Pub Date : 2024-06-13DOI: 10.1016/j.ijplas.2024.104035
Pengfei Qu, Wenchao Yang, Qiang Wang, Chen Liu, Jiarun Qin, Jun Zhang, Lin Liu
Although blades with a deviation angle of less than 15° between the blade stacking axis and the [001] orientation are qualified in the industry, the creep life of samples near [001] orientation exhibits significant anisotropy at intermediate temperatures. Those crystals having orientations within 15° from precise [001] exhibited significantly longer lives when their orientations were closer to the [001]-[101] boundary of the stereographic triangle than to the [001]-[111] boundary. Here, we first investigated the orientation rotation path of specimens near [001] orientation during creep at 750 °C/750 MPa, then revealed the dominant slip systems at different creep stages. Subsequently, we evaluated the effect of orientation deviation from precise [001] on creep properties. Finally, our research revealed the orientation sensitive mechanism of creep life in near [001] oriented Ni-based single crystal superalloys at intermediates.
{"title":"Unveiling the orientation sensitivity of creep life in near [001] oriented Ni-based single crystal superalloys at intermediate temperatures","authors":"Pengfei Qu, Wenchao Yang, Qiang Wang, Chen Liu, Jiarun Qin, Jun Zhang, Lin Liu","doi":"10.1016/j.ijplas.2024.104035","DOIUrl":"https://doi.org/10.1016/j.ijplas.2024.104035","url":null,"abstract":"<div><p>Although blades with a deviation angle of less than 15° between the blade stacking axis and the [001] orientation are qualified in the industry, the creep life of samples near [001] orientation exhibits significant anisotropy at intermediate temperatures. Those crystals having orientations within 15° from precise [001] exhibited significantly longer lives when their orientations were closer to the [001]-[101] boundary of the stereographic triangle than to the [001]-[111] boundary. Here, we first investigated the orientation rotation path of specimens near [001] orientation during creep at 750 °C/750 MPa, then revealed the dominant slip systems at different creep stages. Subsequently, we evaluated the effect of orientation deviation from precise [001] on creep properties. Finally, our research revealed the orientation sensitive mechanism of creep life in near [001] oriented Ni-based single crystal superalloys at intermediates.</p></div>","PeriodicalId":340,"journal":{"name":"International Journal of Plasticity","volume":null,"pages":null},"PeriodicalIF":9.8,"publicationDate":"2024-06-13","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141333406","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":1,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-06-11DOI: 10.1016/j.ijplas.2024.104034
Xinyan Wang , Mengyu Cao , Yang Zhao , Jingjing He , Xuefei Guan
Wire and arc additive manufacturing (WAAM) enables rapid near-net-shape fabrications of large-size parts and in-situ remanufacturing in many industry sectors. A comprehensive understanding of the fatigue failure mechanism of WAAM titanium alloys is a prerequisite for their widespread use in critical structural components subject to fatigue load. Here, the fatigue crack growth behavior of WAAM TA15 material is investigated. Fatigue crack growth tests are performed using compact tension specimens sampled from different locations and with different crack orientations of the WAAM TA15 block. The fatigue crack growth rate (FCGR) data exhibit two governing rates separated by a transition stress intensity factor value, , and the degrees of fluctuation of the FCGR data in the two regimes are notably different. A piecewise log-linear model is first proposed by incorporating the Heaviside step function and into the classical Paris’ model, allowing for the transition to be determined by the data. The potential causes of the transition are phenomenologically inferred via fractography and surface roughness profiling results. The critical microstructure affecting the value of is identified by relating the crack tip cyclic plastic zone size at to the sizes of main microstructures. The cause of different degrees of fluctuations in the two regimes separated by is inferred by examining the microstructures within the plastic zone. The microstructural mechanisms of the local FCGR reduction and fluctuation are further identified and explained.
{"title":"Microstructural causes and mechanisms of crack growth rate transition and fluctuation of additively manufactured titanium alloy","authors":"Xinyan Wang , Mengyu Cao , Yang Zhao , Jingjing He , Xuefei Guan","doi":"10.1016/j.ijplas.2024.104034","DOIUrl":"https://doi.org/10.1016/j.ijplas.2024.104034","url":null,"abstract":"<div><p>Wire and arc additive manufacturing (WAAM) enables rapid near-net-shape fabrications of large-size parts and in-situ remanufacturing in many industry sectors. A comprehensive understanding of the fatigue failure mechanism of WAAM titanium alloys is a prerequisite for their widespread use in critical structural components subject to fatigue load. Here, the fatigue crack growth behavior of WAAM TA15 material is investigated. Fatigue crack growth tests are performed using compact tension specimens sampled from different locations and with different crack orientations of the WAAM TA15 block. The fatigue crack growth rate (FCGR) data exhibit two governing rates separated by a transition stress intensity factor value, <span><math><mrow><mstyle><mi>Δ</mi></mstyle><msub><mi>K</mi><mi>n</mi></msub></mrow></math></span>, and the degrees of fluctuation of the FCGR data in the two regimes are notably different. A piecewise log-linear model is first proposed by incorporating the Heaviside step function and <span><math><mrow><mstyle><mi>Δ</mi></mstyle><msub><mi>K</mi><mi>n</mi></msub></mrow></math></span> into the classical Paris’ model, allowing for the transition <span><math><mrow><mstyle><mi>Δ</mi></mstyle><msub><mi>K</mi><mi>n</mi></msub></mrow></math></span> to be determined by the data. The potential causes of the transition <span><math><mrow><mstyle><mi>Δ</mi></mstyle><msub><mi>K</mi><mi>n</mi></msub></mrow></math></span> are phenomenologically inferred via fractography and surface roughness profiling results. The critical microstructure affecting the value of <span><math><mrow><mstyle><mi>Δ</mi></mstyle><msub><mi>K</mi><mi>n</mi></msub></mrow></math></span> is identified by relating the crack tip cyclic plastic zone size at <span><math><mrow><mstyle><mi>Δ</mi></mstyle><msub><mi>K</mi><mi>n</mi></msub></mrow></math></span> to the sizes of main microstructures. The cause of different degrees of fluctuations in the two regimes separated by <span><math><mrow><mstyle><mi>Δ</mi></mstyle><msub><mi>K</mi><mi>n</mi></msub></mrow></math></span> is inferred by examining the microstructures within the plastic zone. The microstructural mechanisms of the local FCGR reduction and fluctuation are further identified and explained.</p></div>","PeriodicalId":340,"journal":{"name":"International Journal of Plasticity","volume":null,"pages":null},"PeriodicalIF":9.8,"publicationDate":"2024-06-11","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141328710","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":1,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-06-09DOI: 10.1016/j.ijplas.2024.104032
Glenn R. Peterson , Youngung Jeong , Carlos N. Tomé , Michael D. Sangid
Ceramic-metal composites, or cermets, exhibit beneficial properties resulting in their use in many industrial applications. One challenge with cermets is mismatches in the coefficient of thermal expansion (CTE) values between the ceramic and metal phases that lead to residual stresses after processing, plasticity in the metal phase, internal stresses, and instability after thermal cycling. In order to make predictions of these properties to inform the design of cermets, we employ an incremental elasto-viscoplastic, self-consistent formulation to calculate the thermal, elastic, and plastic strains in two-phase polycrystalline cermet materials. This framework is extended to include temperature dependent properties, which are called implicitly within the temperature-dependent, incremental elasto-viscoplastic, self-consistent (TE-VPSC) model. Temperature-induced cooling and thermal cycling simulations are conducted using the TE-VPSC framework to study the residual stresses and plastic strains in the metal phases. Two materials are discussed in detail exhibiting stark differences based on the CTE between their ceramic and metal phases, WC/57-vol% Cu (exhibiting a pronounced CTE mismatch) and Y2O3/27-vol% Nb (exhibiting a negligible CTE mismatch). The model demonstrates high residual stresses in the Cu phase during processing and reverse plasticity leading to recovery of plastic strain during thermal cycling of the WC/Cu cermet. Moreover, the model demonstrates relatively low residual stresses and plasticity in Y2O3/Nb and a thermal stability point of 1251 °C, below which no plasticity develops in the cermet. We employ the TE-VPSC model as a design tool for cermets to systematically investigate the effects of process-induced microstructure variations (volume fraction, grain aspect ratio, and crystallographic texture are investigated) and compositional differences (19 compositions are explored) on the residual stress, degree of plasticity in the metal phase, and thermal stability point. The computational efficiency of the TE-VPSC framework makes it a desktop design tool that can be used to quantify the impact of changing composition, processing, and thermo-mechanical loading on the performance of the cermet, which can help reduce the number of time intensive and costly high temperature experiments.
{"title":"A comprehensive analysis of cermet design and thermal cyclic stability via elasto-viscoplastic crystal plasticity modeling","authors":"Glenn R. Peterson , Youngung Jeong , Carlos N. Tomé , Michael D. Sangid","doi":"10.1016/j.ijplas.2024.104032","DOIUrl":"10.1016/j.ijplas.2024.104032","url":null,"abstract":"<div><p>Ceramic-metal composites, or cermets, exhibit beneficial properties resulting in their use in many industrial applications. One challenge with cermets is mismatches in the coefficient of thermal expansion (CTE) values between the ceramic and metal phases that lead to residual stresses after processing, plasticity in the metal phase, internal stresses, and instability after thermal cycling. In order to make predictions of these properties to inform the design of cermets, we employ an incremental elasto-viscoplastic, self-consistent formulation to calculate the thermal, elastic, and plastic strains in two-phase polycrystalline cermet materials. This framework is extended to include temperature dependent properties, which are called implicitly within the temperature-dependent, incremental elasto-viscoplastic, self-consistent (TE-VPSC) model. Temperature-induced cooling and thermal cycling simulations are conducted using the TE-VPSC framework to study the residual stresses and plastic strains in the metal phases. Two materials are discussed in detail exhibiting stark differences based on the CTE between their ceramic and metal phases, WC/57-vol% Cu (exhibiting a pronounced CTE mismatch) and Y<sub>2</sub>O<sub>3</sub>/27-vol% Nb (exhibiting a negligible CTE mismatch). The model demonstrates high residual stresses in the Cu phase during processing and reverse plasticity leading to recovery of plastic strain during thermal cycling of the WC/Cu cermet. Moreover, the model demonstrates relatively low residual stresses and plasticity in Y<sub>2</sub>O<sub>3</sub>/Nb and a thermal stability point of 1251 °C, below which no plasticity develops in the cermet. We employ the TE-VPSC model as a design tool for cermets to systematically investigate the effects of process-induced microstructure variations (volume fraction, grain aspect ratio, and crystallographic texture are investigated) and compositional differences (19 compositions are explored) on the residual stress, degree of plasticity in the metal phase, and thermal stability point. The computational efficiency of the TE-VPSC framework makes it a desktop design tool that can be used to quantify the impact of changing composition, processing, and thermo-mechanical loading on the performance of the cermet, which can help reduce the number of time intensive and costly high temperature experiments.</p></div>","PeriodicalId":340,"journal":{"name":"International Journal of Plasticity","volume":null,"pages":null},"PeriodicalIF":9.4,"publicationDate":"2024-06-09","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141392867","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":1,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-06-08DOI: 10.1016/j.ijplas.2024.104022
Franz Miller Branco Ferraz , Ricardo Henrique Buzolin , Stefan Ebenbauer , Thomas Leitner , Alfred Krumphals , Maria Cecilia Poletti
Thermomechanical processing of titanium alloys often requires complex routes to achieve the desired final microstructure. Recent advances in modeling and simulation tools have facilitated the optimization of these processing routes. However, existing models often fail to accurately predict microstructural changes at large deformations. In this study, we refine the physical principles of an existing mean-field model and propose a calibration method that uses experimental results under isothermal conditions, accounting for the actual local deformation within the workpiece. This new approach improves the predictability of microstructural changes due to continuous dynamic recrystallization during torsion and compression experiments. Additionally, we integrate the model into the commercial FEM-based DEFORM™ 2D software to predict the local microstructure evolution within hot torsion specimens thermomechanically treated by resistive heating. Validation using non-isothermal deformation tests demonstrates that the model provides realistic simulations at high strain rates, where adiabatic heat modifies temperature, flow stress and microstructure. This study demonstrates the intrinsic correlation between microstructure, flow behavior, and workpiece geometry, considering the impact of deformation history in thermomechanical processes.
{"title":"A predictive mesoscale model for continuous dynamic recrystallization","authors":"Franz Miller Branco Ferraz , Ricardo Henrique Buzolin , Stefan Ebenbauer , Thomas Leitner , Alfred Krumphals , Maria Cecilia Poletti","doi":"10.1016/j.ijplas.2024.104022","DOIUrl":"https://doi.org/10.1016/j.ijplas.2024.104022","url":null,"abstract":"<div><p>Thermomechanical processing of titanium alloys often requires complex routes to achieve the desired final microstructure. Recent advances in modeling and simulation tools have facilitated the optimization of these processing routes. However, existing models often fail to accurately predict microstructural changes at large deformations. In this study, we refine the physical principles of an existing mean-field model and propose a calibration method that uses experimental results under isothermal conditions, accounting for the actual local deformation within the workpiece. This new approach improves the predictability of microstructural changes due to continuous dynamic recrystallization during torsion and compression experiments. Additionally, we integrate the model into the commercial FEM-based DEFORM™ 2D software to predict the local microstructure evolution within hot torsion specimens thermomechanically treated by resistive heating. Validation using non-isothermal deformation tests demonstrates that the model provides realistic simulations at high strain rates, where adiabatic heat modifies temperature, flow stress and microstructure. This study demonstrates the intrinsic correlation between microstructure, flow behavior, and workpiece geometry, considering the impact of deformation history in thermomechanical processes.</p></div>","PeriodicalId":340,"journal":{"name":"International Journal of Plasticity","volume":null,"pages":null},"PeriodicalIF":9.8,"publicationDate":"2024-06-08","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.sciencedirect.com/science/article/pii/S0749641924001499/pdfft?md5=2b6489ae95bf715a474616fd98be3ffb&pid=1-s2.0-S0749641924001499-main.pdf","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141326064","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":1,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-06-08DOI: 10.1016/j.ijplas.2024.104031
Y.S. Fan , L. Tan , X.G. Yang , W.Q. Huang , D.Q. Shi
Monotonic tensile and cyclic deformation behaviours are investigated under different microstructural rafting states of a SC Ni-based superalloy, with emphasis on the influences of the rafting extent, type and loading orientation. The deformed microstructures and the dislocation configurations are characterized to give a micro-based understanding on the varying of deformation behaviours due to rafting. It is found that the decreases in the initial yield point and cyclic stress amplitude are only related to the rafting extent. Nevertheless, the rafting type (namely, the plate-like and needle-like morphology) has an undeniable contribution to the shape of hysteresis loops, where the plate-like rafting morphology results in more significant Bauschinger effect than needle-like rafting morphology. The variation of monotonic and cyclic deformation induced by rafting shares affinity with the alteration of internal stress and the movement of dislocations. Afterwards, a microstructure-sensitive constitutive model with two-phase flow rules has been developed. The effect of rafting on the monotonic and cyclic stress-strain responses is captured by introduce a series of microscopic mechanisms and a micromechanics-based back stress model that considers the morphology and size of the γ'/γ two-phase structures. The developed model is used to simulate the macroscopic stress-strain responses of the SC Ni-based superalloy under different rafting states. Model predictions are in good agreement with tests, capturing the reduction of cyclic stress amplitudes and the change in hysteresis loops. Finally, the impacts of the two-phase flow rules and the micromechanics-based back stress on the simulation capability have been discussed.
研究了一种 SC Ni 基超合金在不同微结构筏化状态下的单调拉伸和循环变形行为,重点是筏化程度、类型和加载方向的影响。对变形的微观结构和位错配置进行了表征,以便从微观上了解筏化导致的变形行为变化。研究发现,初始屈服点和循环应力振幅的降低仅与筏变程度有关。然而,不可否认的是,筏形类型(即板状和针状形态)对滞后环的形状有影响,其中板状筏形形态比针状筏形形态产生更显著的鲍辛格效应。筏状变形引起的单调变形和周期变形的变化与内应力的改变和位错的移动密切相关。随后,我们建立了一个具有两相流动规则的微结构敏感构造模型。通过引入一系列微观机制和基于微观力学的背应力模型(考虑了 γ'/γ 两相结构的形态和尺寸),捕捉到了漂移对单调和循环应力应变响应的影响。所建立的模型用于模拟 SC Ni 基超级合金在不同筏化状态下的宏观应力-应变响应。模型预测结果与试验结果十分吻合,捕捉到了循环应力振幅的减小和滞后环的变化。最后,讨论了两相流动规则和基于微观力学的背应力对模拟能力的影响。
{"title":"Monotonic tensile and cyclic deformation of a Ni-based single crystal superalloy with anisotropic microstructural rafting patterns at high temperature: Experiment and constitutive modelling","authors":"Y.S. Fan , L. Tan , X.G. Yang , W.Q. Huang , D.Q. Shi","doi":"10.1016/j.ijplas.2024.104031","DOIUrl":"https://doi.org/10.1016/j.ijplas.2024.104031","url":null,"abstract":"<div><p>Monotonic tensile and cyclic deformation behaviours are investigated under different microstructural rafting states of a SC Ni-based superalloy, with emphasis on the influences of the rafting extent, type and loading orientation. The deformed microstructures and the dislocation configurations are characterized to give a micro-based understanding on the varying of deformation behaviours due to rafting. It is found that the decreases in the initial yield point and cyclic stress amplitude are only related to the rafting extent. Nevertheless, the rafting type (namely, the plate-like and needle-like morphology) has an undeniable contribution to the shape of hysteresis loops, where the plate-like rafting morphology results in more significant Bauschinger effect than needle-like rafting morphology. The variation of monotonic and cyclic deformation induced by rafting shares affinity with the alteration of internal stress and the movement of dislocations. Afterwards, a microstructure-sensitive constitutive model with two-phase flow rules has been developed. The effect of rafting on the monotonic and cyclic stress-strain responses is captured by introduce a series of microscopic mechanisms and a micromechanics-based back stress model that considers the morphology and size of the γ'/γ two-phase structures. The developed model is used to simulate the macroscopic stress-strain responses of the SC Ni-based superalloy under different rafting states. Model predictions are in good agreement with tests, capturing the reduction of cyclic stress amplitudes and the change in hysteresis loops. Finally, the impacts of the two-phase flow rules and the micromechanics-based back stress on the simulation capability have been discussed.</p></div>","PeriodicalId":340,"journal":{"name":"International Journal of Plasticity","volume":null,"pages":null},"PeriodicalIF":9.8,"publicationDate":"2024-06-08","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141314126","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":1,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-06-07DOI: 10.1016/j.ijplas.2024.104017
Yuanzhe Hu , Guowei Zhou , Myoung-Gyu Lee , Peidong Wu , Dayong Li
Machine learning (ML) based methods have achieved preliminary success in the constitutive modeling for single crystals or homogenized polycrystals with remarkable computational efficiency. However, existing ML-based constitutive models neglect grain-level anisotropy, which limits the accurate analysis of local effects. In the current work, a temporal graph neural network (TGNN) model is proposed to simulate cross-scale deformation behaviors of polycrystals under complex loading conditions, with straightforward consideration of microstructure variation and local interaction. The TGNN-based model, a variant of Linearized Minimal State Cells (LMSCs), extends its scope from macroscopic stress response to the mechanical response and orientation evolution of all grains within the aggregate. Specifically, the polycrystalline microstructure is represented with a graph to incorporate essential features of grains, including the spatial connectivity, crystallographic orientation and deformation state. Graph neural network (GNN) is used to capture the spatial correlation of grains, and the features extracted by the GNN are further processed with LMSCs to account for the history-dependent deformation and microstructure evolution. Moreover, the representative volume element (RVE) simulation with crystal plasticity is performed to provide reliable datasets for model establishment. The proposed model demonstrates high efficiency, accuracy and self-consistency in predicting the strain-stress response and orientation evolution at the scale of both individual grain and the overall aggregate under complex loading cases, such as cyclic loading and arbitrary loading.
基于机器学习(ML)的方法在单晶体或均匀化多晶体的构造模型中取得了初步成功,并具有显著的计算效率。然而,现有的基于 ML 的构造模型忽略了晶粒级各向异性,从而限制了对局部效应的精确分析。本研究提出了一种时序图神经网络(TGNN)模型,用于模拟多晶体在复杂加载条件下的跨尺度变形行为,并直接考虑了微观结构变化和局部相互作用。基于 TGNN 的模型是线性化极小状态单元(LMSCs)的一个变体,其范围从宏观应力响应扩展到集合体内所有晶粒的机械响应和取向演变。具体来说,多晶微观结构用图形来表示,以纳入晶粒的基本特征,包括空间连通性、晶体学取向和变形状态。图神经网络(GNN)用于捕捉晶粒的空间相关性,由 GNN 提取的特征通过 LMSCs 进一步处理,以解释随历史变化的变形和微结构演变。此外,还进行了具有晶体塑性的代表性体积元素(RVE)模拟,为模型的建立提供了可靠的数据集。在循环加载和任意加载等复杂加载情况下,所提出的模型在预测单个晶粒和整体骨料尺度上的应变应力响应和取向演变方面表现出高效、准确和自洽性。
{"title":"A temporal graph neural network for cross-scale modelling of polycrystals considering microstructure interaction","authors":"Yuanzhe Hu , Guowei Zhou , Myoung-Gyu Lee , Peidong Wu , Dayong Li","doi":"10.1016/j.ijplas.2024.104017","DOIUrl":"https://doi.org/10.1016/j.ijplas.2024.104017","url":null,"abstract":"<div><p>Machine learning (ML) based methods have achieved preliminary success in the constitutive modeling for single crystals or homogenized polycrystals with remarkable computational efficiency. However, existing ML-based constitutive models neglect grain-level anisotropy, which limits the accurate analysis of local effects. In the current work, a temporal graph neural network (TGNN) model is proposed to simulate cross-scale deformation behaviors of polycrystals under complex loading conditions, with straightforward consideration of microstructure variation and local interaction. The TGNN-based model, a variant of Linearized Minimal State Cells (LMSCs), extends its scope from macroscopic stress response to the mechanical response and orientation evolution of all grains within the aggregate. Specifically, the polycrystalline microstructure is represented with a graph to incorporate essential features of grains, including the spatial connectivity, crystallographic orientation and deformation state. Graph neural network (GNN) is used to capture the spatial correlation of grains, and the features extracted by the GNN are further processed with LMSCs to account for the history-dependent deformation and microstructure evolution. Moreover, the representative volume element (RVE) simulation with crystal plasticity is performed to provide reliable datasets for model establishment. The proposed model demonstrates high efficiency, accuracy and self-consistency in predicting the strain-stress response and orientation evolution at the scale of both individual grain and the overall aggregate under complex loading cases, such as cyclic loading and arbitrary loading.</p></div>","PeriodicalId":340,"journal":{"name":"International Journal of Plasticity","volume":null,"pages":null},"PeriodicalIF":9.8,"publicationDate":"2024-06-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141294237","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":1,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-06-07DOI: 10.1016/j.ijplas.2024.104019
Z.G. Liu, W.H. Wong, T.F. Guo
This paper investigates void growth and coalescence in porous ductile solids under dynamic loading condition. A physical definition for the onset of void coalescence in porous ductile solids under dynamic loading is proposed. The onset is deemed to occur when the third invariant of the tensorial form of the Hill–Mandel condition attains a zero value. The definition allows for systematic investigations on the effects of dimensionless stress rate and stress state, defined by the stress triaxiality and Lode parameter , on the onset of void coalescence via micromechanical analyses. The analyses reveal that the critical macroscopic effective strain for the onset of void coalescence displays an increasing–decreasing transition trend as the dimensionless stress rate increases, for all levels of and considered. The macroscopic effective strain at the transition is identified as the “ductile–brittle” transition strain. The dimensionless stress rate at which the transition strain occurs is found to be relatively constant. A mapping in the space for , representative of a generalized uniaxial tension typical in spall fracture experiments, is established which depicts regions where coalescence and non-coalescence can take place, as well as the ductile–brittle regions demarcated by a ductile–brittle transition curve. The results also show that the critical void volume fraction and macroscopic effective strain at the onset of void coalescence are insensitive to inertia at high stress triaxialities at .
本文研究了动态加载条件下多孔韧性固体中的空隙增长和凝聚。本文提出了动态加载条件下多孔韧性固体中空隙凝聚开始的物理定义。当希尔-曼德尔(Hill-Mandel)条件的张量形式的第三个不变量达到零值时,即认为开始凝聚。根据这一定义,可以通过微观力学分析系统地研究无量纲应力速率 κ 和应力状态(由应力三轴度 T 和洛德参数 L 定义)对空洞凝聚开始的影响。分析表明,在考虑的所有 T 和 L 水平上,随着无量纲应力率的增加,空洞凝聚开始时的临界宏观有效应变呈现出由增到减的过渡趋势。过渡时的宏观有效应变被确定为 "韧性-脆性 "过渡应变。过渡应变发生时的无量纲应力速率相对恒定。建立了 L=-1 的 κ-T 空间映射,代表了典型的剥落断裂实验中的广义单轴拉伸,描绘了可能发生凝聚和非凝聚的区域,以及由延性-脆性过渡曲线划分的延性-脆性区域。结果还表明,在 L=-1 的高应力三轴度条件下,空隙凝聚开始时的临界空隙体积分数和宏观有效应变对惯性不敏感。
{"title":"Onset of dynamic void coalescence in porous ductile solids","authors":"Z.G. Liu, W.H. Wong, T.F. Guo","doi":"10.1016/j.ijplas.2024.104019","DOIUrl":"https://doi.org/10.1016/j.ijplas.2024.104019","url":null,"abstract":"<div><p>This paper investigates void growth and coalescence in porous ductile solids under dynamic loading condition. A physical definition for the onset of void coalescence in porous ductile solids under dynamic loading is proposed. The onset is deemed to occur when the third invariant of the tensorial form of the Hill–Mandel condition attains a zero value. The definition allows for systematic investigations on the effects of dimensionless stress rate <span><math><mi>κ</mi></math></span> and stress state, defined by the stress triaxiality <span><math><mi>T</mi></math></span> and Lode parameter <span><math><mi>L</mi></math></span>, on the onset of void coalescence <em>via</em> micromechanical analyses. The analyses reveal that the critical macroscopic effective strain for the onset of void coalescence displays an increasing–decreasing transition trend as the dimensionless stress rate increases, for all levels of <span><math><mi>T</mi></math></span> and <span><math><mi>L</mi></math></span> considered. The macroscopic effective strain at the transition is identified as the “ductile–brittle” transition strain. The dimensionless stress rate at which the transition strain occurs is found to be relatively constant. A mapping in the <span><math><mrow><mi>κ</mi><mo>−</mo><mi>T</mi></mrow></math></span> space for <span><math><mrow><mi>L</mi><mo>=</mo><mo>−</mo><mn>1</mn></mrow></math></span>, representative of a generalized uniaxial tension typical in spall fracture experiments, is established which depicts regions where coalescence and non-coalescence can take place, as well as the ductile–brittle regions demarcated by a ductile–brittle transition curve. The results also show that the critical void volume fraction and macroscopic effective strain at the onset of void coalescence are insensitive to inertia at high stress triaxialities at <span><math><mrow><mi>L</mi><mo>=</mo><mo>−</mo><mn>1</mn></mrow></math></span>.</p></div>","PeriodicalId":340,"journal":{"name":"International Journal of Plasticity","volume":null,"pages":null},"PeriodicalIF":9.8,"publicationDate":"2024-06-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141326065","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":1,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-06-07DOI: 10.1016/j.ijplas.2024.104030
Ping Yu, Guisen Liu, Yao Shen
By impeding dislocation motion, the irradiation-induced dislocation loops cause irradiation hardening and further embrittlement of plasma-facing tungsten in fusion reactors, leading to its performance degradation. But fundamental questions regarding the mechanisms remain to be clarified and predictive model for loop hardening remains to be built. In this paper, interactions between gliding edge dislocations and interstitial dislocation loops (with Burger vector bL = ½<111>) are studied using atomistic simulations. The influences of bL orientations, dislocation-loop intersection positions, loop sizes, and loading conditions (temperature and strain rate) on the interactions are systematically calculated and analyzed. Results show a large variety of interaction mechanisms, depending mainly on the relative orientations of bL to dislocation slip plane, while slightly affected by loading conditions. Although loops with bL parallel to the plane can be easily swept away by gliding dislocations, loops with bL inclined to dislocation slip plane can strongly pin the gliding dislocation by forming a sessile 〈100〉 segment, which would bend the dislocation line into a screw dipole. Thus, high stress is required for the dislocation line to break away from the inclined loops by cross-slip of each individual arm of the screw dipole coupled with glide of the 〈100〉 segment. On the other hand, increasing temperature and/or decreasing strain rate hardly change the above mechanisms, but monotonically reduce the obstruction by these loops. Simplifying the complex motion of the edge dislocation pinned by the inclined loops as a thermally-activated process of a 1/2[111] edge dislocation overcoming barriers, a hardening model for the inclined loops is proposed. This model well describes the dependence of loop strength on loop sizes, temperatures and strain rates. The model is then applied to predict irradiation hardening at experimental strain rates, and it shows reasonable agreement with experimental results.
{"title":"Atomistic investigation of the interaction between an edge dislocation and 1/2<111> interstitial dislocation loops in irradiated tungsten","authors":"Ping Yu, Guisen Liu, Yao Shen","doi":"10.1016/j.ijplas.2024.104030","DOIUrl":"10.1016/j.ijplas.2024.104030","url":null,"abstract":"<div><p>By impeding dislocation motion, the irradiation-induced dislocation loops cause irradiation hardening and further embrittlement of plasma-facing tungsten in fusion reactors, leading to its performance degradation. But fundamental questions regarding the mechanisms remain to be clarified and predictive model for loop hardening remains to be built. In this paper, interactions between gliding edge dislocations and interstitial dislocation loops (with Burger vector <strong><em>b</em></strong><sub>L</sub> = ½<111>) are studied using atomistic simulations. The influences of <strong><em>b</em></strong><sub>L</sub> orientations, dislocation-loop intersection positions, loop sizes, and loading conditions (temperature and strain rate) on the interactions are systematically calculated and analyzed. Results show a large variety of interaction mechanisms, depending mainly on the relative orientations of <strong><em>b</em></strong><sub>L</sub> to dislocation slip plane, while slightly affected by loading conditions. Although loops with <strong><em>b</em></strong><sub>L</sub> parallel to the plane can be easily swept away by gliding dislocations, loops with <strong><em>b</em></strong><sub>L</sub> inclined to dislocation slip plane can strongly pin the gliding dislocation by forming a sessile 〈100〉 segment, which would bend the dislocation line into a screw dipole. Thus, high stress is required for the dislocation line to break away from the inclined loops by cross-slip of each individual arm of the screw dipole coupled with glide of the 〈100〉 segment. On the other hand, increasing temperature and/or decreasing strain rate hardly change the above mechanisms, but monotonically reduce the obstruction by these loops. Simplifying the complex motion of the edge dislocation pinned by the inclined loops as a thermally-activated process of a 1/2[111] edge dislocation overcoming barriers, a hardening model for the inclined loops is proposed. This model well describes the dependence of loop strength on loop sizes, temperatures and strain rates. The model is then applied to predict irradiation hardening at experimental strain rates, and it shows reasonable agreement with experimental results.</p></div>","PeriodicalId":340,"journal":{"name":"International Journal of Plasticity","volume":null,"pages":null},"PeriodicalIF":9.8,"publicationDate":"2024-06-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141390328","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":1,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-06-05DOI: 10.1016/j.ijplas.2024.104021
Yiqi Zhu, Min Yi, Wanlin Guo
Polysynthetically twinned (PST) TiAl single crystal with lamellar structures exhibits great mechanical properties at room temperature. Therein twin boundaries (TBs) are important for achieving optimized ductile and fatigue performance of PST TiAl, but their role and the associated mechanism are elusive. Herein, we decipher the role of true TB (TTB) and pseudo TB (PTB) by a combined atomistic simulation and mesoscopic modeling, and find that PTB could remarkably improve room-temperature flow stress and cyclic stability of TiAl single crystal. It is revealed that dislocations pile up at PTB while unobstructedly traverse TTB. The emergency of back stress and the movement of dislocations along PTB contribute to the strengthening mechanism. The flow stress of TiAl single crystal with PTB is 34% higher than that with TTB. It is further found that as the twin thickness decreases, the flow stress of TiAl single crystal with TTB initially increases and then decreases (i.e., inverse Hall–Petch like behavior), whereas that with PTB always increases owing to the extra back stress and interfacial stress (i.e., Hall–Petch like behavior). Atomistic-informed mesoscopic theoretical models are then proposed to describe the flow stress as a function of twin thickness. Under cyclic loading, PTB is found to facilitate strain delocalization of TiAl single crystal during plastic deformation and thus noticeably improve the cyclic stability. These findings should shed light on achieving strong TiAl alloys with enhanced fatigue performance by the introduction and design of PTB.
具有片状结构的多合成孪晶(PST)钛铝单晶在室温下具有很好的机械性能。因此,孪晶边界(TB)对于实现 PST TiAl 的最佳韧性和疲劳性能非常重要,但其作用和相关机制却难以捉摸。在此,我们通过原子模拟和介观建模相结合的方法,解读了真孪晶(TTB)和伪孪晶(PTB)的作用,发现 PTB 能显著改善 TiAl 单晶的室温流动应力和循环稳定性。研究发现,位错在 PTB 处堆积,而在 TTB 处无障碍穿越。背应力的紧急作用和位错沿 PTB 的运动促成了强化机制。带有 PTB 的 TiAl 单晶的流动应力比带有 TTB 的高 34%。研究还发现,随着孪晶厚度的减小,带有 TTB 的 TiAl 单晶的流动应力会先增大后减小(即类似霍尔-佩奇的反向行为),而带有 PTB 的 TiAl 单晶的流动应力则由于额外的背应力和界面应力而始终增大(即类似霍尔-佩奇的行为)。然后,提出了以原子论为基础的介观理论模型,以描述流动应力与孪晶厚度的函数关系。在循环加载下,PTB 可促进 TiAl 单晶在塑性变形过程中的应变分散,从而显著提高循环稳定性。这些发现将有助于通过引入和设计 PTB 来实现具有更强疲劳性能的高强度 TiAl 合金。
{"title":"Pseudo-twin boundary improves flow stress and cyclic stability of TiAl single crystal","authors":"Yiqi Zhu, Min Yi, Wanlin Guo","doi":"10.1016/j.ijplas.2024.104021","DOIUrl":"https://doi.org/10.1016/j.ijplas.2024.104021","url":null,"abstract":"<div><p>Polysynthetically twinned (PST) TiAl single crystal with lamellar structures exhibits great mechanical properties at room temperature. Therein twin boundaries (TBs) are important for achieving optimized ductile and fatigue performance of PST TiAl, but their role and the associated mechanism are elusive. Herein, we decipher the role of true TB (TTB) and pseudo TB (PTB) by a combined atomistic simulation and mesoscopic modeling, and find that PTB could remarkably improve room-temperature flow stress and cyclic stability of TiAl single crystal. It is revealed that dislocations pile up at PTB while unobstructedly traverse TTB. The emergency of back stress and the movement of dislocations along PTB contribute to the strengthening mechanism. The flow stress of TiAl single crystal with PTB is 34% higher than that with TTB. It is further found that as the twin thickness decreases, the flow stress of TiAl single crystal with TTB initially increases and then decreases (i.e., inverse Hall–Petch like behavior), whereas that with PTB always increases owing to the extra back stress and interfacial stress (i.e., Hall–Petch like behavior). Atomistic-informed mesoscopic theoretical models are then proposed to describe the flow stress as a function of twin thickness. Under cyclic loading, PTB is found to facilitate strain delocalization of TiAl single crystal during plastic deformation and thus noticeably improve the cyclic stability. These findings should shed light on achieving strong TiAl alloys with enhanced fatigue performance by the introduction and design of PTB.</p></div>","PeriodicalId":340,"journal":{"name":"International Journal of Plasticity","volume":null,"pages":null},"PeriodicalIF":9.8,"publicationDate":"2024-06-05","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141307922","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":1,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-06-04DOI: 10.1016/j.ijplas.2024.104020
Prashant Singh , William Trehern , Brent Vela , Prince Sharma , Tanner Kirk , Zongrui Pei , Raymundo Arroyave , Michael C. Gao , Duane D. Johnson
Multi-principal-element alloys (MPEAs) based on 3d-transition metals show remarkable mechanical properties. The stacking fault energy (SFE) in face-centered cubic (fcc) alloys is a critical property that controls underlying deformation mechanisms and mechanical response. Here, we present an exhaustive density-functional theory study on refractory- and copper-reinforced Cantor-based systems to ascertain the effects of refractory metal chemistry on SFE. We find that even a small percent change in refractory metal composition significantly changes SFEs, which correlates favorably with features like electronegativity variance, size effect, and heat of fusion. For fcc MPEAs, we also detail the changes in mechanical properties, such as bulk, Young's, and shear moduli, as well as yield strength. A Labusch-type solute-solution-strengthening model was used to evaluate the temperature-dependent yield strength, which, combined with SFE, provides a design guide for high-performance alloys. We also analyzed the electronic structures of two down-selected alloys to reveal the underlying origin of optimal SFE and strength range in refractory-reinforced fcc MPEAs. These new insights on tuning SFEs and modifying composition-structure-property correlation in refractory- and copper-reinforced MPEAs by chemical disorder, provide a chemical route to tune twinning- and transformation-induced plasticity behavior.
{"title":"Understanding the effect of refractory metal chemistry on the stacking fault energy and mechanical property of Cantor-based multi-principal element alloys","authors":"Prashant Singh , William Trehern , Brent Vela , Prince Sharma , Tanner Kirk , Zongrui Pei , Raymundo Arroyave , Michael C. Gao , Duane D. Johnson","doi":"10.1016/j.ijplas.2024.104020","DOIUrl":"10.1016/j.ijplas.2024.104020","url":null,"abstract":"<div><p>Multi-principal-element alloys (MPEAs) based on <em>3d</em>-transition metals show remarkable mechanical properties. The stacking fault energy (SFE) in face-centered cubic (fcc) alloys is a critical property that controls underlying deformation mechanisms and mechanical response. Here, we present an exhaustive density-functional theory study on refractory- and copper-reinforced Cantor-based systems to ascertain the effects of refractory metal chemistry on SFE. We find that even a small percent change in refractory metal composition significantly changes SFEs, which correlates favorably with features like electronegativity variance, size effect, and heat of fusion. For fcc MPEAs, we also detail the changes in mechanical properties, such as bulk, Young's, and shear moduli, as well as yield strength. A Labusch-type solute-solution-strengthening model was used to evaluate the temperature-dependent yield strength, which, combined with SFE, provides a design guide for high-performance alloys. We also analyzed the electronic structures of two down-selected alloys to reveal the underlying origin of optimal SFE and strength range in refractory-reinforced fcc MPEAs. These new insights on tuning SFEs and modifying composition-structure-property correlation in refractory- and copper-reinforced MPEAs by chemical disorder, provide a chemical route to tune twinning- and transformation-induced plasticity behavior.</p></div>","PeriodicalId":340,"journal":{"name":"International Journal of Plasticity","volume":null,"pages":null},"PeriodicalIF":9.4,"publicationDate":"2024-06-04","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141279688","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":1,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}