A crystal plasticity analysis of length-scale dependent internal stresses with image effects

In this work, we present a stress functions approach to include image effects in continuum crystal plasticity arising from the long-range elastic interactions (LRI) between the GND density and free surfaces. The resulting length-scale dependent internal stresses augment those produced by the GND density variation. The formulation is applied to the case of a long, thin specimen subjected to uniform curvature. The analysis shows that under nominally uniform GND density distribution, internal stresses arise from two sources: (1) GND–GND LRI arising from the finite spatial extent of the uniform GND density field and (2) the LRI between the GND density and free surfaces appearing as image fields. A comparison with experimental results suggests that the length-scale for internal stresses, described as a correlation length-scale, should increase with decreasing specimen thickness. This observation is rationalized by associating the internal length-scale with the average slip-plane spacing, which may increase with decreasing specimen size due to paucity of dislocation sources. Finally, we also discuss the length-scale dependent image stress in terms of the Peach–Koehler force density proposed by Gurtin (2002).     

基于微结构动态演化机制的单晶镍基高温合金晶体塑性本构及其有限元模拟

因其优异的高温力学性能,镍基单晶高温合金在航空航天和能源等领域得到了广泛的应用.镍基单晶高温合金优异的高温性能来源于其特有的两相微结构.基于代表体胞模型及分块均匀化方法,以位错密度为主要内变量,发展了一个包含两相微结构和位错演化信息的单晶镍基高温合金塑性行为的本构模型.该本构模型充分考虑了镍基单晶合金中位错在基体相和沉淀增强相中的多种演化机制,例如,基体位错八面体滑移、立方滑移、位错攀移、交滑移、位错弓出、位错切过沉淀增强相以及位错Kear-Wilsdolf(K-W)锁形成与解锁等.在商用有限元软件ABAQUS的框架下,编制了UMAT用户材料子程序.利用该用户子程序,对单晶和多晶镍基高温合金在不同温度、不同加载方向下的单调塑性、循环塑性、蠕变等典型行为进行了计算模拟.结果表明:该晶体塑性本构模型能"统一地"刻画镍基高温合金在不同温度、不同方向下的多种变形行为,并与实验结果具有良好的一致性.     

Randomness and slip avalanches in gradient plasticity

While localization of deformation at macroscopic scales has been documented and carefully characterized long ago, it is only recently that systematic experimental investigations have demonstrated that plastic flow of crystalline solids on mesoscopic scales proceeds in a strongly heterogenous and intermittent manner. In fact, deformation is characterized by intermittent bursts (‘slip avalanches’) the sizes of which obey power-law statistics. In the spatial domain, these avalanches produce characteristic deformation patterns in the form of slip lines and slip bands. Unlike to the case of macroscopic localization where gradient plasticity can capture the width and spacing of shear bands in the softening regime of the stress–strain graph, this type of mesoscopically jerky like localized plastic flow is observed in spite of a globally convex stress–strain relationship and may not be captured by standard deterministic continuum modelling. We thus propose a generalized constitutive model which includes both second-order strain gradients and randomness in the local stress–strain relationship. These features are related to the internal stresses which govern dislocation motion on microscopic scales. It is shown that the model can successfully describe experimental observations on slip avalanches as well as the associated surface morphology characteristics.     

Mechanical annealing under low-amplitude cyclic loading in micropillars

Mechanical annealing has been demonstrated to be an effective method for decreasing the overall dislocation density in submicron single crystal. However, simultaneously significant shape change always unexpectedly happens under extremely high monotonic loading to drive the pre-existing dislocations out of the free surfaces. In the present work, through in situ TEM experiments it is found that cyclic loading with low stress amplitude can drive most dislocations out of the submicron sample with virtually little change of the shape. The underlying dislocation mechanism is revealed by carrying out discrete dislocation dynamic (DDD) simulations. The simulation results indicate that the dislocation density decreases within cycles, while the accumulated plastic strain is small. By comparing the evolution of dislocation junction under monotonic, cyclic and relaxation deformation, the cumulative irreversible slip is found to be the key factor of promoting junction destruction and dislocation annihilation at free surface under low-amplitude cyclic loading condition. By introducing this mechanics into dislocation density evolution equations, the critical conditions for mechanical annealing under cyclic and monotonic loadings are discussed. Low-amplitude cyclic loading which strengthens the single crystal without seriously disturbing the structure has the potential applications in the manufacture of defect-free nano-devices.     

Theory of creep deformation with kinematic hardening for materials with different properties in tension and compression

A constitutive model for creep deformation that describes the loading-history-dependent behavior of initially isotropic materials with different properties in tension and compression under stress vector rotations limited by 50–60° is presented within a thermodynamic framework. In the proposed constitutive model a kinematic hardening rule is adopted. This model also introduces an effective equivalent stress in the creep potential that is based on the first and second invariants of the effective stress tensor, and on the joint invariant of the effective stress tensor and eigenvector associated with the maximum principal Cauchy stress. The formulation of the kinematic hardening rule is presented and discussed. All the material parameters in the model have been obtained from a series of proposed basic experiments with constant stresses. These model parameters are then used to predict the creep deformation of the aluminum alloy under multiaxial loading with constant stresses, and under non-proportional uniaxial and non-proportional multiaxial loadings for both isothermal and nonisothermal processes.     

Study of size effects in thin films by means of a crystal plasticity theory based on DiFT

In a recent publication, we derived the mesoscale continuum theory of plasticity for multiple-slip systems of parallel edge dislocations, motivated by the statistical-based nonlocal continuum crystal plasticity theory for single-glide given by Yefimov et al. [2004b. A comparison of a statistical-mechanics based plasticity model with discrete dislocation plasticity simulations. J. Mech. Phys. Solids 52, 279-300]. In this dislocation field theory (DiFT) the transport equations for both the total dislocation density and geometrically necessary dislocation (GND) density on each slip system were obtained from the Peach-Koehler interactions through both single and pair dislocation correlations. The effect of pair correlation interactions manifested itself in the form of a back stress in addition to the external shear and the self-consistent internal stress. We here present the study of size effects in single crystalline thin films with symmetric double slip using the novel continuum theory. Two boundary value problems are analyzed: (1) stress relaxation in thin films on substrates subject to thermal loading, and (2) simple shear in constrained films. In these problems, earlier discrete dislocation simulations had shown that size effects are born out of layers of dislocations developing near constrained interfaces. These boundary layers depend on slip orientations and applied loading but are insensitive to the film thickness. We investigate the stress response to changes in controlled parameters in both problems. Comparisons with previous discrete dislocation simulations are discussed.     

Creep,plasticity, and fatigue of single crystal superalloy

Single crystal components in gas turbine engines are subject to such extreme temperatures and stresses that life prediction becomes highly inaccurate resulting in components that can only be shown to meet their requirements through experience. Reliable life prediction methodologies are required both for design and life management. In order to address this issue we have developed a thermo-viscoplastic constitutive model for single crystal materials. Our incremental large strain formulation additively decomposes the inelastic strain rate into components along the octahedral and cubic slip planes. We have developed a crystallographic-based creep constitutive model able to predict sigmoidal creep behavior of Ni base superalloys. Inelastic shear rate along each slip system is expressed as a sum of a time dependent creep component and a rate independent plastic component. We develop a new robust, computationally efficient rate-independent crystal plasticity approach and combined it with creep flow rule calibrated for Ni-based superalloys. The transient variation of each of the inelastic components includes a back stress for kinematic hardening and latent hardening parameters to account for the stress evolution with inelastic strain as well as the evolution for dislocation densities. The complete formulation accurately predicts both monotonic and cyclic tests at different crystallographic orientations for constant and variable temperature conditions (low cycle fatigue (LCF) and thermo-mechanical fatigue (TMF) tests). Based on the test and modeling results we formulate a new life prediction criterion suitable for both LCF and TMF conditions.     

各向同性率无关材料本构关系的不变性表示

在内变量理论的框架下,针对各向同性率无关材料,使用张量函数表示理论建立了塑性应变全量及增量本构关系的最一般的张量不变性表示. 它们均由3个完备不可约的基张量组合构成,这3个基张量分别是应力的零次幂、一次幂和二次幂. 因此得出,塑性应变、塑性应变增量与应力三者共主轴. 通过对基张量的正交化,给出了本构关系式在主应力空间中的几何解释. 进一步,全量(或增量)本构关系中3个组合因子被表达为应力、塑性应变(或塑性应变增量)的不变量的函数. 当塑性应变(或塑性应变增量)的3个不变量之间满足一定关系时,所给出的本构关系将退化为经典的形变理论(或塑性势理论).最后,还讨论它与奇异屈服面理论的关系,当满足一定条件时,两者是一致的.      

Inelastic constitutive equations of polycrystalline metals subjected to finite deformation part I: Effect of grain rotation

In this article, a set of inelastic constitutive equations of polycrystalline metals is derived by combining a finite deformation kinematics of single crystal component, and a shear stress-shear strain relation of slip system based on a thermoactivated motion of dislocation. Interactions among grains are incorporated by “constant deformation gradient assumption.” The forms of these equations are rather simple internal variable theory types. By using these equations, some fundamental effects of grain rotations on inelastic behaviors of polycrystalline metals in a finite deformation range under complex loading and elevated temperature conditions are demonstrated. Some comments are given on a problem of plastic spin tensor.     

A thermodynamical theory of gradient elastoplasticity with dislocation density tensor. I: Fundamentals

A thermodynamical theory of gradient elastoplasticity, including kinematic hardening, is developed by introducing the concept of dislocation density tensor. The theory is self-consistent and is based on two fundamental principles, the principle of increase of entropy and the maximal entropy production rate. Thermodynamically consistent constitutive equations for plastic stretching, plastic spin and back stress are rigorously derived. Also, an expression for the plastic spin is obtained from the constitutive equation of dislocation drift rate and an expression for the back stress is given as a balance equation expressing equilibrium between internal stress and microstress conjugate to the dislocation density tensor. Moreover, it is shown that the present gradient theory yields a symmetric stress tensor. Some generalities and utility of this theory are discussed and comparisons with other gradient theories are given.     

非比例循环塑性内时本构关系研究

在Valanis的内时本构理论的框架中,引入内结构张量以反映由于非比例加载而引起金属材料的附加等向强化及异向强化效应,同时提出材料强化程度的度量采用沿路径法线方向的塑性应变分量来描述.这些考虑的有效性已经通过用所建模型对304不锈钢材料在一些典型非比例循环加载路径下的响应进行的理论预测得到了验证;将该模型应用于U71Mn材料室温单轴棘轮行为描述中,结果显示内结构张量的引入不仅能较好地反映应变控制下的非比例附加效应,而且也能较好地反映应力控制下塑性应变的累积及变化率.     

A phase-field theory of dislocation dynamics, strain hardening and hysteresis in ductile single crystals

A phase-field theory of dislocation dynamics, strain hardening and hysteresis in ductile single crystals is developed. The theory accounts for: an arbitrary number and arrangement of dislocation lines over a slip plane; the long-range elastic interactions between dislocation lines; the core structure of the dislocations resulting from a piecewise quadratic Peierls potential; the interaction between the dislocations and an applied resolved shear stress field; and the irreversible interactions with short-range obstacles and lattice friction, resulting in hardening, path dependency and hysteresis. A chief advantage of the present theory is that it is analytically tractable, in the sense that the complexity of the calculations may be reduced, with the aid of closed form analytical solutions, to the determination of the value of the phase field at point-obstacle sites. In particular, no numerical grid is required in calculations. The phase-field representation enables complex geometrical and topological transitions in the dislocation ensemble, including dislocation loop nucleation, bow-out, pinching, and the formation of Orowan loops. The theory also permits the consideration of obstacles of varying strengths and dislocation line-energy anisotropy. The theory predicts a range of behaviors which are in qualitative agreement with observation, including: hardening and dislocation multiplication in single slip under monotonic loading; the Bauschinger effect under reverse loading; the fading memory effect, whereby reverse yielding gradually eliminates the influence of previous loading; the evolution of the dislocation density under cycling loading, leading to characteristic ‘butterfly’ curves; and others.     

Dwell fatigue crack nucleation model based on crystal plasticity finite element simulations of polycrystalline titanium alloys

In this paper a crystal plasticity-based crack nucleation model is developed for polycrystalline microstructures undergoing cyclic dwell loading. The fatigue crack nucleation model is developed for dual-phase titanium alloys admitting room temperature creep phenomenon. It is a non-local model that accounts for the cumulative effect of slip on multiple slip systems, and involves evolving mixed-mode stresses in the grain along with dislocation pileups in contiguous grains. Rate dependent, highly anisotropic behavior causes significant localized stress concentration that increases with loading cycles. The crystal plasticity finite element (CPFE) model uses rate and size-dependent anisotropic elasto-crystal plasticity constitutive model to account for these effects. Stress rise in the hard grain is a consequence of time-dependent load shedding in adjacent soft grains, and is the main cause of crack nucleation in the polycrystalline titanium microstructure. CPFE simulation results are post-processed to provide inputs to the crack nucleation model. The nucleation model is calibrated and satisfactorily validated using data available from acoustic microscopy experiments for monitoring crack evolution in dwell fatigue experiments.     

Continuum slip viscoplasticity with the Haasen constitutive model: Application to CdTe single crystal inelasticity

Small strain constitutive equations are developed for the thermomechanical behavior of semiconductor single crystals, including dislocation density as an evolving parameter. The model of Haasen, Alexander and coworkers is modified (extended) to include evolution of coefficients in the definition of internal stress. These account for an evolving dislocation substructure. The resulting model is applied in a continuum slip framework to allow multiple slip orientations. Slip system interaction rules are adapted to include slip system interaction for multiple slip conditions and to suppress secondary slip and dislocation density generation for single slip orientations. The approach is discussed relative to other models for viscoplasticity of single crystals and is examined in the context of thermodynamics with internal state variables. The framework is used to correlate experimental data from compression tests of single crystals of the compound semiconductor CdTe from room temperature to near the melting point. Sensitivity of the model to uncertainties such as initial dislocation density is explored.     

Micromechanical modeling of the elasto-viscoplastic behavior of semi-crystalline polymers

A micromechanically based constitutive model for the elasto-viscoplastic deformation and texture evolution of semi-crystalline polymers is developed. The model idealizes the microstructure to consist of an aggregate of two-phase layered composite inclusions. A new framework for the composite inclusion model is formulated to facilitate the use of finite deformation elasto-viscoplastic constitutive models for each constituent phase. The crystalline lamellae are modeled as anisotropic elastic with plastic flow occurring via crystallographic slip. The amorphous phase is modeled as isotropic elastic with plastic flow being a rate-dependent process with strain hardening resulting from molecular orientation. The volume-averaged deformation and stress within the inclusions are related to the macroscopic fields by a hybrid interaction model. The uniaxial compression of initially isotropic high density polyethylene (HDPE) is taken as a case study. The ability of the model to capture the elasto-plastic stress-strain behavior of HDPE during monotonic and cyclic loading, the evolution of anisotropy, and the effect of crystallinity on initial modulus, yield stress, post-yield behavior and unloading-reloading cycles are presented.     

颗粒材料三维应力路径下的接触组构特性

颗粒材料的宏观应力变形特征与其微观接触力、组构等紧密相关.一般而言,强接触系统属于颗粒内部体系的传力结构,其对应的组构张量是影响宏观应力性质的重要因素.细观数值方法(如离散单元法)能够反映物理试验的基本规律,并且可以方便地提取宏微观数据来研究颗粒体系的应力变形机制.采用离散单元法(discrete element method,DEM)进行一系列等$p$等$b$应力路径下颗粒材料的真三轴试验,在此基础上研究了三维应力路径下颗粒材料的宏微观力学参数的演化过程、三维组构张量与应力张量多重联系以及强接触体系反映的宏观应力特征.研究表明:颗粒体系偏应力峰值状态和临界状态均存在与加载路径无关的宏微观特征;三维应力路径下组构张量与应力张量存在非共轴性,但其联合不变量演化过程表现出加载路径无关的特征;与弱接触系统的组构张量相比,强接触系统的组构张量更能反映宏观应力张量的特征;强弱接触体系的组构张量对颗粒体系宏观响应的贡献不同,其分界点存在一定取值范围,但采用平均接触力较为简单合理.      

金属热黏塑性本构关系的研究进展

金属材料的塑性流动行为依赖于温度和应变率,温度和应变率敏感性是金属材料塑性流动的最重要的本质特性之一,建立合适的热黏塑性本构关系来准确描述金属塑性流动行为的温度和应变率依赖性,是金属材料能被广泛应用的必要前提。为此,对金属热黏塑性本构关系的最新研究进展进行了综述,介绍了常见的几种金属热黏塑性本构关系并进行了详细讨论,给出了各本构关系的优势与不足,最后系统介绍了包含金属塑性流动行为中出现的第三型应变时效、或K-W锁位错结构引起的流动应力随温度变化出现的反常应力峰以及拉压不对称等行为的金属热黏塑性本构关系的研究进展。