Machine learning-assisted efficient design of Cu-based shape memory alloy with specific phase transition temperature

The martensitic transformation temperature is the basis for the application of shape memory alloys(SMAs),and the ability to quickly and accurately predict the transformation temperature of SMAs has very important practical significance.In this work,machine learning(ML)methods were utilized to accelerate the search for shape memory alloys with targeted properties(phase transition temperature).A group of component data was selected to design shape memory alloys using reverse design method from numerous unexplored data.Component modeling and feature modeling were used to predict the phase transition temperature of the shape memory alloys.The experimental results of the shape memory alloys were obtained to verify the effectiveness of the support vector regression(SVR)model.The results show that the machine learning model can obtain target materials more efficiently and pertinently,and realize the accurate and rapid design of shape memory alloys with specific target phase transition temperature.On this basis,the relationship between phase transition temperature and material descriptors is analyzed,and it is proved that the key factors affecting the phase transition temperature of shape memory alloys are based on the strength of the bond energy between atoms.This work provides new ideas for the controllable design and performance optimization of Cu-based shape memory alloys.

Effect of solution treatment on the microstructure,phase transformation behavior and functional properties of NiTiNb ternary shape memory alloys fabricated via laser powder bed fusion in-situ alloying

Post-heat treatment is commonly employed to improve the microstructural homogeneity and enhance the mechanical performances of the additively manufactured metallic materials.In this work,a ternary(NiTi)91Nb9(at.%)shape memory alloy was produced by laser powder bed fusion(L-PBF)using pre-alloyed NiTi and elemental Nb powders.The effect of solution treatment on the microstructure,phase transformation behavior and mechanical/functional performances was investigated.The in-situ alloyed(NiTi)91Nb9 alloy exhibits a submicron cellular-dendritic structure surrounding the supersaturated B2-NiTi matrix.Upon high-temperature(1273 K)solution treatment,Nb-rich precipitates were precipitated from the supersaturated matrix.The fragmentation and spheroidization of the NiTi/Nb eutectics occurred during solution treatment,leading to a morphological transition from mesh-like into rod-like and sphere-like.Coarsening of theβ-Nb phases occurred with increasing holding time.The martensite transformation temperature increases after solution treatment,mainly attributed to:(i)reduced lattice distortion due to the Nb expulsion from the supersaturated B2-NiTi,and(ii)the Ti expulsion from theβ-Nb phases that lowers the ratio Ni/Ti in the B2-NiTi matrix,which resulted from the microstructure changes from non-equilibrium to equilibrium state.The thermal hysteresis of the solutionized alloys is around 145 K after 20%pre-deformation,which is comparable to the conventional NiTiNb alloys.A short-term solution treatment(i.e.at 1273 K for 30 min)enhances the ductility and strength of the as-printed specimen,with the increase of fracture stress from(613±19)MPa to(781±20)MPa and the increase of fracture strain from(7.6±0.1)%to(9.5±0.4)%.Both the as-printed and solutionized samples exhibit good tensile shape memory effects with recovery rates>90%.This work suggests that post-process heat treatment is essential to optimize the microstructure and improve the mechanical performances of the L-PBF in-situ alloyed parts.

Improving comprehensive properties of Cu-11.9Al-2.5Mn shape memory alloy by adding multi-layer graphene carried by Cu_(51)Zr_(14)inoculant particles

In order to improve the comprehensive properties of the Cu-11.9Al-2.5Mn shape memory alloy(SMA),multilayer graphene(MLG)carried by Cu_(51)Zr_(14)inoculant particles was incorporated and dispersed into this alloy through preparing the preform of the cold-pressed MLG-Cu_(51)Zr_(14)composite powders.In the resultant novel MLG/Cu-Al-Mn composites,MLG in fragmented or flocculent form has a good bonding with the Cu-Al-Mn matrix.MLG can prevent the coarsening of grains of the Cu-Al-Mn SMA and cause thermal mismatch dislocations near the MLG/Cu-Al-Mn interfaces.The damping and mechanical properties of the MLG/Cu-Al-Mn composites are significantly improved.When the content of MLG reaches 0.2 wt.%,the highest room temperature damping of 0.0558,tensile strength of 801.5 MPa,elongation of 10.8%,and hardness of HV 308 can be obtained.On the basis of in-depth observation of microstructures,combined with the theory of internal friction and strengthening and toughening theories of metals,the relevant mechanisms are discussed.

Laser powder bed fusion additive manufacturing of NiTi shape memory alloys: a review

NiTi alloys have drawn significant attentions in biomedical and aerospace fields due to their unique shape memory effect(SME),superelasticity(SE),damping characteristics,high corrosion resistance,and good biocompatibility.Because of the unsatisfying processabilities and manufacturing requirements of complex NiTi components,additive manufacturing technology,especially laser powder bed fusion(LPBF),is appropriate for fabricating NiTi products.This paper comprehensively summarizes recent research on the NiTi alloys fabricated by LPBF,including printability,microstructural characteristics,phase transformation behaviors,lattice structures,and applications.Process parameters and microstructural features mainly influence the printability of LPBF-processed NiTi alloys.The phase transformation behaviors between austenite and martensite phases,phase transformation temperatures,and an overview of the influencing factors are summarized in this paper.This paper provides a comprehensive review of the mechanical properties with unique strain-stress responses,which comprise tensile mechanical properties,thermomechanical properties(e.g.critical stress to induce martensitic transformation,thermo-recoverable strain,and SE strain),damping properties and hardness.Moreover,several common structures(e.g.a negative Poisson’s ratio structure and a diamond-like structure)are considered,and the corresponding studies are summarized.It illustrates the various fields of application,including biological scaffolds,shock absorbers,and driving devices.In the end,the paper concludes with the main achievements from the recent studies and puts forward the limitations and development tendencies in the future.

Meso-mechanical analyses of shape memory alloy wires reinforced smart structures with damages

The thermo-mechanical behaviors of shape memory alloy (SMA) wires reinforced smart structures with damages are analyzed through variational principle and meso-mechanical method.A governing equation on the structure is derived.Mathematical expressions on meso-displacement field,stress-strain field of typical element with damages are presented.A failure criterion for interface failure between SMA wires and matrix is established under two kinds of actuation which are dead-load and temperature,where the temperature is included in effective free restoring strain.In addition,there are some other composing factors in the failure criterion such as interface properties,thermodynamical properties of SMA,initial debonding length L-l,etc.The results are significant to understand structural strength self-adaptive control and failure mechanism of SMA wires reinforced smart structures with damages,and provide a theoretical foundation for further study on the integrity of SMA smart structures.

Tunable topological interface states and resonance states of surface waves based on the shape memory alloy

Topological interface state(TIS)of elastic wave has attracted significant research interest due to its potential prospects in strengthening acoustic energy and enhancing the signal accuracy of damage identification and quantification.However,previous implementations on the interface modes of surface waves are limited to the non-adjustable frequency band and unalterable mode width.Here,we demonstrate the tunable TIS and topological resonance state(TRS)of Rayleigh wave by using a shape memory alloy(SMA)stubbed semi-infinite one-dimensional(1D)solid phononic crystals(PnCs),which simultaneously possesses the adjustable mode width.The mechanism of tunability stems from the phase transformation of the SMA between the martensite at low temperature and the austenite at high temperature.The tunable TIS of Rayleigh wave is realized by combining two bandgap-opened PnCs with different Zak phases.The TRS with adjustable mode width is achieved in the heterostructures by adding PnCs with Dirac point to the middle of two bandgap-opened PnCs with different Zak phases,which exhibits the extraordinary robustness in contrast to the ordinary Fabry–Perot resonance state.This research provides new possibilities for the highly adjustable Rayleigh wave manipulation and find promising applications such as tunable energy harvesters,wide-mode filters,and high-sensitivity Rayleigh wave detectors.

Passive smart self-repairing concrete beams by using shape memory alloy wires and fibers containing adhesives

An innovative approach to increase structural survivability of concrete and maintain structural durability of concrete was developed in case of earthquakes and typhoons. This approach takes advantage of the superelastic effect of shape memory alloy(SMA) and the cohering characteristic of repairing adhesive. These SMA wires and brittle fibers containing adhesives were embedded into concrete beams during concrete casting to form smart reinforced concrete beams. The self-repairing capacity of smart concrete beams was investigated by three-point bending tests. The experimental results show that SMA wires add self-restoration capacity,the concrete beams recover almost completely after incurring an extremely large deflection and the cracks are closed almost completely by the recovery forces of SMA wires. The number or areas of SMA wires has no influence on the tendency of deformation during loading and the tendency of reversion by the superelasticity. The adhesives released from the broken-open fibers fill voids and cracks. The repaired damage enables continued function and prevents further degradation.

Surface Coating of NiTi Shape Memory Alloys with Calcium Phosphates by Dip-coating or Plasma-spraying-biological Characterization Examined by in vitro Testing Methods

The influence of different surface coatings of NiTi shape memory allays was examined using in vitro testing methods. Plates of superelastic nickel-titanium shape memory allay （ NiTi ） were coated with calcium phosphates （ hydroxyapatite ） by high-temperature plasma-spraying or by dip-coating. The biocompatibility was tested in vitro by cultivation of isolated human granulocytes and whole blood cells. As substrates, pure NiTi, plasma-spray-coated NiTi and dip-coated NiTi were used. Isolated granulocytes showed an increased adhesion to both calcium phosphate-coated NiTi samples. Compared to non-coated NiTi or dip-coated NiTi, the number of dead granulocytes adherent to plasma-sprayed surfaces was significantly increased （ p 〈 0.01 ）. Whether the d/f- ferences in apoptosis of granulocytes on dip-coated vs plasma-sprayed coatings observed are due to differences in material surface morphologies has to be analyzed in further studies. Because of the cellular interactions with the coating layers, h is likely that the results obtained are not caused by the underlying NiTi but due to the coating itself.

MESO-MECHANICAL ANALYSIS OF SHAPE MEMORY ALLOY REINFORCED SMART STRUCTURE WITH DAMAGE

The mechanical behaviors of shape memory alloy （SMA） wires reinforced smart structure with damage were analyzed through the variational principle, a governing equation for the structure was derived, mathematical expressions for the meso-displacement field, stressstrain field of typical element with damage were presented, and a failure criterion for interface failure between SMA wires and matrix was established under two kinds of actuation which are dead-load and temperature, where the temperature is included in effective free restoring strain. In addition, there are some other composing factors in the failure criterion such as the interface properties, dynamical properties of SMA, initial debonding length L - l etc. The results are significant to understand structural strength self-adapted control and failure mechanism of SMA wires reinforced smart structure with damage.

Piecewise Linear Analysis for Pseudo-elasticity of Shape Memory Alloy (SMA)

Based on the Brinson constitutive model of SMA, a piecewise linear model for the hysteresis loop of pseudo-elasticity is proposed and applied in the analysis of responses of an SMA-spring-mass system under initial velocity activation. The histories of displacement and velocity of the mass, and the response of stress of SMA are calculated with Brinson’s model and the piecewise linear model. The difference of results of the two models is not significant. The calculation with piecewise-linear model needs no iteration and is highly efficient.

STRUCTURAL HEALTH MONITORING IN COMPOSITE MATERIALS USING EMBEDDED SHAPE MEMORY ALLOY(SMA) WIRE SENSORS

Shape memory alloy （SMA） materials possess completely superelasticity or pseudoelasticity above the austenite finish temperature and many unique mechanical, thermal, thermal-mechanical and electrical properties compared with other conventional materials. Many studies have reported that the superelastic and hysteresis properties of the SMA materials can absorb energies coming from external excitations or sudden impacts. In addition, due to the special electrical properties of NiTi superelastic wires, they can also be used as strain-sensing element to monitor structural health conditions. Composite laminated specimens embedded with SMA wire sensors are fabricated and detailed testing system is designed such as multi-parameters measuring for impact and weak signal processing for SMA sensor. Low velocity impact test shows that SMA wire sensors embedded in fiber-reinforced plastic （FRP） laminate can be well used to monitor impact responses, such as the location of impact damage, impact degree, and strain distribution. Experimental results and theoretical predictions reveal almost the same. Comparing with other method, a simple, economic and reliable technique method monitoring important engineering structures on line is provided.

Modification of the Recovery Behavior of TiNi Shape Memory Alloy(SMA)by Chemical Heat Treatment

In order to improve the linear recovery behavior, TiNi shape memory alloy springs were samariumed at 550°C for 4 hours with SmH3 as samarium source, in a vacuum furnace. The phase of samariumed layer was determined by X-ray diffractometer (XRD). The fracture surface of TiNi SMA spring was investigated by scanning electronic microscope (SEM). The experimental results indicate that a thick samariumed layer composed of NiSm intermetallics existed on the fracture surface. Additionally, a new idea of linear recovery behavior in shape memory alloy (SMA) has been proposed, and its properties have been defined. The reversion measurements show that the linear recovery properties of TiNi SMA were obviously improved. The temperature range of the linear reversion (Tw) was enlarged from 4°C to 8’C, The ratio of linear reversion was increased from 54% to 75%, the proportion of linear reversion (PL) was increased from 56% to 70%, and the proportion of non-linear reversion (Ps) was decreased from 44% to 10%, but the proportion of total reversion (PT) has a little decrease. These results were attributed to the strengthening effect of NiSm intermetallics.

Effect of solution treatment and aging on microstructural evolution and mechanical behavior of NiTi shape memory alloy

As-received nickel-titanium （NiTi） shape memory alloy with a nominal composition of Ni50.9Ti49.1 （mole fraction,%） was subjected to solution treatment at 1123 K for 2 h and subsequent aging for 2 h at 573 K, 723 K and 873 K, respectively. The influence of solution treatment and aging on microstructural evolution and mechanical behavior of NiTi alloy was systematically investigated by transmission electron microscopy （TEM）, high resolution transmission electron microscopy （HRTEM）, scanning electron microscopy （SEM） and compression test. Solution treatment contributes to eliminating the Ti2Ni phase in the as-received NiTi sample, in which the TiC phase is unable to be removed. Solution treatment leads to ordered domain of atomic arrangement in NiTi alloy. In all the aged NiTi samples, the Ni4Ti3 precipitates, the R phase and the B2 austenite coexist in the NiTi matrix at room temperature, while the martensitic twins can be observed in the NiTi samples aged at 873 K. In the NiTi samples aged at 573 and 723 K, the fine and dense Ni4Ti3 precipitates distribute uniformly in the NiTi matrix, and thus they are coherent with the B2 matrix. However, in the NiTi sample aged at 873 K, the Ni4Ti3 precipitates exhibit the very inhomogeneous size, and they are coherent, semi-coherent and incoherent with the B2 matrix. In the case of aging at 723 K, the NiTi sample exhibits the maximum yield strength, where the fine and homogeneous Ni4Ti3 precipitates act as the effective obstacles against the dislocation motion, which results in the maximum critical resolved shear stress for dislocation slip.

Crystallization of amorphous NiTi shape memory alloy fabricated by severe plastic deformation

Based on the local canning compression,severe plastic deformation（SPD） is able to lead to the almost complete amorphous nickel-titanium shape memory alloy（NiTi SMA）,in which a small amount of retained nanocrystalline phase is embedded in the amorphous matrix.Crystallization of amorphous NiTi alloy annealed at 573,723 and 873 K was investigated,respectively.The crystallization kinetics of the amorphous NiTi alloy can be mathematically described by the Johnson-MehlAvrami-Kolmogorov（JMAK） equation.NiTi SMA with a complete nanocrystalline phase is obtained in the case of annealing at 573 K and 723 K,where martensite phase transformation is suppressed due to the constraint of the grain boundaries.Crystallization of amorphous NiTi alloy at 873 K leads to the coarse-grained NiTi sample,where（001） martensite compound twin is observed at room temperature.It can be found that the martensitic twins preferentially nucleate at the grain boundary and they grow up towards the two different grains.SPD based on the local canning compression and subsequent annealing provides a new approach to obtain the nanocrystalline NiTi SMA.

Dynamic recovery and dynamic recrystallization of NiTi shape memory alloy under hot compression deformation

Mechanical behavior of nickel？titanium shape memory alloy（NiTi SMA） under hot deformation was investigated according to the true stress—strain curves of NiTi samples under compression at the strain rates of 0.001-1 s-1 and at the temperatures of 600？1000℃.Dynamic recovery and dynamic recrystallization of NiTi SMA were systematically investigated by microstructural evolution.The influence of the strain rates,the deformation temperatures and the deformation degree on the dynamic recovery and dynamic recrystallization of NiTi SMA was obtained as well.NiTi SMA was characterized by the combination of dynamic recovery and dynamic recrystallization at 600℃ and 700℃,but the complete dynamic recrystallization occurred at other deformation temperatures.Increasing the deformation temperatures or decreasing the stain rates leads to larger equiaxed grains.The deformation degree has an important influence on the dynamic recrystallization of NiTi SMA.There exists the critical deformation degree during the dynamic recrystallization of NiTi SMA,beyond which the larger deformation degree contributes to obtaining the finer equiaxed grains.

Effects of second phases on mechanical properties and martensitic transformations of ECAPed TiNi and Ti-Mo based shape memory alloys

TiNi and Ti-based shape memory alloys were processed by equal channel angular pressing （ECAP） at 673-773 K along Bc route to obtain ultrafine grains for increasing the strength of parent phase and improving the functional properties. The effects of both thermodynamically stable and metastable second phases on the mechanical properties and martensitic transformations of these alloys were investigated. It is found that thermodynamically stable Ti2Ni phase has no effect on martensitic transformation and superelasticity of Ti-rich TiNi alloy, thermodynamically stable α phase is harmful for ductility of Ti-Mo-Nb-V-Al alloy, but metastable Ti3Ni4 phase is effective for R phase transformation, martensitic transformation and superelasticity of Ni-rich TiNi alloy. The mechanisms of the second phases on the martensitic transformations and mechanical properties were discussed.

Influence of Ni_4Ti_3 precipitates on phase transformation of NiTi shape memory alloy

Ni Ti shape memory alloy samples were aged for 2 h at 573, 723 and 873 K, respectively. Two R-phase variants are observed in the Ni Ti samples aged at 573 and 723 K, where the orientation relationship between the two R-phase variants and the B2 matrix is determined. In the Ni Ti samples aged at 573 and 723 K, fine and homogeneous Ni4Ti3 precipitates are coherent with the B2 austenite matrix. The Ni4Ti3 particles precipitate in the grain interior and at the grain boundaries, where the heterogeneous Ni4Ti3 precipitates are coherent, semi-coherent and incoherent with the B2 matrix in the Ni Ti sample aged at 873 K. As for the Ni Ti sample aged at 873 K, one-stage phase transformation from B19＇ martensite to B2 austenite occurs on heating, but two-stage phase transformation of B2-R-B19＇ arises on cooling. The Ni Ti sample aged at 723 K shows two-stage phase transformation of B2-R-B19＇ on cooling as well, but exhibits two-stage phase transformation of B19＇-R-B2 on heating. The Ni Ti sample aged at 573 K exhibits three-stage transformation on cooling due to local stress inhomogeneity and local composition inhomogeneity around the Ni4Ti3 precipitates.

Plastic yielding of NiTi shape memory alloy under local canning compression

As a new attempt, local canning compression was applied in order to implement large plastic deformation of nickel-titanium shape memory alloy （NiTi SMA） at room temperature. The plastic mechanics of local canning compression of NiTi SMA was analyzed according to the slab method as the well as plastic yield criterion. Transmission electron microscopy （TEM）, high resolution transmission electron microscopy （HRTEM） and scanning electron microscopy （SEM） were used to study the microstructural evolution as well as deformation behavior of NiTi samples under local canning compression. Increasing the hydrostatic pressure with the increase in the outer diameters of the steel cans is responsible for suppressing the initiation and growth of the micro-cracks, which contributes to enhancing the plasticity ofNiTi SMA and avoiding the occurrence of brittle fracture. Plastic deformation of NiTi SMA under a three-dimensional compressive stress state meets von-Mises yield criterion at the true strains ranging from about 0.15 to 0.50, while in the case of larger plastic strain, von-Mises yield criterion is unable to be met since the amorphous phase arises in the deformed NiTi sample.

Influence of cooling rate on phase transformation and microstructure of Ti-50.9%Ni shape memory alloy

Heat treatment of Ti-50.9%Ni （mole fraction） alloy was studied by differential scanning calorimetry, X-ray diffraction, scanning electron microscopey and energy dispersive X-ray analysis to investigate the influence of cooling rate on transformation behavior and microstructures of NiTi shape memory alloy. The experimental results show that three-stage phase transformation can be induced at a very low cooling rate such as cooling in furnace. The cooling rate also has a great influence on the phase transformation temperatures. Both martensitic start transformation temperature （Ms） and martensitic finish transformation temperature （Mf） decrease with the decrease of the cooling rate, and decreasing the cooling rate contributes to enhancing the M→A austenite transformation temperature. The phase transformation hysteresis （Af-Mf） increases with the decrease of the cooling rate. Heat treatment is unable to eliminate the textures formed in hot working of NiTi sample, but can weaken the intensity of them. The cooling rate has little influence on the grain size.

Microstructure,mechanical and shape memory properties of Ti-55Ta-xSi biomedical alloys

The effects of Si addition on microstructures, mechanical and shape memory properties of Ti-55Ta biomedical alloy were investigated. The results show that the microstructures consist of mainly α′′ martensite and a little β phase, and the grain size decreases obviously with increasing Si addition. When x = 0.2, small （Ti, Ta）3Si precipitates are formed at grain boundaries. With further increasing Si content, the amount of the precipitates gradually increases. The tensile and yield strength of Ti-55Ta-xSi alloys gradually increase with increasing Si addition, whereas elongation decreases. Ti-55Ta-0.1Si alloy exhibits the lowest elastic modulus and the best shape memory recoverable strain. It is revealed that the refinement of grain and the precipitation of （Ti, Ta）3Si phase are responsible to the changes of their mechanical and shape memory properties.