The coupling effects of the metastable austenitic phase and the amorphous matrix in a transformation-induced plasticity(TRIP)-reinforced bulk metallic glass(BMG)composite under compressive loading were investigated by...The coupling effects of the metastable austenitic phase and the amorphous matrix in a transformation-induced plasticity(TRIP)-reinforced bulk metallic glass(BMG)composite under compressive loading were investigated by employing the digital image correlation(DIC)technique.The evolution of local strain field in the crystalline phase and the amorphous matrix was directly monitored,and the contribution from the phase transformation of the metastable austenitic phase was revealed.Local shear strain was found to be effectively consumed by the displacive phase transformation of the metastable austenitic phase,which relaxed the local strain/stress concentration at the interface and thus greatly enhanced the plasticity of the TRIP-reinforced BMG composites.Our current study sheds light on in-depth understanding of the underlying deformation mechanism and the interplay between the amorphous matrix and the metastable crystalline phase during deformation,which is helpful for design of advanced BMG composites with further improved properties.展开更多
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
Alloys with a hexagonal close-packed(HCP)lattice often suffer from intrinsic brittleness due to their in-sufficient number of slip systems,which limits their practical uses.In this paper,nevertheless,we show that rema...Alloys with a hexagonal close-packed(HCP)lattice often suffer from intrinsic brittleness due to their in-sufficient number of slip systems,which limits their practical uses.In this paper,nevertheless,we show that remarkably tensile ductility in HCP Hf-Zr-Ti medium entropy alloys(MEAs)was achieved,particu-larly in the MEAs with a higher content of Hf.Both first-principles calculation and experimental analyses reveal that addition of Hf increases basal I2 stacking fault energy and decreases prismatic stacking fault energy in these HCP MEAs,which promotes the source of pyramidal dislocations due to the facilitated cross slips of basal dislocations and eventually give rise to the observed large tensile ductility.Our current findings not only shed new insights into understanding deformation of HCP alloys,but also provide a basis for controlling alloying effects for developing novel HCP complex alloys with optimized properties.展开更多
Refractory high-entropy alloys have great potential to be utilized as high-temperature materials,and the repeatability and reproducibility of their mechanical properties are critical for practical applications.In this...Refractory high-entropy alloys have great potential to be utilized as high-temperature materials,and the repeatability and reproducibility of their mechanical properties are critical for practical applications.In this work,nevertheless,we found that the mechanical properties of the TiZrHfNb HEA greatly varied with the content of impurities in the samples even using high-purity raw materials.Specifically,the oxygen impurity is mainly responsible for the increment of the yield stress due to the strong interstitial hardening effect,whilst the ductility deterioration closely associates with the content of metalloid elements B,C,and Si.Our analysis reveals that the metalloid elements not only tend to segregate at grain boundaries but also enhance the aggregation of Zr and Ti.Such co-segregation induced the formation of strong(Zr,Ti)-metalloid bonds,resulting in grain boundary embrittlement and brittle fracture.Our current work demonstrates that the impurity contents in refractory HEAs need to be strictly controlled during production in order to improve their stability of mechanical performance.展开更多
In this letter,we briefly summarize experimental and theoretical findings of fo rmation and characterization of short-range orderings(SROs)as well as their effects on the defo rmation behavior of high-entropy alloys(H...In this letter,we briefly summarize experimental and theoretical findings of fo rmation and characterization of short-range orderings(SROs)as well as their effects on the defo rmation behavior of high-entropy alloys(HEAs).We show that existence of SROs is a common yet key structural feature of HEAs,and tuning the degree of SROs is an effective way for optimizing mechanical properties of HEAs.In additional,the challenges concerning about formation mechanism and characterization of SROs in HEAs are discussed,and future research activities in this regard are also proposed.展开更多
Searching for free-standing and cost-efficient hydrogen evolution reaction(HER)electrocatalysts with high efficiency and excellent durability remains a great challenge for the hydrogen-based energy industry.Here,we re...Searching for free-standing and cost-efficient hydrogen evolution reaction(HER)electrocatalysts with high efficiency and excellent durability remains a great challenge for the hydrogen-based energy industry.Here,we report fabrication of a unique hierarchically porous structure,i.e.,nanoporous Ni(NPN)/metallic glass(MG)composite,through surface dealloying of the specially designed Ni_(40)Zr_(40)Ti_(20)MG wire.This porous composite is composed of micrometer slits staggered with nanometer pores,which not only enlarges effective surface areas for the catalytic reaction,but also facilitates the release of H2 gas.As a result,the NPN/MG hybrid electrode exhibited the prominent HER performance with a low overpotential of 78 m V at 10 m A cm^(-2)and Tafel slope of 42.4 m V dec^(-1),along with outstanding stability in alkaline solutions.Outstanding catalytic properties,combining with their free-standing capability and cost efficiency,make the current composite electrode viable for HER applications.展开更多
Fe-based metallic glasses(MGs)have been extensively investigated due to their unique properties,especially the outstanding soft-magnetic properties.However,conventional design of soft-magnetic Fe-based MGs is heavily ...Fe-based metallic glasses(MGs)have been extensively investigated due to their unique properties,especially the outstanding soft-magnetic properties.However,conventional design of soft-magnetic Fe-based MGs is heavily relied on“trial and error”experiments,and thus difficult to balance the saturation flux density(Bs)and thermal stability due to the strong interplay between the glass formation and magnetic interaction.Herein,we report an eXtreme Gradient Boosting(XGBoost)machine-learning(ML)model for developing advanced Fe-based MGs with a decent combination of Bs and thermal stability.展开更多
1.Introduction As an ancient method for manufacturing metallic materials,casting has the advantages of low cost,high process flexibility and forming complex parts.However,due to the poor as-cast mechanical properties,...1.Introduction As an ancient method for manufacturing metallic materials,casting has the advantages of low cost,high process flexibility and forming complex parts.However,due to the poor as-cast mechanical properties,various processes after casting are generally necessary for traditional metallic materials to eliminate casting defects(e.g.,voids,shrinkage cavities and elemental segregation)and improve their properties,such as rolling,forging,and heat treatment.展开更多
基金financially supported by the National Natural Science Foundation of China(Nos.52061135207,51871016,51921001,11790293,and 51971017)111 Project(No.B07003)the Projects of SKL-AMM-USTB(Nos.2019Z-01 and 2018Z-19)。
文摘The coupling effects of the metastable austenitic phase and the amorphous matrix in a transformation-induced plasticity(TRIP)-reinforced bulk metallic glass(BMG)composite under compressive loading were investigated by employing the digital image correlation(DIC)technique.The evolution of local strain field in the crystalline phase and the amorphous matrix was directly monitored,and the contribution from the phase transformation of the metastable austenitic phase was revealed.Local shear strain was found to be effectively consumed by the displacive phase transformation of the metastable austenitic phase,which relaxed the local strain/stress concentration at the interface and thus greatly enhanced the plasticity of the TRIP-reinforced BMG composites.Our current study sheds light on in-depth understanding of the underlying deformation mechanism and the interplay between the amorphous matrix and the metastable crystalline phase during deformation,which is helpful for design of advanced BMG composites with further improved properties.
基金This work was financially supported by the National Natural Science Foundation of China(Nos.51671021,11790293,51871016,52071024,and 51961160729)the Funds for Creative Research Groups of China(No.51921001)+1 种基金the 111 Project(No.B07003)the Fundamental Research Funds for the Central Universities.
文摘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.
基金supported by the National Key Research and Development Program of China(2022YFB3705201)the National Natural Science Foundation of China(51971018 and U20B2025)+3 种基金the Funds for Creative Research Groups of National Natural Science Foundation of China(51921001)111 Project(BP0719004)the Program for Changjiang Scholars and Innovative Research Team in University of China(IRT_14R05)the Fundamental Research Funds for the Central Universities of China(FRF-MP-20-43Z)。
基金financially supported by the Funds for Creative Research Groups of China(51921001)the 111 Project(BP0719004)+1 种基金the Program for Changjiang Scholars,Innovative Research Team in University of China(IRT_14R05)the National Natural Science Foundation of China(11790293 and 51871016)。
基金supported by the National Natural Science Foundation of China(52071024,52271003,52101188)Guangdong Basic and Applied Basic Research Foundation(2020B1515120077)+4 种基金the Funds for Creative Research Groups of NSFC(51921001)the Projects of International Cooperation and Exchanges of NSFC(51961160729,52061135207)the 111 Project(BP0719004)the Program for Changjiang Scholars and Innovative Research Team in University of China(IRT_14R05)the Project funded by China Postdoctoral Science Foundation(2020M680009)。
基金supported by the National Natural Science Foundation of China(Nos.11790293,51871016,51671021,51971017,52122408,52071023,51901013)the Funds for Creative Research Groups of China(51921001)+3 种基金111 Project(BP0719004)Program for Changjiang Scholars and Innovative Research Team in University of China(IRT_14R05)financial support from the Fundamental Research Funds for the Central Universities of China(No.FRF-TP-18-004C1,No.FRF-BD-19-002B,respectively)financial support from Projects of SKLAMM-USTB(2019Z-01,2018-Z01,2022Z-09).
文摘Alloys with a hexagonal close-packed(HCP)lattice often suffer from intrinsic brittleness due to their in-sufficient number of slip systems,which limits their practical uses.In this paper,nevertheless,we show that remarkably tensile ductility in HCP Hf-Zr-Ti medium entropy alloys(MEAs)was achieved,particu-larly in the MEAs with a higher content of Hf.Both first-principles calculation and experimental analyses reveal that addition of Hf increases basal I2 stacking fault energy and decreases prismatic stacking fault energy in these HCP MEAs,which promotes the source of pyramidal dislocations due to the facilitated cross slips of basal dislocations and eventually give rise to the observed large tensile ductility.Our current findings not only shed new insights into understanding deformation of HCP alloys,but also provide a basis for controlling alloying effects for developing novel HCP complex alloys with optimized properties.
基金This research was financially supported by the National Natural Science Foundation of China(Nos.11790293,52225103,51871016,52271003,52071023,52122408,and 52225103)the Funds for Creative Research Groups of China(No.51921001)+2 种基金Project of International Cooperation and Exchanges NSFC(No.52061135207,51961160729)National Key Research and Development Program of China(2022YFB4602101)Joint Project of NSFC(No.U20B2025111).
文摘Refractory high-entropy alloys have great potential to be utilized as high-temperature materials,and the repeatability and reproducibility of their mechanical properties are critical for practical applications.In this work,nevertheless,we found that the mechanical properties of the TiZrHfNb HEA greatly varied with the content of impurities in the samples even using high-purity raw materials.Specifically,the oxygen impurity is mainly responsible for the increment of the yield stress due to the strong interstitial hardening effect,whilst the ductility deterioration closely associates with the content of metalloid elements B,C,and Si.Our analysis reveals that the metalloid elements not only tend to segregate at grain boundaries but also enhance the aggregation of Zr and Ti.Such co-segregation induced the formation of strong(Zr,Ti)-metalloid bonds,resulting in grain boundary embrittlement and brittle fracture.Our current work demonstrates that the impurity contents in refractory HEAs need to be strictly controlled during production in order to improve their stability of mechanical performance.
基金supported by the National Natural Science Foundation of China(Nos.51921001,51871016,51971017,51531001,51901013,and 51671021)111 Project(B07003)+3 种基金Program for Changjiang Scholars and Innovative Research Team in University of China(IRT-14R05)the Projects of SKLAMM-USTBthe financial support from the Fundamental Research Fund for the Central Universities(No.FRF-BD-19002B)National Key Basic Research Program,China(No.2016YFB0300502)。
文摘In this letter,we briefly summarize experimental and theoretical findings of fo rmation and characterization of short-range orderings(SROs)as well as their effects on the defo rmation behavior of high-entropy alloys(HEAs).We show that existence of SROs is a common yet key structural feature of HEAs,and tuning the degree of SROs is an effective way for optimizing mechanical properties of HEAs.In additional,the challenges concerning about formation mechanism and characterization of SROs in HEAs are discussed,and future research activities in this regard are also proposed.
基金supported by the National Natural Science Foundation of China (51671021,51961160729,1179029,51871016 and 51971017)the Funds for Creative Research Groups of China (51921001)+3 种基金111 Project (B07003)the Program for Changjiang Scholars and Innovative Research Team in University of China (IRT14R05)the Project of SKLAMM-USTB (2019Z-01)the Project supported by the State Key Laboratory of Powder Metallurgy,Central South University,Changsha,China。
基金supported by National Natural Science Foundation of China(Nos.11790293,51871016,51671018,51671021,and 51961160729)the Funds for Creative Research Groups of China(No.51921001)+3 种基金111 Project(B07003)the Program for Changjiang Scholars and Innovative Research Team in University of China(IRT 14R05)the Fundamental Research Funds for the Central Universities(Nos.FRF-GF-19-011A,FRF-TP-18-004C1,FRF-BD-19-002B,and FRF-TP19-054A2)partially supported by State Key Laboratory for Advanced Metals and Materials(2018Z-19)。
文摘Searching for free-standing and cost-efficient hydrogen evolution reaction(HER)electrocatalysts with high efficiency and excellent durability remains a great challenge for the hydrogen-based energy industry.Here,we report fabrication of a unique hierarchically porous structure,i.e.,nanoporous Ni(NPN)/metallic glass(MG)composite,through surface dealloying of the specially designed Ni_(40)Zr_(40)Ti_(20)MG wire.This porous composite is composed of micrometer slits staggered with nanometer pores,which not only enlarges effective surface areas for the catalytic reaction,but also facilitates the release of H2 gas.As a result,the NPN/MG hybrid electrode exhibited the prominent HER performance with a low overpotential of 78 m V at 10 m A cm^(-2)and Tafel slope of 42.4 m V dec^(-1),along with outstanding stability in alkaline solutions.Outstanding catalytic properties,combining with their free-standing capability and cost efficiency,make the current composite electrode viable for HER applications.
基金This research was supported by National Natural Science Foundation of China(Nos.51671018,51671021,51531001,11790923,and 51961160729)the Funds for Creative Research Groups of China(No.51921001),Program for Changjiang Scholars and Innovative Research Team in University of China(No.IRT_14R05)+3 种基金National Key Basic Research Program China(No.2016YFB0300502)the Fundamental Research Fund for the Central Universities(Nos.FRF-GF-19-011A and FRF-BD-19-002B)X.J.L.is grateful to the financial support from the Projects of SKLAMM-USTB(2018Z-19)HXL appreciates the financial support from the Natural Science Foundation of Beijing,China(Grant No.2202033).
文摘Fe-based metallic glasses(MGs)have been extensively investigated due to their unique properties,especially the outstanding soft-magnetic properties.However,conventional design of soft-magnetic Fe-based MGs is heavily relied on“trial and error”experiments,and thus difficult to balance the saturation flux density(Bs)and thermal stability due to the strong interplay between the glass formation and magnetic interaction.Herein,we report an eXtreme Gradient Boosting(XGBoost)machine-learning(ML)model for developing advanced Fe-based MGs with a decent combination of Bs and thermal stability.
基金supported by the National Natural Science Foundation of China(Nos.11790293,51871016,52061135207,51671021,51971017)the Funds for Creative Research Groups of China(51921001)+1 种基金111 Project(BP0719004)Program for Changjiang Scholars and Innovative Research Team in University of China(IRT_14R05)。
文摘1.Introduction As an ancient method for manufacturing metallic materials,casting has the advantages of low cost,high process flexibility and forming complex parts.However,due to the poor as-cast mechanical properties,various processes after casting are generally necessary for traditional metallic materials to eliminate casting defects(e.g.,voids,shrinkage cavities and elemental segregation)and improve their properties,such as rolling,forging,and heat treatment.
