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金属顶刊双语导读丨Acta Mater. Vol.201,Dec. 2021(下)

2021-02-02 来源:Goal Science

本期包含金属材料领域论文11篇,涵盖了高熵合金、镁合金、镁铝合金、形状记忆合金与金属铜等,国内科研单位包括国立清华大学、厦门大学、燕山大学、上海交通大学等(通讯作者单位)。

 

 

Vol. 201 目录

1. Enhancement of fatigue resistance by overload-induced deformation twinning in a CoCrFeMnNi high-entropy alloy

通过过载诱导形变孪晶增强CoCrFeMnNi高熵合金的抗疲劳性能

 

2. Torsional fatigue mechanisms of an A357-T6 cast aluminium alloy

A357-T6铸造铝合金的扭转疲劳机制

 

3. The evolution of dislocation loop and its interaction with pre-existing dislocation in He+-irradiated molybdenum: in-situ TEM observation and molecular dynamics simulation

 

He+辐照条件下钼中位错环的演化及其与位错相互作用原位TEM观察和分子动力学模拟

 

4. Lithium Cluster Segregation in Coherent Contraction Twin Boundaries of Magnesium Alloys

镁合金共格收缩孪晶界处的锂团簇偏析研究

 
5. Irradiation induced void spheroidization, shrinkage and migration in Cu at elevated temperatures: An in situ study

高温辐照诱导Cu中孔洞球化、收缩和迁移的原位研究

 
6. Mechanical instability and tensile properties of TiZrHfNbTa high entropy alloy at cryogenic temperatures

 

低温下TiZrHfNbTa高熵合金的力学不稳定性和拉伸性能研究

 
7.  Characterising Ion-Irradiated FeCr: Hardness, Thermal Diffusivity and Lattice Strain

 

离子辐照FeCr合金的硬度、热和晶格应变表征

 

8. Microstructure evolution of thin nickel films with embedded chromium oxide nanoparticles

嵌氧化铬纳米粒子镍薄膜的微观组织演变研究

 
9. An Asymmetric Elasto-Plastic Phase-Field Model for Shape Memory Effect, Pseudoelasticity and Thermomechanical Training in Polycrystalline Shape Memory Alloys

多晶形状记忆合金中形状记忆效应、伪弹性和热形变训练的非对称弹塑性相场模型

 
10. Atomistic study of grain-boundary segregation and grain-boundary diffusion in Al-Mg alloys

Al-Mg合金中晶界偏析和扩散的原子尺度研究
 

11. Topological model of type II deformation twinning in 10M Ni-Mn-Ga

10M Ni-Mn-Ga中的II型形变孪晶拓扑模型

 

 

ACTA

Vol. 201,Dec. 2021, P412-424

1. Enhancement of fatigue resistance by overload-induced deformation twinning in a CoCrFeMnNi high-entropy alloy

 

通过过载诱导形变孪晶增强CoCrFeMnNi高熵合金的抗疲劳性能

 

Tu-Ngoc Lam, Soo Yeol Lee, Nien-Ti Tsou, Hung-Sheng Chou, Bo-Hong Lai, Yao-Jen Chang, Rui Feng, Takuro Kawasaki, Stefanus Harjo, Peter K. Liaw, An-Chou YehMing-Jun Li, Ren-Fong Cai, Sheng-Chuan Lo h, E-Wen Huang

S.Y. Leesylee2012@cnu.ac.kr

E.-W. HuangEwenHUANG@nctu.edu.tw(台湾国立交通大学/国立清华大学)

https://doi.org/10.1016/j.actamat.2020.10.016

 

摘要

我们利用中子衍射技术,研究了CoCrFeMnNi高熵合金(HEAs)在疲劳和拉伸过载条件下的疲劳裂纹扩展行为。我们采用高分辨率透射电子显微技术(HRTEM)和中子衍射应变图谱对组织进行了表征。与疲劳状态相比,由于单次拉伸过载后疲劳抗增加,因此裂纹扩展被推迟载引起的大塑性变形、残余压应力和塑性区增大,以及裂纹尖端钝化和变形孪晶机制共同导致了这一行为。拉伸过载后,沿裂纹扩展方向出现明显的锯齿形断口。此外,在室温载条件下,塑性区的塑性变形机制由平面位错滑移为主变为孪晶为主,与有限元模拟结果一致。以上大晶粒尺寸CoCrFeMnNi合金的拉伸过载诱发效应为提高高强度材料的疲劳性能提供了理论依据。

向上滑动阅览英文摘要

 

We examined fatigue-crack-growth behaviors of CoCrFeMnNi high-entropy alloys (HEAs) under as-fatigued and tensile-overloaded conditions using neutron-diffraction measurements coupled with diffraction peak-profile analyses. We applied both high-resolution transmission electron microscopy(HRTEM) and neutron-diffraction strain mapping for the complementary microstructure examinations. Immediately after a single tensile overload, the crack-growth-retardation period was obtained by enhancing the fatigue resistance, as compared to the as-fatigued condition. The combined mechanisms of the overload-induced larger plastic deformation, the enlarged compressive residual stresses and plastic-zone size, the crack-tip blunting ahead of the crack tip, and deformation twinning governed the pronounced macroscopic crack-growth-retardation behavior following the tensile overload. A remarkable fracture surface of highly-periodic serrated features along the crack-propagation direction was found in the crack-growth region immediately after the tensile overload. Moreover, a transition of plastic deformation from planar dislocation slip-dominated to twinning-dominated microstructures in the extended plastic zone was clearly observed at room temperature in the overloaded condition, in accordance with the simulated results by a finite element method (FEM). The above tensile overload-induced simultaneously combined effects in the coarse-grained CoCrFeMnNi shed light on the improvement of fatigue resistance for HEAs applications.

 

 

 

ACTA

Vol. 201,Dec. 2021, P435-447

2. Torsional fatigue mechanisms of an A357-T6 cast aluminium alloy

A357-T6铸造铝合金的扭转疲劳机制

 

I. Serrano-Munoz, D. Shiozawa, S. Dancette, C. Verdu, J.-Y. Buffiere

I. Serrano-Munozitziar.serrano.munoz@gmail.com

J.-Y. Buffierejeanyves.buffiere@insa-lyon.fr

https://doi.org/10.1016/j.actamat.2020.09.046

 

摘要

我们研究了A357-T6铸造铝合金循环扭转载荷下疲劳响应机制。我们采用表面裂纹监测与背散电子衍射(EBSD)研究了裂纹的萌生;基于S-N曲线结合原位疲劳同步层析成像研究传了裂纹的扩展结果表明,断口形貌取决于应力水平。在中-低应力水平max < 100 MPa)下,晶粒组织决定了裂纹萌生和扩展周期。裂纹通常在接近或垂直于试样轴的滑移面以模式II核。裂纹扩展的早期以II型裂纹扩展为主,III型裂纹向内扩展显著减缓。这种行为导致了浅表面裂纹的形成。随着裂纹逐渐变长,模式III的驱动力超过了模式II,裂纹就会形成~ 45°的模式I分支

向上滑动阅览英文摘要

The mechanisms controlling the fatigue response of an A357-T6 cast aluminium alloy under cyclic torsional loading are investigated. Surface crack monitoring coupled with Electron BackScattering Diffraction (EBSD) analysis is used to study crack initiation. Determination of S-N curve combined with interrupted in situ fatigue testing using synchrotron tomography allows the study of the propagation behaviour. It is observed that fractographic morphologies depend on the stress level. At intermediate-low stress levels (τmax < 100 MPa), the grain structure controls the crack initiation and propagation periods. Cracks are usually nucleated in mode II from slip planes close to the specimen axis or perpendicular to it. Mode II crack growth dominates the early stages of crack propagation as mode III inward crack growth is rapidly decelerated. This behaviour leads to the formation of characteristic shallow surface cracks. Once the crack is long enough for the mode II driving force to be overtaken by mode III, propagation branches into  ~ 45° mode I.

 

 

 

ACTA

Vol. 201,Dec. 2021, P462-476

3. The evolution of dislocation loop and its interaction with pre-existing dislocation in He+-irradiated molybdenum: in-situ TEM observation and molecular dynamics simulation

He+辐照条件下钼中位错环的演化及其与位错相互作用原位TEM观察和分子动力学模拟

 

Yipeng Li, Guang Ran, Yijia Guo, Zhipeng Sun, Xinyi Liu, Yuanming Li, Xi Qiu, Yong Xin

G. Rangran@xmu.edu.cn (厦门大学/福建省核工程研究中心)

Z. Sunsuperszp@163.com (中国核电研究院,成都)

https://doi.org/10.1016/j.actamat.2020.10.022

 

摘要

我们采用原位TEM和分子动力学模拟,673 K30kev He+辐照条件下Mo中位错环的演化及其与位错线的相互作用进行了研究。我们详细研究了位错环的形核、湮没、合并、尺寸变化和类型,并分析了位错环导致的硬化效应。研究表明,随着氦离子注入量的增加,位错环的体积数密度迅速增大,随后缓慢减小,到达一平台值;同时,位错环的平均尺寸不断增大,直至达到上限。在3.95×1015 He+辐照下(对应0.07dpa), 组织中形成了1/2<111><100>位错环,占比分别60.2% 39.8%组织中预先存在的位错线会抑制位错环的形核长大,而辐照诱导的位错环对位错线有较强的钉扎作用,阻碍运动。通过分子动力学模拟,我们阐明了位错线与位错环相互作用的原子尺度机制,模拟结果与原位实验的观测结果基本一致。不同的相互作用过程主要取决于位错环所在平面和伯氏矢量、位错的运动、位错反应动力学外加载荷。

向上滑动阅览英文摘要

In-situ TEM observation and molecular dynamics simulation were used to investigate the evolution of irradiation-induced dislocation loops and their interactions with the pre-existing dislocation lines in molybdenum irradiated by 30 keV He+ at 673 K. The nucleation, annihilation, merging, size change, and types of dislocation loops were investigated in detail, and the hardening effect from dislocation loops was analyzed. With the increase of helium fluence, the volume number density of dislocation loops increased rapidly and then decreased slowly to a saturation value, while the average size of dislocation loops increased continuously until it reached an upper limit. Both 1/2<111> and <100> loops were formed, with a proportion of 60.2% to 39.8% at 3.95 × 1015 He+.cm−2 (0.07 dpa). The pre-existing dislocation lines would suppress the nucleation and growth of the dislocation loops, while the irradiation-induced dislocation loops had a strong pinning effect on the dislocation lines and impeded their motion. Molecular dynamics simulations were used to clarify the atomistic mechanisms of some major features of the line-loop interactions observed in the in-situ experiment, which showed in a good agreement. The different interaction processes depended on the Burgers vector and plane of the dislocation loop, the motion and reaction kinetics of dislocation segments, and the external loading.

 

 

 

ACTA

Vol. 201,Dec. 2021, P477-487

4. Lithium Cluster Segregation in Coherent Contraction Twin Boundaries of Magnesium Alloys

镁合金共格收缩孪晶界处的锂团簇偏析研究

 

Bingcheng Ge, Meng Yang, Qun Zu, Jianxin Guo, Yongjun Tian, Qiuming Peng

Q. Pengpengqiuming@ysu.edu.cn(燕山大学)

https://doi.org/10.1016/j.actamat.2020.10.041

 

摘要

孪晶界调控被认为是许多工程合金实现高强度高延性的潜在策略。本文中,我们Mg合金中一种独特的共格收缩孪晶界Li团簇偏析现象。我们通过透射电子显微镜对原子尺度的组织结构进行了表征。同时,通过第一性原理计算和分子动力学模拟分别阐明了偏析驱动力和强化机制。实验结果表明,具有六边形密排结构的偏聚Li原子团簇与收缩孪晶共格。理论计算表明,Li团簇倾向于占据收缩孪晶界的空位,并沿孪晶界优先生长。最后,动力学模拟和实验观察都表明,收缩孪晶界Li原子团簇的形成不仅能钉扎位错,达到类似析出强化的作用,而且能提高收缩孪晶界的临界剪切应变,抑制其形变宽化这种孪晶边界处的团簇偏聚现象在其他体系中也发现,这为通过孪晶界调控金属和陶瓷的力学性能开辟了一条重要途径。

向上滑动阅览英文摘要

Modification of twin boundaries has been deemed as a potential strategy to achieve high strength in combination with good ductility for many engineering alloys. Herein, we report a unique Li cluster segregation phenomenon in coherent contraction twin boundaries of Mg alloys. The structures at the atomic scale have been investigated by transmission electron microscopy. Meanwhile, the driving force for segregation and strengthening mechanisms have been elucidated by first-principles calculations and molecular dynamics simulations, respectively. Experimental results show that the segregated Li cluster with a hexagonal close-packed structure is coherent with a contraction twin. Subsequently, theoretical calculations reveal that the Li cluster is prone to occupy the interface vacancy in the contraction twin boundaries, following which it grows along the twin boundaries preferentially. Finally, both dynamics simulations and experimental observations demonstrate that the formation of Li cluster in contraction twin boundaries can not only directly pin dislocation movement analogous to precipitation strengthening, but also improve the critical shear strain of contraction twin boundaries, inhibiting their deformation or widening. The finding of cluster segregation in twin boundaries also occurs in other systems, which might open an avenue for twin boundary engineering to tune the mechanical properties of metals and ceramics.

 

 

 

ACTA

Vol. 201,Dec. 2021, P504-516

5. Irradiation induced void spheroidization, shrinkage and migration in Cu at elevated temperatures: An in situ study

高温辐照诱导Cu中孔洞球化、收缩和迁移的原位研究

 

Cuncai Fan, Rayaprolu Goutham Sreekar Annadanam, Zhongxia Shang, Jin Li, Meimei Li, Haiyan Wang, Anter El-Azab, Xinghang Zhang

C. Fancuncaifan@gmail.com

X.Zhangxzhang98@purdue.edu

https://doi.org/10.1016/j.actamat.2020.10.008

 

摘要

辐照诱发的孔洞形成通常会导致材料发生明显的体积膨胀和力学性能退化,因此了解辐照环境下孔洞演化具有重要意义。然而,关于纳米孔洞在高温辐照的原位研究目前仍然非常有限。在本研究中,我们对铜中的纳米孔洞演化进行了系统的TEM原位辐照实验,辐照粒子为1 MeV Kr++辐照温度最高350°C。原位研究揭示了孔洞的球化、收缩和迁移。此外,研究表明,纳米孔洞的形貌和迁移极大地受辐照温度和初始孔洞尺影响通过对辐照样品的分析,我们发现缺陷团簇通常以四面体层错和较大的多面体孔洞形式存在我们基于相场模型辐照导致的孔洞球化和收缩机理进行了讨论。

向上滑动阅览英文摘要

Understanding the void evolution in irradiation environment is of great interest and significance, as irradiation-induced voids typically lead to pronounced volumetric swelling and degradation of mechanical properties. In situ studies on the irradiation response of nanovoids at elevated temperature remain limited. In this work, we performed systematic in situ 1 MeV Kr++ irradiations on Cu with nanovoids in a transmission electron microscope up to 350 °C. The in situ studies revealed intriguing void spheroidization, shrinkage and migration. Furthermore, the morphology evolution and migration of nanovoids showed a strong dependence on irradiation temperature and initial void size. Post-irradiation analyses identified defect clusters in the form of stacking fault tetrahedrons, and the remaining large faceted nanovoids. The underlying mechanisms of irradiation-induced void spheroidization and shrinkage were discussed based on phase-field modeling.

 

 

 

 

ACTA

Vol. 201,Dec. 2021, P517-527

6.Mechanical instability and tensile properties of TiZrHfNbTa high entropy alloy at cryogenic temperatures

低温下TiZrHfNbTa高熵合金的力学不稳定性和拉伸性能研究

 

Shubin Wang, Mingxu Wu, Da Shu, Guoliang Zhu, Donghong Wang, Baode Sun

D. Shudshu@sjtu.edu.cn(上海交通大学)

B. Sunbdsun@sjtu.edu.cn(上海交通大学)

https://doi.org/10.1016/j.actamat.2020.10.044

 

摘要

等原子TiZrHfNbTa合金是为数不多的室温下具有较高拉伸塑性高熵合金之一,其变形机制主要是位错滑移。我们在低温拉伸变形过程中发现,随着位错的不断滑移,{112}<111>纳米孪晶被激活,同时发生BCC到非密排六方晶型的ω相变这表明单相BCC TiZrHfNbTa合金具有内在力学不稳定性。温度从277 K降低到77 K,合金屈服强度显著提高,达到1549 MPa,且没有发生明显的韧脆转变,保持了较高的伸长率20.8%。通过考虑螺位错滑移、{112}<111>机械孪晶和BCC→ω相变的协同效应,我们对合金在低温下表现出的高强高塑特性进行了解释。这些结果加深了我们对高熔点TiZrHfNbTa合金的理解,并且表明TiZrHfNbTa合金不仅在高温应用方面很有前景,在航空航天、海洋船舶和天然气等行业要求的极端低温环境下也有很大的应用潜力。

向上滑动阅览英文摘要

 

The equiatomic TiZrHfNbTa alloy is one of the few refractory high entropy alloys that exhibit tensile ductility at room temperature, the deformation of which is only dominated by dislocation slip. Here, we observed the activation of {112}<111> nano-twinning accompanied by the deformation induced body-centered cubic structure (BCC) to non-closed packed hexagonal ω phase transformation along with the dislocation slip during tensile deformation at cryogenic temperatures, which indicates the intrinsic mechanical instability of the single-phase BCC TiZrHfNbTa solid solution. The alloy maintains a high tensile elongation of 20.8% while the yield strength increases significantly up to 1,549 MPa as the temperature is decreased from 277 K to 77 K, without obvious ductile to brittle transition. This exceptional combination of high strength and high ductility at cryogenic temperatures can be interpreted by considering the synergistic effect of screw dislocation glide, {112} <111> mechanical twinning and BCC→ω phase transformation. These results provide new insights on our understanding of the refractory TiZrHfNbTa-based alloys and extend their application to cryogenic temperatures at the extreme service conditions like aerospace, marine shipbuilding and natural gas industries, albeit they are promising for high-temperature application.

 

 

 

ACTA

Vol. 201, Dec. 2021, P535-546

7.Characterising Ion-Irradiated FeCr: Hardness, Thermal Diffusivity and Lattice Strain

离子辐照FeCr合金的硬度、热和晶格应变表征

 

Kay Song, Suchandrima Das, Abdallah Reza, Nicholas W. Phillips, Ruqing Xu, Hongbing Yu, Kenichiro Mizohata, David E.J. Armstrong, Felix Hofmann

K. Songkay.song@eng.ox.ac.uk

D.E.J. Armstrongdavid.armstrong@materials.ox.ac.uk

F. Hofmannfelix.hofmann@eng.ox.ac.uk

https://doi.org/10.1016/j.actamat.2020.10.015

 

摘要

FeCr合金进行的离子辐照实验有助于我们理解和预测未来核反应堆结构钢的中子损伤。以往的研究主要集中辐照缺陷的TEM表征和力学性能变化方面。在这些研究中,研究人员对具有不同加工历史的样品进行了各种条件下的辐照实验,这使得对于缺陷和材料性能之间关系分析变得十分复杂、困难。此外,对于材料的某些关键性质,如热和晶格应变,几乎没有探讨。

 

鉴于以上原因,我们对Fe3CrFe5CrFe10Cr二元合金进行了系统的室温辐照实验研究辐照粒子为20MeV Fe3+损伤剂量分别为0.01 dpa0.1 dpa我们采用纳米压痕、瞬态光栅光谱(TGS)X射线衍射法研究了材料硬度、热扩散系数和应变随损伤程度Cr含量的变化规律。结果表明,Cr的增加将导致辐照缺陷增加,从而导致硬度和晶格应变发生显著变化。而材料的热扩散系数随损伤程度的增加变化不大,Cr含量的增加显著降低。此外,我们发现即使在名义损伤0.01 dpa的样品中,也存在显著的晶格应变。基于晶格应变预测的缺陷密度显著高于之前研究中TEM测结果,这表明TEM可能不能完全地表征辐照导致的缺陷。

向上滑动阅览英文摘要

 

Ion-irradiated FeCr alloys are useful for understanding and predicting neutron damage in the structural steels of future nuclear reactors. Previous studies have largely focused on the structure of irradiation-induced defects, probed by transmission electron microscopy (TEM), as well as changes in mechanical properties. Across these studies, a wide range of irradiation conditions has been employed on samples with different processing histories, which complicates the analysis of the relationship between defect structures and material properties. Furthermore, key properties, such as irradiation-induced changes in thermal transport and lattice strain, are little explored.

Here we present a systematic study of Fe3Cr, Fe5Cr and Fe10Cr binary alloys implanted with 20 MeV Fe3+ ions to nominal doses of 0.01 dpa and 0.1 dpa at room temperature. Nanoindentation, transient grating spectroscopy (TGS) and X-ray micro-beam Laue diffraction were used to study the changes in hardness, thermal diffusivity and strain in the material as a function of damage and Cr content. Our results suggest that Cr leads to an increased retention of irradiation-induced defects, causing substantial changes in hardness and lattice strain. However, thermal diffusivity varies little with increasing damage and instead degrades significantly with increasing Cr content in the material. We find significant lattice strains even in samples exposed to a nominal displacement damage of 0.01 dpa. The defect density predicted from the lattice strain measurements is significantly higher than that observed in previous TEM studies, suggesting that TEM may not fully capture the irradiation-induced defect population.

 

 

 

ACTA

Vol. 201, Dec. 2021, P561-571

8.Microstructure evolution of thin nickel films with embedded chromium oxide nanoparticles

嵌氧化铬纳米粒子镍薄膜的微观组织演变研究

 

Hagit Barda, Leonid Klinger, Eugen Rabkin

E. Rabkinerabkin@tx.technion.ac.il

https://doi.org/10.1016/j.actamat.2020.10.032

 

摘要

在本文中,我们提出了一种纳米陶瓷颗粒增强金属基复合薄膜的制备方法。为此,我们首先在蓝宝石衬底上沉积了20 nm Ni /超薄Cr氧化物层/ 20 nm Ni明治结构随后将其700℃下退火。研究发现,退火10 min后,Cr氧化物层中形成了单晶或双晶多面Cr2O3纳米颗粒,并与Ni基体形成了(11-1)Ni||(0006)Cr2O3和[112]Ni||[1-210]Cr2O3的取向关系。我们惊讶地发现Cr氧化物粒子的质心相对初始位置发生了垂直漂移。我们建立了颗粒形状演变和垂直漂移的动力学模型,从而Ni-Cr2O3界面的有效扩散系数进行了估计(Di=7.4·10−19m2/s)。尽管界面扩散比Ni中的晶界扩散慢得多,但这种界面扩散能够使超薄Cr氧化物层快速转变为嵌入Ni薄膜中的Cr2O3纳米颗粒阵列。以上研究结果对颗粒增强金属薄膜中粒子空间位置的精确调控具有重要意义

向上滑动阅览英文摘要

 

We developed a fabrication method of thin metal matrix composite films reinforced with ceramic nanoparticles. To this end, we deposited a 20 nm Ni / ultrathin Cr-oxide layer / 20 nm Ni tri-layer on a sapphire substrate, and annealed the sample at the temperature of 700°C. We found that after annealing for 10 min the Cr-oxide layer agglomerates into single- or bi-crystalline faceted Cr2O3 nanoparticles, with the orientation relationship of (11-1)Ni||(0006)Cr2O3 and [112]Ni||[1-210]Cr2O3 to the Ni matrix. We encountered a surprising vertical spread of the centers of mass of the Cr-oxide particles with respect to the initial position of the Cr-oxide layer. We developed a kinetic model of the evolution of particles shape and of their vertical drift, which enabled an estimate of the effective diffusion coefficient of the Ni-Cr2O3 interface (Di=7.4·10−19m2/s). Though much slower than grain boundary diffusion in Ni, this interface diffusion enables fast transformation of ultra-thin Cr-oxide layer into an array of isolated Cr2O3 nanoparticles embedded in the Ni film. The insight into the kinetics of the system obtained in the present work paves the way for the design of particle reinforcement of thin metal films with a precise control over the spatial positions of the particles.

 

 

 

ACTA

Vol. 201, Dec. 2021, P580-595

9. An Asymmetric Elasto-Plastic Phase-Field Model for Shape Memory Effect, Pseudoelasticity and Thermomechanical Training in Polycrystalline Shape Memory Alloys

多晶形状记忆合金中形状记忆效应、伪弹性和形变训练的非对称弹塑性相场模型

 

Cheikh Cissé, Mohsen Asle Zaeem

M. Asle Zaeemzaeem@mines.edu

https://doi.org/10.1016/j.actamat.2020.10.034

 

摘要

我们提出了一种弹塑性相场模型(PFM),首次对CuAlBe形状记忆合金(SMA)的形状记忆效应(SME)、伪弹性、应力辅助双向记忆效应(SATWME) 等特征进行了微观尺度的理论研究。这种非等温相场模型考虑了与温度相关材料性质、潜热、晶界以及非对称相变和塑性的影响。模拟结果表明,模型能够很好地模拟形状记忆效应中的热机械和纯机械形状恢复。由于晶界的作用,晶粒细化将导致更高的相变应力明显的相变硬化和更小的形状记忆和伪弹性的滞回线。模拟结果还指出,采用几何晶界进行模拟时,相变应力高。应力辅助双向记忆效应的模拟结果表明,残余马氏体随着保有应力的增大而增大,这与实验观测结果一致。模型首次实现了在几个循环内模拟材料的力学状态结果表明塑性应变和相关的残余应变在前4个循环逐渐增加,并在之后保持稳定。塑性的激活总是发生在相变开始之后。尽管塑性导致了更多的应力松弛,但由于它阻碍反向相变,因此使得材料的形状记忆能力和伪弹性发生了劣化此外,拉伸和压缩的比较表明该相场模型首次成功解释形状记忆合金中的非对称相变和塑性响应。

向上滑动阅览英文摘要

We propose an elasto-plastic phase-field model (PFM) to conduct the first microscopic computational study of shape memory effect (SME), pseudoelasticity, stress assisted two-way memory effect (SATWME), and thermomechanical training of CuAlBe shape memory alloy (SMA). This non-isothermal PFM model considers the effects of temperature dependent properties, latent heat, grain boundaries, and asymmetric transformation and plasticity. PFM simulations demonstrate the capacity of our model to capture the thermomechanical and purely mechanical shape recovery in the SMA. When considering transforming grain boundaries, grain refinement generates a higher transformation stress, a steeper transformation hardening, and smaller hysteresis loops for both SME and pseudoelasticity. The results also point out slightly higher transformation stress when geometrical grain boundaries are used. The simulations of SATWME highlight an augmentation of the residual martensite as the hold stress increases, which is consistent with experimental observations. This is the first PFM that can mimic the thermal training within several SATWME cycles, showing an asymptotic increase of plastic strain and the related retained transformation strain until the fourth cycle, and their stabilization thereafter. The activation of plasticity occurs always after initiation of phase transformation. Although plasticity results in more stress relaxation, it deteriorates the shape recovery for both SME and pseudoelasticity by hindering the reverse transformation. Comparison between tension and compression demonstrates the capacity of this PFM to account for, for the first time, the nonsymmetrical transformation and plastic responses of SMAs.

 

 

ACTA

Vol. 201, Dec. 2021, P596-603

10. Atomistic study of grain-boundary segregation and grain-boundary diffusion in Al-Mg alloys

Al-Mg合金中晶界偏析和扩散的原子尺度研究

 

R.K. Koju, Y. Mishin

Y. Mishinymishin@gmu.edu

https://doi.org/10.1016/j.actamat.2020.10.029

 

摘要

Mg晶界偏聚和扩散Al-Mg合金的加工和性能有很大影响,目前却鲜有相关的实验测量或模拟预测被报导在本研究中,我们采用原子尺度的计算机模拟Mg的晶界偏聚能量能、以及偏聚对两种合金组分晶界扩散的影响进行了预测研究发现,低温下Mg原子于在倾侧晶界偏聚形成高度各向异性团簇。MgAl 晶界中的扩散速度比Al基体中慢,且两者都比Al的晶界自扩散慢。因此,Mg偏析显著降低Al-Mg合金中沿晶界原子迁移速率,从而提高组织的高温稳定性。

向上滑动阅览英文摘要

Mg grain boundary (GB) segregation and GB diffusion can impact the processing and properties of Al-Mg alloys. Yet, Mg GB diffusion in Al has not been measured experimentally or predicted by simulations. We apply atomistic computer simulations to predict the amount and the free energy of Mg GB segregation, and the impact of segregation on GB diffusion of both alloy components. At low temperatures, Mg atoms segregated to a tilt GB form clusters with highly anisotropic shapes. Mg diffuses in Al GBs slower than Al itself, and both components diffuse slowly in comparison with Al GB self-diffusion. Thus, Mg segregation significantly reduces the rate of mass transport along GBs in Al-Mg alloys. The reduced atomic mobility can be responsible for the improved stability of the microstructure at elevated temperatures.

 

 

ACTA

Vol. 201, Dec. 2021, P604-616

11. Topological model of type II deformation twinning in 10M Ni-Mn-Ga

10M Ni-Mn-GaII型形变孪晶拓扑模型

 

Bibek Karki, Peter Müllner, Robert Pond

B. Karkibkkarki@u.boisestate.edu

https://doi.org/10.1016/j.actamat.2020.10.020

 

摘要

我们使用拓扑方法模拟了10M Ni-Mn-Ga合金中的II型孪晶结构。该方法预测的孪生参数与BevisCrocker的动态模型相同。此外,我们借助拓扑模型得到了迁移速率、孪晶应力及其温度之间的关系我们假设II型孪晶借助前驱I型共轭形成。前驱体k1面上的断对齐成倾壁,倾经扭转松弛后形成平行于k2平面的II型孪晶界。缺陷组元可排列成壁,或松弛形成较不规则的结构。这两界面都能容纳额外的滑动断点,这些断点可沿界运动导致界面迁移和切。这些缺陷的动性随其核心宽度增加而增加,而核心宽度又随界面的锐度增加而降低。在其他材料中的一些实验证据表明,II型孪晶可以通过采取低指数面来降低其界面能,从而降低孪晶界迁移率。拓扑模型表明,这样的协同多面体结构不太可能10M Ni-Mn-Ga合金出现,这与II型孪晶界的高迁移率一致。

向上滑动阅览英文摘要

The structure of type II twins in 10M Ni-Mn-Ga is modeled using the topological method. This method predicts the same twinning parameters as the kinematic model of Bevis and Crocker. Furthermore, topological modeling provides mechanistic insight into boundary migration rates, the twinning stresses and their temperature dependence. A type II twin is envisaged to form from a precursor, which is its type I conjugate. Disconnections on the precursor k1 plane align into a tilt wall, which, after the relaxation of the rotational distortions, forms the type II boundary parallel on average to the k2 plane. The component defects may align into a sharp wall or relax by kinking into a less orderly configuration. Both interfaces can host additional glissile disconnections whose motion along a boundary produces combined migration and shear. The ease of motion of these defects increases with their core width, and this, in turn, decreases with increasing sharpness of the boundary. Some experimental evidence in other materials suggests that type II twins can reduce their interfacial energy by adopting a configuration of low-index facets, which reduces twin boundary mobility. Topological modeling suggests that such a coherently faceted structure is unlikely in 10M Ni-Mn-Ga, in agreement with the high mobility of type II twin boundaries.