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.

COUPLED NUMERICAL SIMULATION ON COLD ROLLER'S TEMPERATURE FIFLD-PHASE TRANSFORMATION - STRESS FIELD DURING ITS QUENCHING PSOCESS

Complicated changns occur inside the steel parts during quenching process. The abruptly changed boundary conditions make the temperature field,micro - structure and stress field change dramatically in very short time, and these variables take a contact interactions in the whole process. In this paper, a three dimensional non - linear mathematical model for queeching process has been founded and the numerical simulation on temperature field,microstructre and stress field has been realized.In the FEM analysis, the incremental iteration method is used to deal with such complicated nonlinear as boundary nonlinear, physical property nonlinear,transformation nonlinear etc.The effect of stress on transformation kinetics has been considered in the calculation of microstructure. In the stress field anal- ysis,a thermo- elasto - plastic model has been founded, which considers such factors as transforma- tion strain,transformation plastic strain, themal strain and the effect of temperature and transforma- tion on mechanical propertier etc. The transient temperature field, microstructure distribution and stress field of the roller on any time can be displayed vividly,and the cooling curve and the changes of stress on any position can also be given.

Effects of thermomechanical cycling on the shape memory behavior and transformation temperatures of a Ni50.2Ti49.8 alloy

The effects of thermomechanical cycling on the shape memory behavior and transformation temperatures of a Ni50.2Ti49.8 alloy under a constant applied stress of 300 MPa were investigated, k is believed that thermomechanical cycling induces defects such as dislocations, which evidently affect the shape memory behavior and transformation temperatures. The recovery strain decreases with increasing number of thermomechanical cycles, whereas the irreversible plastic strain increases, especially in the initial few cycles. The stored elastic strain energy has an important influence on transformation temperatures, the A5^σ decreases and the M5^σ increases with increasing number of thermomechanical cycles. The recovery strain, irreversible plastic strain, A5^σ , and M5^σ reach a saturation value after several cycles.

First-principles study on the effect of Hf content on martensitic transformation temperature of TiNiHf alloy

In this paper a first-principles study of the electronic structure and stability of B2 Ti1-xNiHfx （x = 0.2, 0.4, 0.6） and B19′ Ti1-xNiHfx（x = 0, 0.5） alloys is presented. The calculations are performed by the plane-wave pseudopotential method in the framework of the density functional theory with the generalized gradient approximation. This paper calculates the lattice parameters, density of states, charge density, and heats of formation. The results show that the electronic structure and stability of B2 Ti1-xNiHfx change gradually with Hf content. However, Hf content has little effect on the electronic structure and stability of B19′ Ti1-xNiHfx. The mechanism of the effect of Hf content on martensitic transformation temperature of TiNiHf alloys is studied from the electronic structure.

Factors Affecting Transformation Temperatures in Fe-Mn-Si-Cr-Ni Shape Memory Alloy

The effects of prestrain and annealing temperature on phase transformation temperatures in Fel4Mn5Si8Cr4Ni shape memory alloy have been studied. The results showed that when the annealing temperature was 673 K, both the At and the Ms temperatures increased appreciably as the prestrain increased, the As temperature increased slightly with increasing prestrain; the resistivity difference at 303 K between the heating and cooling curve also increased with increasing prestrain, which agreed with the recovery strain. The shape memory effect in Fe-Mn-Si-Cr-Ni shape memory alloy is caused by the stress-induced γ→ε martensite transformation and its reverse transformation. When the prestrain was 10%, the Ms temperature decreased remarkably as the annealing temperature increased.

Effect of heat treatment on the transformation behavior and temperature memory effect in TiNiCu wires

The effect of heat treatment on the phase transformation behavior of TiNiCu shape memory alloy wires and the temperature memory effect in this alloy were investigated by the resistance method. These results showed that with increasing annealing temperature and annealing time, the phase transformation temperatures of TiNiCu wires were shifted to higher temperatures in the heating and cooling process. It was also found that incomplete thermal cycles, upon heating the TiNiCu wires, which were arrested at a temperature between the start and finish temperatures of the reverse martensite transformation, could induce a kinetic stop in the next complete thermal cycle. The kinetic stop temperature was closely related to the previous arrested temperature. This phenomenon was defined as the temperature memory effect. The result of this study was consistent with the previous report on the phenomenon obtained using the differential scanning calorimetry method, indicating that temperature memory effect was a common phenomenon in shape memory alloys.

MORPHOLOGY AND STRUCTURE OF TRANSFORMATION PRODUCTS FORMED AT INTERMEDIATE TEMPERATURE IN A Cu-Zn-Al ALLOY

A TTT diagram for th ie precipitation formed at some intermediate temperatures through cooling from high lemperalure parenl phase in a Cu-27 27Zn-3.73Al allay is established by means of dilatormetric measurement.The morphology and structure of transformation products formed at some intermediate tem peratures isothermally through cooling from high temperature parent phase and up-quenching from DO_(3) parent phase are studied by metallographic.X-ray and electron microscopy analyses.Three regions in the two separate C curves are obtained according to different morphology of precipitate:rod-like a,plate-like bainite and a rods,and bainite plates.Prolonged aging makes bainite plate change gradually into a whose lattice parameters are no different from that of a formed equilibriumly from parent phase.The structure is almost orthorhombic long period structure for bainites formed from B_(2) and DO_(3) parent phase,but monoclinic for martensite from DO_(3).They correspond to the overlapping and separating of(1210)and(2010)diffraction peaks respectively,showing the lower degree of ordering in bainite.

Thermodynamic analysis of β → α(α_2) phase transformation temperature in a Ti-Al-H alloy system

The T0 face equation of a Ti-Al-H alloy system was set up by the regular solution model,and the relationship between the β phase stabilizing parameter of hydrogen and the equilibrium phase compositions was attained.According to the T0 face equation and the thermodynamic parameters from literature,the effect of hydrogen on the β→α（α2） transformation temperature was evaluated.The calculated results were in a better consistence with the measured ones.

HYSTERESIS OF PHASE TRANSFORMATION TEMPERATURE IN NiTi SHAPE MEMORY ALLOY

The relationship between structure and hysteresis of phase transformation temperature in NiTi shape memory alloy has been investigated by means of TEM observation,positron an- nihilation and electrical resistivity measurement.The sequence of hysteresis for the alloy aged under different regimes was found to be:plate martensite>R-phase>tie-like martensite. The reversible displaeement of phase boundaries of these transformations is blocked by the co- herent stress field around Ti_(11)Ni_(14)phase particles.A linear relationship between S paramet- er of positron annihilation and maximum values of temperature hysteresis showed that the mismatch dislocation and elastic stress field established by Ti_(11)Ni_(14)phase precipitation are the main factor to determine the temperature hysteresis of phase transformation in NiTi shape memory alloy.

Relation between martensitic transformation temperature range and lattice distortion ratio of NiMnGaCoCu Heusler alloys

In order to study the relation between martensitic transformation temperature range AT （where AT is the difference between martensitic transformation start and finish temperature） and lattice distortion ratio （c/a） of martensitic transforma~ tion, a series of Ni46Mnz8_xGa22Co4Cux （x = 2-5） Heusler alloys is prepared by arc melting method. The vibration sample magnetometer （VSM） experiment results show that AT increases when x 〉 4 and decreases when x 〈 4 with x increasing, and the minimal AT （about 1 K） is found at x = 4. Ambient X-ray diffraction （XRD） results show that AT is proportional to c/a for non-modulated Ni46Mn28_xGa22Co4Cux （x = 2-5） martensites. The relation between AT and c/a is in agreement with the analysis result obtained from crystal lattice mismatch model. About 1000-ppm strain is found for the sample at x = 4 when heating temperature increases from 323 K to 324 K. These properties, which allow a modulation of AT and temperature-induced strain during martensitic transformation, suggest Ni46Mn24Ga22Co4Cu4 can be a promising actuator and sensor.

Improving the fatigue performance of longitudinal welded joints by low transformation temperature electrodes

For a longitudinal welded joint, the tensile residual stresses are as high as the yield stress of the metal, so that the weld toes are sensitive to fatigue load. In this case a low transformation temperature electrode (LTTE) is one of the most useful methods used to improve the fatigue strength of the longitudinal welded joint, because the tensile residual stress is reduced or changed into compressive stress. Three kinds of longitudinal welded joints were selected to conduct fatigue tests. The tests results show that the fatigue strengths at 2×10 6 cycles of the joints welded with LTTE were improved by 41%, 47% and 59% respectively compared with those of the joints welded with E5015, and the fatigue lives at 162 MPa were improved by 9.9 times, 9.6 times and 46.8 times respectively. Furthermore, the LTTE method is not necessary to add process after welding and so that it can be valuable method to improve the fatigue performance of longitudinal welded joints.

Effect of Titanium on the Martensitic Transformation Temperature of Cu-14Al-4Ni Shape Memory Alloy Rapidly Solidified

The present research aimed to analyze the influence that different contents of titanium(x=0.5,0.6 and 0.7 wt.%)have on the martensitic transformation temperature of a Cu-14Al-4Ni(wt.%)SMA(shape memory alloy).The Cu-14Al-4Ni-xTi samples were casted in an arc-melting furnace and rapidly solidified.All samples underwent heat treatment in a tubular furnace at a temperature of 1,100°C for 30 min and water quenched at 25°C.Subsequently,samples were analyzed by SEM(scanning electron microscopy)with EDS(energy dispersive spectroscopy),XRD(X-ray diffraction)and DSC(differential scanning calorimeter).SEM images and XRD patterns showed that the presence of titanium modified the alloy’s microstructure,induced the formation of three titanium rich phases called“X”phase(CuNi2Ti,Cu3Ti and AlCu2Ti)and reduced the presence of the brittle phaseγ2(Cu9Al4)for samples with 0.6 and 0.7 wt.%Ti.The titanium added to the copper based SMA also functioned as a refiner,reducing GS(grain size)up to approximately 80%with the increase of Ti content.DSC results exhibited low enthalpy levels,hysteresis,as well as low start martensitic transformation temperatures.

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.

Extension of analytical model of solid-state phase transformation

Departing from an analytical phase transformation model, a new analytical approach to deduce transformed fraction for non-isothermal phase transformation was developed. In the new approach, the effect of the initial transformation temperature and the accurate ＂temperature integral＂ approximations are incorporated to obtain an extended analytical model. Numerical approach demonstrated that the extended analytical model prediction for transformed fraction and transformation rate is in good agreement with the exact numerical calculation. The new model can describe more precisely the kinetic behavior than the original analytical model, especially for transformation with relatively high initial transformation temperature. The kinetic parameters obtained from the new model are more accurate and reasonable than those from the original analytical model.

Transformation behavior and shape memory effect of Ti_(50-x)Ni_(48)Fe_2Nb_x alloys by aging treatment

The influence of aging treatment on transformation behavior and shape memory of the Ti 50_x Ni_(48) Fe_2 Nb_x(x=0,0.6,0.8,1.0,and 1.2) alloys was investigated using differential scanning calorimeter(DSC),mechanical drawing machine,and microhardness tester in this paper.It is indicated that the aging treatment has a significant effect on the phase transformation temperatures(M_s,M_f,M_p,A_s,A_f,and A_p) and microhardness of the samples.The phase transformation temperatures are found to decrease initially with the increasing aging temperature from 300 to 500 ℃ and increase with further increase of the aging temperature.The aging treatment at intermediate temperature between 400 and 500 ℃ results in an improved shape memory effect.In addition,the highest microhardness value is also obtained.

Temperature field distribution of burnt surrounding rock in UCG stope

In order to study temperature field distribution in burnt surrounding rock and to determine ranges of burnt surrounding rock, coal-wall coking cycle and heat influence in the underground coal gasification(UCG) stope, based on the Laplace transform and inversion formula, we studied the temperature analytical solution of one-dimensional unsteady heat conduction for multi-layer overlying strata under the first and the forth kinds of boundary conditions, and we also carried out a numerical simulation of twodimensional unsteady heat conduction by the COMSOL multiphysics. The results show that when the boundary temperature of surrounding rock has a linear decrease because of a directional movement of heat source in the UCG flame working face, the temperature in surrounding rock increases first and then decreases with time, the peak of temperature curve decreases gradually and its position moves inside surrounding rock from the boundary. In the surrounding rock of UCG stope, there is an envelope curve of temperature curve clusters. We analyzed the influence of thermophysical parameters on envelope curves and put forward to take envelope curve as the calculation basis for ranges of burnt surrounding rock, coal-wall coking cycle and heat influence. Finally, the concrete numerical values are given by determining those judgement standards and temperature thresholds, which basically tally with the field geophysical prospecting results.

Effect of Alloying Elements on Microstructure,Martensitic Transformation and Mechanical Properties of Ni-Mn Based Alloys

The microstructural features, shape memory behavior and mechanical properties of Ni-Mn based alloys were investigated by differential scanning calorimetry （DSC）, scanning electron microscopy （SEM）, transmission electron microscopy （TEM） and thermal cycling test under various stresses. The transformation temperatures shifted toward lower temperatures when adding a third element into the Ni-Mn system. The addition of 10 at. pct Fe increased considerably the mechanical properties exhibiting still high transformation temperatures. However, it was found that in NiMn40Fe10 alloy the martensitic transformation is not thermoelastic in nature. The mechanism of this transformation and the crystallography of Ni-Mn（50-x）-Fex （x=5, 7, 10, 20 at. pct） alloys are presented.

Preparation of ultrafine α-Al_2O_3 powders by catalytic sintering of ammonium aluminum carbonate hydroxide at low temperature

The precursor of ammonium aluminum carbonate hydroxide was synthesized by using aluminum sulfate（Al2（SO4）3） and ammonium carbonate（（NH4）2CO3）. The effects of α-Al2O3 seeds and mixture composed of α-Al2O3 and ammonium nitrate, as well as multiplex catalysts （AT） on phase transformation of alumina in sintering process were investigated respectively. The results show that the α-Al2O3 seeds and the mixture of α-Al2O3 and ammonium nitrate can lower the phase transformation temperature of α-Al2O3 to different extents while the particles obtained agglomerate heavily. AT has great potential synergistic effects on the phase transformation of alumina and reduces the phase transformation temperature of α-Al2O3 and the trends of necking-formation between particles. Therefore the dispersion of powder particles is improved significantly.

SOLID-STATE PHASE TRANSFORMATION OF WELDED METAL IN CONTROL OF WELDING DISTORTION PROCESS

Based on the tests of a build-up welding at plate edge (BWPE) and amulti-layer build-up welding on plate (MBWP), the article studies on the solid-state phasetransformations which affect welding distortion process and on the influence rule of transformationstarting temperature (TST) of welded metal to the welding residual distortion. The weldingdistortion can be decreased or controlled by the transformation volume expansion caused bysolid-state phase transformation of welded metal during the cooling. The test results of BWPE showthat when TST is at about 190 deg C, the bending distortion of welded specimen is the smallest, andits displacements at free end are decreased to 58 percent and 67 percent compared with those ofconventional welding electrodes A102 and E5015, which TST are less than room temperature and equalto 758 deg C respectively. The test results of MBWP show that when TST were at 100 approx 250 deg C.the welded specimen would appear reversible bending distortion compared with those of A102 andE5015. The maximum deflection value of reversible bending distortion in 8 mm thick plate is -2.94 mmat about 170 deg C of TST. The test results provide a valuable method to decrease or to controlwelding residual distortion.

StudyoffinestructureoftemperatureintheequatorialwesternPacificOceanwithwavelettransform

By using the wavelet transform (WT), we analysed part of the CTD data collected from the equatorialwestern Pacific Ocean, the results show that the temperature fine structure has selfsimilarity and may be describedwith fractal. The singularity exponents of temperature series and their probability distributions are also calculated. Theprobability distribution functions (pdfs) have nearly a universal form. The nonzero probability at negative exponentsimplies the possible existence of sigular points in the temperature profiles. When computing the averaged period of theWT,we find that the mean period of the WT of the temperature series has a power dependence on the transformscale a, i. e. , with ￣ 1 . This suggests that a simple dichomotous cascading mechanism may govern thefine-structure dynamics. In addtion, since the amplitudes of the wavelet transform is related with the strength of thetemperature fluctuations, the vertical distribution of fluctuation energy can be calculated by wavelet transform.Com-pared to the FFT spectrum, the WT spectrum is more smooth and is capable of giving more accurate spectral slopes.