. 展开更多
关键词 Nanoscale energy fluctuation Staking fault energy Chemical short-range order multi-principal element alloy Mechanism
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Multi-scale investigation of short-range order and dislocation glide in MoNbTi and TaNbTi multi-principal element alloys 被引量:1
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作者 Hui Zheng Lauren T.W.Fey +6 位作者 Xiang-Guo Li Yong-Jie Hu Liang Qi Chi Chen Shuozhi Xu Irene J.Beyerlein Shyue Ping Ong 《npj Computational Materials》 SCIE EI CSCD 2023年第1期1430-1442,共13页
Refractory multi-principal element alloys(RMPEAs)are promising materials for high-temperature structural applications.Here,we investigate the role of short-range ordering(SRO)on dislocation glide in the MoNbTi and TaN... Refractory multi-principal element alloys(RMPEAs)are promising materials for high-temperature structural applications.Here,we investigate the role of short-range ordering(SRO)on dislocation glide in the MoNbTi and TaNbTi RMPEAs using a multi-scale modeling approach.Monte carlo/molecular dynamics simulations with a moment tensor potential show that MoNbTi exhibits a much greater degree of SRO than TaNbTi and the local composition has a direct effect on the unstable stacking fault energies(USFEs).From mesoscale phase-field dislocation dynamics simulations,we find that increasing SRO leads to higher mean USFEs and stress required for dislocation glide.The gliding dislocations experience significant hardening due to pinning and depinning caused by random compositional fluctuations,with higher SRO decreasing the degree of USFE dispersion and hence,amount of hardening.Finally,we show how the morphology of an expanding dislocation loop is affected by the applied stress. 展开更多
关键词 alloyS DISLOCATION element
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Computational discovery of ultra-strong, stable, and lightweight refractory multi-principal element alloys. Part II: comprehensive ternary design and validation
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作者 Kate L.M.Elder Joel Berry +6 位作者 Aurélien Perron Brandon Bocklund Jibril Shittu Connor J.Rietema Hunter B.Henderson Scott K.McCall Joseph T.McKeown 《npj Computational Materials》 SCIE EI CSCD 2023年第1期1469-1481,共13页
Here the discovery of refractory multi-principal element alloys(MPEAs)with high-temperature strength and stability is pursued within a constrained and application-relevant design space.A comprehensive approach is deve... Here the discovery of refractory multi-principal element alloys(MPEAs)with high-temperature strength and stability is pursued within a constrained and application-relevant design space.A comprehensive approach is developed and applied to explore all 165 ternary systems in the Al-Ce-Fe-Hf-Mo-Nb-Ta-Ti-V-W-Zr family.A subset of ternary systems that contain large areas in composition–temperature space with high strength and robust BCC phase stability is found.Twelve sets of high-performing alloys are identified,each set optimized for one combination of phase constraint,optimization target,and temperature range.Preliminary mechanical tests support the viability of the method.This work highlights the importance of considering phase stability,exploring non-equiatomic regions of composition space,and applying application-relevant constraints.Parts I and II provide three down-selection techniques for identifying high-performing BCC refractory MPEAs,design guidelines,and many candidates predicted to have BCC phase stability and strengths 2–3 times higher than any reported to date. 展开更多
关键词 alloyS element TERNARY
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Microstructure and dry sliding wear behavior of laser clad AlCrNiSiTi multi-principal element alloy coatings 被引量:7
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作者 Can Huang Yi-Zhou Tang +4 位作者 Yong-Zhong Zhang An-Ping Dong Jian Tu Lin-Jiang Chai Zhi-Ming Zhou 《Rare Metals》 SCIE EI CAS CSCD 2017年第7期562-568,共7页
The approximately equimolar ratio A1CrNiSiTi multi-principal element alloy (MPEA) coatings were fab- ricated by laser cladding on Ti-6Al-4V (Ti64) alloy. Scanning electron microscopy (SEM), equipped with an ener... The approximately equimolar ratio A1CrNiSiTi multi-principal element alloy (MPEA) coatings were fab- ricated by laser cladding on Ti-6Al-4V (Ti64) alloy. Scanning electron microscopy (SEM), equipped with an energy-dispersive spectroscopy (EDS), and X-ray diffrac- tion (XRD) were used to characterize the microstructure and composition. Investigations show that the coatings consist of (Ti, Cr)5Si3 and NiA1 phases, formed by in situ reaction. The phase composition is initially explicated according to obtainable binary and ternary phase diagrams, and the formation Gibbs energy of TisSi3, VsSi3 and CrsSi3. Dry sliding reciprocating friction and wear tests of the A1CrNiSiTi coating and Ti64 alloy substrate without coating were evaluated. A surface mapping profiler was used to evaluate the wear volume. The worn surface was characterized by SEM-EDS. The hardness and wear resistance of the A1CrNiSiTi coating are well compared with that of the basal material (Ti64). The main wear mechanism of the AICrNiSiTi coating is slightly adhesive transfer from GCrl5 counterpart, and a mixed layer com- posed of transferred materials and oxide is formed. 展开更多
关键词 Laser cladding multi-principal element alloy MICROSTRUCTURE Wear behavior
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Design of low-alloying and high-performance solid solution-strengthened copper alloys with element substitution for sustainable development
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作者 Jiaqiang Li Hongtao Zhang +2 位作者 Jingtai Sun Huadong Fu Jianxin Xie 《International Journal of Minerals,Metallurgy and Materials》 SCIE EI CAS CSCD 2024年第5期826-832,共7页
Solid solution-strengthened copper alloys have the advantages of a simple composition and manufacturing process,high mechanical and electrical comprehensive performances,and low cost;thus,they are widely used in high-... Solid solution-strengthened copper alloys have the advantages of a simple composition and manufacturing process,high mechanical and electrical comprehensive performances,and low cost;thus,they are widely used in high-speed rail contact wires,electronic component connectors,and other devices.Overcoming the contradiction between low alloying and high performance is an important challenge in the development of solid solution-strengthened copper alloys.Taking the typical solid solution-strengthened alloy Cu-4Zn-1Sn as the research object,we proposed using the element In to replace Zn and Sn to achieve low alloying in this work.Two new alloys,Cu-1.5Zn-1Sn-0.4In and Cu-1.5Zn-0.9Sn-0.6In,were designed and prepared.The total weight percentage content of alloying elements decreased by 43%and 41%,respectively,while the product of ultimate tensile strength(UTS)and electrical conductivity(EC)of the annealed state increased by 14%and 15%.After cold rolling with a 90%reduction,the UTS of the two new alloys reached 576 and 627MPa,respectively,the EC was 44.9%IACS and 42.0%IACS,and the product of UTS and EC(UTS×EC)was 97%and 99%higher than that of the annealed state alloy.The dislocations proliferated greatly in cold-rolled alloys,and the strengthening effects of dislocations reached 332 and 356 MPa,respectively,which is the main reason for the considerable improvement in mechanical properties. 展开更多
关键词 element substitution copper alloy solid solution strengthening microstructure and performance
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A cluster-plus-glue-atom composition design approach designated for multi-principal element alloys
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作者 Xuan Liu Hui-Bin Ke +6 位作者 Liang Wang Yao-Jian Liang Lin-Jing Wang Ben-Peng Wang Lu Wang Qun-Bo Fan Yun-Fei Xue 《Rare Metals》 SCIE EI CAS CSCD 2022年第11期3839-3849,共11页
Multi-principal element alloys(MPEAs)have shown extraordinary properties in different fields.However,the composition design of MPEAs is still challenging due to the complicated interactions among principal elements(PE... Multi-principal element alloys(MPEAs)have shown extraordinary properties in different fields.However,the composition design of MPEAs is still challenging due to the complicated interactions among principal elements(PEs),and even more challenging with precipitates formation.Precipitation can be either beneficial or detrimental in alloys,thus it is important to control precipitates formation on purpose during alloy design.In this work,cluster-plus-glue-atom model(CGM)composition design method which is usually used to describe short-range order in traditional alloys has been successfully extended to MPEAs for precipitation design.The key challenge of extending CGM to MPEAs is the determination of center atom since there are no solvent or solute in MPEAs.Research has found that the element type of center atom was related not only with chemical affinity,but also with atomic volume difference in MPEAs,which has inevitable effect on atomic arrangement.Based on experimental data of MPEAs with precipitates,it was found that elements with either stronger chemical affinity or larger volume difference with other PEs would occupy the center site of clusters.Therefore,a cluster index(P_(C)),which considers both chemical affinity and atomic volume factors,was proposed to assist the determination of center atom in MPEAs.Based on the approach,a solid-solution Zr-Ti-V-Nb-Al BCC alloy was obtained by inhibiting the precipitation,while precipitation-strengthened Al-Cr-FeNi-V FCC alloy and Al-Co-Cr-Fe-Ni BCC alloy were designed by promoting the precipitation.Corresponding experimental results demonstrated that the approach could provide a relatively simple and accurate predication of precipitation and the compositions of precipitations were in line with PEs in cluster in MPEAs.The research may open an effective way for composition design of MPEAs with desired phase structure. 展开更多
关键词 multi-principal element alloy(MPEA) Composition design Phase structure Cluster-plus-glue-atom model(CGM)
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Thermodynamic analysis of the simple microstructure of AlCrFeNiCu high-entropy alloy with multi-principal elements 被引量:6
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作者 Anmin LI Xiyan ZHANG 《Acta Metallurgica Sinica(English Letters)》 SCIE EI CAS CSCD 2009年第3期219-224,共6页
AlCrFeNiCu high-entropy alloy (THA) was synthesized by the arc melting and casting method. The alloy exhibits simple FCC and BCC solid solution phases rather than intermetallic compounds. The reason is that the Gibb... AlCrFeNiCu high-entropy alloy (THA) was synthesized by the arc melting and casting method. The alloy exhibits simple FCC and BCC solid solution phases rather than intermetallic compounds. The reason is that the Gibbs free energy of mixing of the equimolar A1CrFeNiCu alloy is smaller than that of inter-metallic compounds by calculation according to the Miedema model . 展开更多
关键词 multi-principal elements alloy High-entropy alloy THERMODYNAMICS MICROSTRUCTURE
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Phase classification of multi-principal element alloys via interpretable machine learning 被引量:2
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作者 Kyungtae Lee Mukil V.Ayyasamy +2 位作者 Paige Delsa Timothy Q.Hartnett Prasanna V.Balachandran 《npj Computational Materials》 SCIE EI CSCD 2022年第1期206-217,共12页
There is intense interest in uncovering design rules that govern the formation of various structural phases as a function of chemical composition in multi-principal element alloys (MPEAs).In this paper,we develop a ma... There is intense interest in uncovering design rules that govern the formation of various structural phases as a function of chemical composition in multi-principal element alloys (MPEAs).In this paper,we develop a machine learning (ML) approach built on the foundations of ensemble learning,post hoc model interpretability of black-box models,and clustering analysis to establish a quantitative relationship between the chemical composition and experimentally observed phases of MPEAs.The originality of our work stems from performing instance-level (or local) variable attribution analysis of ML predictions based on the breakdown method,and then identifying similar instances based on k-means clustering analysis of the breakdown results.We also complement the breakdown analysis with Ceteris Paribus profiles that showcase how the model response changes as a function of a single variable,when the values of all other variables are fixed.Results from local model interpretability analysis uncover key insights into variables that govern the formation of each phase.Our developed approach is generic,model-agnostic,and valuable to explain the insights learned by the black-box models.An interactive web application is developed to facilitate model sharing and accelerate the design of MPEAs with targeted properties. 展开更多
关键词 alloyS element instance
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Distilling physical origins of hardness in multi-principal element alloys directly from ensemble neural network models
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作者 D.Beniwal P.Singh +3 位作者 S.Gupta M.J.Kramer D.D.Johnson P.K.Ray 《npj Computational Materials》 SCIE EI CSCD 2022年第1期1450-1460,共11页
Despite a plethora of data being generated on the mechanical behavior of multi-principal element alloys,a systematic assessment remains inaccessible via Edisonian approaches.We approach this challenge by considering t... Despite a plethora of data being generated on the mechanical behavior of multi-principal element alloys,a systematic assessment remains inaccessible via Edisonian approaches.We approach this challenge by considering the specific case of alloy hardness,and present a machine-learning framework that captures the essential physical features contributing to hardness and allows high-throughput exploration of multi-dimensional compositional space.The model,tested on diverse datasets,was used to explore and successfully predict hardness in Al_(x)Ti_(y)(CrFeNi)_(1-x-y),Hf_(x)Co_(y)(CrFeNi)_(1-x-y)and Al_(x)(TiZrHf)_(1-x)systems supported by data from density-functional theory predicted phase stability and ordering behavior.The experimental validation of hardness was done on TiZrHfAlx.The selected systems pose diverse challenges due to the presence of ordering and clustering pairs,as well as vacancy-stabilized novel structures.We also present a detailed model analysis that integrates local partial-dependencies with a compositional-stimulus and model-response study to derive material-specific insights from the decision-making process. 展开更多
关键词 alloyS alloy element
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Study on hot deformation behavior of homogenized Mg-8.5Gd-4.5Y-0.8Zn-0.4Zr alloy using a combination of strain-compensated Arrhenius constitutive model and finite element simulation method 被引量:2
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作者 Li Hu Mengwei Lang +4 位作者 Laixin Shi Mingao Li Tao Zhou Chengli Bao Mingbo Yang 《Journal of Magnesium and Alloys》 SCIE EI CAS CSCD 2023年第3期1016-1028,共13页
Isothermal hot compression experiments were conducted on homogenized Mg-8.5Gd-4.5Y-0.8Zn-0.4Zr alloy to investigate hot deformation behavior at the temperature range of 673-773 K and the strain rate range of 0.001-1 s... Isothermal hot compression experiments were conducted on homogenized Mg-8.5Gd-4.5Y-0.8Zn-0.4Zr alloy to investigate hot deformation behavior at the temperature range of 673-773 K and the strain rate range of 0.001-1 s^(-1)by using a Gleeble-1500D thermo mechanical simulator.Metallographic characterization on samples deformed to true strain of 0.70 illustrates the occurrence of flow localization and/or microcrack at deformation conditions of 673 K/0.01 s^(-1),673 K/1 s^(-1)and 698 K/1 s^(-1),indicating that these three deformation conditions should be excluded during hot working of homogenized Mg-8.5Gd-4.5Y-0.8Zn-0.4Zr alloy.Based on the measured true stress-strain data,the strain-compensated Arrhenius constitutive model was constructed and then incorporated into UHARD subroutine of ABAQUS software to study hot deformation process of homogenized Mg-8.5Gd-4.5Y-0.8Zn-0.4Zr alloy.By comparison with measured force-displacement curves,the predicted results can describe well the rheological behavior of homogenized Mg-8.5Gd-4.5Y-0.8Zn-0.4Zr alloy,verifying the validity of finite element simulation of hot compression process with this complicated constitutive model.Numerical results demonstrate that the distribution of values of material parameters(α,n,Q and ln A)within deformed sample is inhomogeneous.This issue is directly correlated to the uneven distribution of equivalent plastic strain due to the friction effect.Moreover,at a given temperature the increase of strain rate would result in the decrease of equivalent plastic strain within the central region of deformed sample,which hinders the occurrence of dynamic recrystallization(DRX). 展开更多
关键词 Mg-RE-Zn alloy Hot deformation Microstructure evolution Constitutive model Finite element simulation
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Biomedical rare-earth magnesium alloy:Current status and future prospects 被引量:1
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作者 Mingli Yang Cheng Chen +5 位作者 Dongsheng Wang Yinjin Shao Wenhao Zhou Cijun Shuai Youwen Yang Xinghai Ning 《Journal of Magnesium and Alloys》 SCIE EI CAS CSCD 2024年第4期1260-1282,共23页
Biomedical magnesium(Mg)alloys have garnered significant attention because of their unique biodegradability,favorable biocompatibility,and suitable mechanical properties.The incorporation of rare earth(RE)elements,wit... Biomedical magnesium(Mg)alloys have garnered significant attention because of their unique biodegradability,favorable biocompatibility,and suitable mechanical properties.The incorporation of rare earth(RE)elements,with their distinct physical and chemical properties,has greatly contributed to enhancing the mechanical performance,degradation behavior,and biological performance of biomedical Mg alloys.Currently,a series of RE-Mg alloys are being designed and investigated for orthopedic implants and cardiovascular stents,achieving substantial and encouraging research progress.In this work,a comprehensive summary of the state-of-the-art in biomedical RE-Mg alloys is provided.The physiological effects and design standards of RE elements in biomedical Mg alloys are discussed.Particularly,the degradation behavior and mechanical properties,including their underlying action are studied in-depth.Furthermore,the preparation techniques and current application status of RE-Mg alloys are reviewed.Finally,we address the ongoing challenges and propose future prospects to guide the development of high-performance biomedical Mg-RE alloys. 展开更多
关键词 Magnesium alloy Rare earth elements Biodegradation behavior Mechanical performance Biological properties
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Study on Dynamic Mechanical Behavior of Al-Mg-Si Alloy
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作者 陶小旺 LIU Jibo +3 位作者 LIU Xianbin CHEN Jianbin WANG Yonggang 汪小锋 《Journal of Wuhan University of Technology(Materials Science)》 SCIE EI CAS CSCD 2024年第2期454-462,共9页
The dynamic mechanical behavior of Al-Mg-Si alloy was investigated under different strain rates by mechanical property and microstructure characterization,constitutive behavior analysis and numerical simulation in the... The dynamic mechanical behavior of Al-Mg-Si alloy was investigated under different strain rates by mechanical property and microstructure characterization,constitutive behavior analysis and numerical simulation in the present study.As the strain rate increases,the yield strength,ultimate tensile strength and elongation increase first,then remain almost constant,and finally increase.The alloy always exhibits a typical ductile fracture mode,not depending on the strain rate.However,as the strain rate increases,the number of dimples gradually increases.Tensile deformation can refine grains,however,the grain structure is slightly affected by the strain rate.An optimized Johnson-Cook constitutive equation was used to describe the mechanical behavior and obtained by fitting the true stress-strain curves.The parameter C was described by a function related to the strain rate.The fitting true stress-strain curves by the JC model agree very well with the experimental true stress-strain curves.The true stress-strain curves calculated by the finite element numerical simulation agree well with the experimental true stress-strain curves. 展开更多
关键词 Al-Mg-Si alloy strain rate mechanical property MICROSTRUCTURE Johnson-Cook model finite element simulation
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