Designing high-performance high-entropy alloys(HEAs)with transformation-induced plasticity(TRIP)or twinning-induced plasticity(TWIP)effects requires precise control over stacking fault energy(SFE)and phase stability.H...Designing high-performance high-entropy alloys(HEAs)with transformation-induced plasticity(TRIP)or twinning-induced plasticity(TWIP)effects requires precise control over stacking fault energy(SFE)and phase stability.However,the vast complexity of multicomponent systems poses a major challenge for identifying promising candidates through conventional experimental or computational methods.A high-throughput CALPHAD framework is developed to identify compositions with potential TWIP/TRIP behaviors in the Cr-Co-Ni and Cr-Co-Ni-Fe systems through systematic screening of stacking fault energy(SFE),FCC phase stability,and FCC-to-HCP transition temperatures(T0).The approach combines TC-Python automation with parallel Gibbs energy calculations across hundreds of thousands of compositions,enabling efficient extraction of metastable FCC-dominant alloys.The high-throughput results find 214 compositions with desired properties from 160,000 candidates.Detailed analysis of the Gibbs energy distributions,phase fraction trends,and temperature-dependent SFE evolution reveals critical insights into the thermodynamic landscape governing plasticity mechanisms in HEAs.The results show that only a narrow region of the compositional space satisfies all screening criteria,emphasizing the necessity of an integrated approach.The screened compositions and trends provide a foundation for targeted experimental validation.Furthermore,this work demonstrates a scalable,composition-resolved strategy for predicting deformation mechanisms in multicomponent alloys and offers a blueprint for integrating thermodynamic screening with mechanistic understanding in HEA design.展开更多
Graphene(Gr)reinforced high-entropy alloy(HEA)matrix composites are expected as potential candidates for next-generation structural applications in light of outstanding mechanical properties.A deep comprehension of th...Graphene(Gr)reinforced high-entropy alloy(HEA)matrix composites are expected as potential candidates for next-generation structural applications in light of outstanding mechanical properties.A deep comprehension of the underlying deformation mechanisms under extreme shock loading is of paramount importance,however,remains lacking due to experimentally technical limitations in existence.In the present study,by means of nonequilibrium molecular dynamics simulations,dynamic deformation behaviors and corresponding mechanisms in equiatomic FeNiCrCoCu HEA/Gr composite systems were investigated in terms of various shock velocities.The resistance to dislocation propagation imparted by Gr was corroborated to encourage the elevated local stress level by increasing the likelihood of dislocation interplays,which facilitated the onset of twins and hexagonal close-packed(HCP)martensite laths.Meanwhile,the advent of Gr was demonstrated to endow the HEA with an additional twinning pathway that induced a structural conversion from HCP to parent face-centered cubic(FCC)inside HCP martensite laths,different from the classical one that necessitated undergoing the intermediate procedure of extrinsic stacking fault(ESF)evolution.More than that,by virtue of an increase in flow stress,the transformation-induced plasticity(TRIP)effect was validated to be additionally evoked as the predominant strain accommodation mechanism at higher strains on the one hand,but which only assisted plasticity in pure systems,and on the other hand,can also act as an auxiliary regulation mode together with the twinning-induced plasticity(TWIP)effect under intermediate strains,but with enhanced contributions relative to pure systems.One may expect that TRIP and TWIP effects promoted by introducing Gr would considerably inspire a synergistic effect between strength and ductility,contributing to the exceptional shock-resistant performance of FeNiCrCoCu HEAs under extreme regimes.展开更多
Metastable β-Ti alloys exhibiting twinning-induced plasticity (TWIP) and transformation-induced plasticity (TRIP) generally have excellent ductility, but typically at the expense of relatively low yield strengths whi...Metastable β-Ti alloys exhibiting twinning-induced plasticity (TWIP) and transformation-induced plasticity (TRIP) generally have excellent ductility, but typically at the expense of relatively low yield strengths which has restricted their widespread use. Our work shows that interstitial oxygen can be employed to regulate β phase stability to significantly enhance both strength and ductility of TWIP/TRIP alloys. For a Ti-32Nb wt.% base alloy, inclusion of 0.3 wt.% O enhanced ductility by more than 140 %, reaching up to 54 % strain, and improved the tensile yield strength by over 95 % to 632 MPa. Compared to other common engineering alloys such as Ti-45Nb, elongation was increased by 29 %, and the yield strength increased by 182 MPa, respectively. Here, we elucidate on impacts of oxygen doping on TWIP/TRIP behaviors in the Ti-32Nb alloy. We reveal that oxygen regulates the critical stress for martensitic transformation, twinning, and dislocation slip. At lower oxygen doping concentrations (≤0.3 wt.% O), multi-stage martensitic transformation and martensitic twinning resulted in high ductility. In higher oxygen content alloys (≥0.5 wt.% O), deformation occurred initially via twinning, while strain induced martensite was subsequently induced in retained β phase regions. Oxygen concentrations control the deformation mechanisms, providing a flexible means to synergistically balance an alloy's strength and ductility. The use of oxygen to enhance stability of the β phase and regulate deformation behaviors is a promising new approach for creating high-performance TWIP/TRIP metastable β-Ti alloys with outstanding mechanical properties.展开更多
The tensile behavior of(Fe_(50)Mn_(30)Co_(10)Cr_(10))_(100-x)Si_(x)(x=0(Si0),2(Si2))metastable HEAs prepared by selective laser melting was studied at cryogenic temperatures.The results demonstrate that the addition o...The tensile behavior of(Fe_(50)Mn_(30)Co_(10)Cr_(10))_(100-x)Si_(x)(x=0(Si0),2(Si2))metastable HEAs prepared by selective laser melting was studied at cryogenic temperatures.The results demonstrate that the addition of Si leads to lattice distortion and a decrease in stacking fault energy,especially at 77 K,which significantly promotes transformation-induced plasticity(TRIP)in Si2 HEAs.The yield strength,tensile strength,and ductility of Si2 HEAs are 505.2 MPa,1364.1 MPa,and 19%,which are 43%,53% and 58% higher than those of Si0 alloy,respectively.TRIP is the main deformation mode,in addition to dislocation slip,and plays a key role in strengthening.The reinforced and continuously sustained TRIP maintains a dynamic strain distribution during deformation.Ultrahigh strain hardening greatly enhances the strength and ductility.展开更多
Warm deformation tests were performed using a kind of tubby heater. The microstructures and mechanical properties of an Fe-C-Mn-Si multiphase steel resulting from different warm deformation temperatures were investiga...Warm deformation tests were performed using a kind of tubby heater. The microstructures and mechanical properties of an Fe-C-Mn-Si multiphase steel resulting from different warm deformation temperatures were investiga- ted by using LOM （light optical microscopy）, SEM and XRD. The results indicated that the microstructure contai- ning polygonal ferrite, granular bainite and a significant amount of the stable retained austenite can be obtained through hot deformation and subsequent austempering. Warm deformation temperature affects the mechanical prop- erties of the hot rolled TRIP steels. Ultimate tensile strength balance reached maximum （881 MPa） when the speci- men was deformed at 250 ~C, and the total elongation and strength-ductility reached maximum （38% and 28 614 MPa ~ ~, respectively） at deforming temperature of 100 ~C. Martensite could nucleate when austenite was deformed above M~, because mechanical driving force compensates the decrease of chemical driving force. The TRIP effect occurs in the Fe-C-Mn-Si multiphase steel at deforming temperature ranging from 15 to 350 ~C. The results of the effects of warm deformation on the mechanical properties of the Fe-C-Mn-Si multiphase steel can provide theoretical basis for the ap- plications and the warm working of the hot rolled TRIP sheet steels in industrial manufacturing.展开更多
基金supported by the U.S.Army Research Laboratory through their award#W911NF-22-2-0040the Ministry of Education,Youth and Sports of the Czech Republic through the e-INFRA CZ(ID:90254).
文摘Designing high-performance high-entropy alloys(HEAs)with transformation-induced plasticity(TRIP)or twinning-induced plasticity(TWIP)effects requires precise control over stacking fault energy(SFE)and phase stability.However,the vast complexity of multicomponent systems poses a major challenge for identifying promising candidates through conventional experimental or computational methods.A high-throughput CALPHAD framework is developed to identify compositions with potential TWIP/TRIP behaviors in the Cr-Co-Ni and Cr-Co-Ni-Fe systems through systematic screening of stacking fault energy(SFE),FCC phase stability,and FCC-to-HCP transition temperatures(T0).The approach combines TC-Python automation with parallel Gibbs energy calculations across hundreds of thousands of compositions,enabling efficient extraction of metastable FCC-dominant alloys.The high-throughput results find 214 compositions with desired properties from 160,000 candidates.Detailed analysis of the Gibbs energy distributions,phase fraction trends,and temperature-dependent SFE evolution reveals critical insights into the thermodynamic landscape governing plasticity mechanisms in HEAs.The results show that only a narrow region of the compositional space satisfies all screening criteria,emphasizing the necessity of an integrated approach.The screened compositions and trends provide a foundation for targeted experimental validation.Furthermore,this work demonstrates a scalable,composition-resolved strategy for predicting deformation mechanisms in multicomponent alloys and offers a blueprint for integrating thermodynamic screening with mechanistic understanding in HEA design.
基金funded by the National Natural Science Foundation of China(Nos.92266206,52227810)Jilin Province Science and Technology Development Plan(No.YDZJ202101ZYTS129)the Fundamental Research Funds for the Central Universities(No.2022-JCXK-11).
文摘Graphene(Gr)reinforced high-entropy alloy(HEA)matrix composites are expected as potential candidates for next-generation structural applications in light of outstanding mechanical properties.A deep comprehension of the underlying deformation mechanisms under extreme shock loading is of paramount importance,however,remains lacking due to experimentally technical limitations in existence.In the present study,by means of nonequilibrium molecular dynamics simulations,dynamic deformation behaviors and corresponding mechanisms in equiatomic FeNiCrCoCu HEA/Gr composite systems were investigated in terms of various shock velocities.The resistance to dislocation propagation imparted by Gr was corroborated to encourage the elevated local stress level by increasing the likelihood of dislocation interplays,which facilitated the onset of twins and hexagonal close-packed(HCP)martensite laths.Meanwhile,the advent of Gr was demonstrated to endow the HEA with an additional twinning pathway that induced a structural conversion from HCP to parent face-centered cubic(FCC)inside HCP martensite laths,different from the classical one that necessitated undergoing the intermediate procedure of extrinsic stacking fault(ESF)evolution.More than that,by virtue of an increase in flow stress,the transformation-induced plasticity(TRIP)effect was validated to be additionally evoked as the predominant strain accommodation mechanism at higher strains on the one hand,but which only assisted plasticity in pure systems,and on the other hand,can also act as an auxiliary regulation mode together with the twinning-induced plasticity(TWIP)effect under intermediate strains,but with enhanced contributions relative to pure systems.One may expect that TRIP and TWIP effects promoted by introducing Gr would considerably inspire a synergistic effect between strength and ductility,contributing to the exceptional shock-resistant performance of FeNiCrCoCu HEAs under extreme regimes.
基金supported by the Key R&D Program of Zhejiang(No.KZ7240079).
文摘Metastable β-Ti alloys exhibiting twinning-induced plasticity (TWIP) and transformation-induced plasticity (TRIP) generally have excellent ductility, but typically at the expense of relatively low yield strengths which has restricted their widespread use. Our work shows that interstitial oxygen can be employed to regulate β phase stability to significantly enhance both strength and ductility of TWIP/TRIP alloys. For a Ti-32Nb wt.% base alloy, inclusion of 0.3 wt.% O enhanced ductility by more than 140 %, reaching up to 54 % strain, and improved the tensile yield strength by over 95 % to 632 MPa. Compared to other common engineering alloys such as Ti-45Nb, elongation was increased by 29 %, and the yield strength increased by 182 MPa, respectively. Here, we elucidate on impacts of oxygen doping on TWIP/TRIP behaviors in the Ti-32Nb alloy. We reveal that oxygen regulates the critical stress for martensitic transformation, twinning, and dislocation slip. At lower oxygen doping concentrations (≤0.3 wt.% O), multi-stage martensitic transformation and martensitic twinning resulted in high ductility. In higher oxygen content alloys (≥0.5 wt.% O), deformation occurred initially via twinning, while strain induced martensite was subsequently induced in retained β phase regions. Oxygen concentrations control the deformation mechanisms, providing a flexible means to synergistically balance an alloy's strength and ductility. The use of oxygen to enhance stability of the β phase and regulate deformation behaviors is a promising new approach for creating high-performance TWIP/TRIP metastable β-Ti alloys with outstanding mechanical properties.
基金supported by Program for Innovative Research Team in Science and Technology in Fujian Province University,Chinathe Natural Science Foundation of Fujian Province,China(Nos.2023J011013,2020J01898)。
文摘The tensile behavior of(Fe_(50)Mn_(30)Co_(10)Cr_(10))_(100-x)Si_(x)(x=0(Si0),2(Si2))metastable HEAs prepared by selective laser melting was studied at cryogenic temperatures.The results demonstrate that the addition of Si leads to lattice distortion and a decrease in stacking fault energy,especially at 77 K,which significantly promotes transformation-induced plasticity(TRIP)in Si2 HEAs.The yield strength,tensile strength,and ductility of Si2 HEAs are 505.2 MPa,1364.1 MPa,and 19%,which are 43%,53% and 58% higher than those of Si0 alloy,respectively.TRIP is the main deformation mode,in addition to dislocation slip,and plays a key role in strengthening.The reinforced and continuously sustained TRIP maintains a dynamic strain distribution during deformation.Ultrahigh strain hardening greatly enhances the strength and ductility.
基金Sponsored by National Natural Science Foundation of China (50334010)
文摘Warm deformation tests were performed using a kind of tubby heater. The microstructures and mechanical properties of an Fe-C-Mn-Si multiphase steel resulting from different warm deformation temperatures were investiga- ted by using LOM （light optical microscopy）, SEM and XRD. The results indicated that the microstructure contai- ning polygonal ferrite, granular bainite and a significant amount of the stable retained austenite can be obtained through hot deformation and subsequent austempering. Warm deformation temperature affects the mechanical prop- erties of the hot rolled TRIP steels. Ultimate tensile strength balance reached maximum （881 MPa） when the speci- men was deformed at 250 ~C, and the total elongation and strength-ductility reached maximum （38% and 28 614 MPa ~ ~, respectively） at deforming temperature of 100 ~C. Martensite could nucleate when austenite was deformed above M~, because mechanical driving force compensates the decrease of chemical driving force. The TRIP effect occurs in the Fe-C-Mn-Si multiphase steel at deforming temperature ranging from 15 to 350 ~C. The results of the effects of warm deformation on the mechanical properties of the Fe-C-Mn-Si multiphase steel can provide theoretical basis for the ap- plications and the warm working of the hot rolled TRIP sheet steels in industrial manufacturing.
