A framework for numerical integration of crystal elasto-plastic constitutive equations compatible with explicit finite element codes

In this paper we summarize the elements of a numerical integration scheme for elasto-plastic response of single crystals. This is intended to be compatible with large-scale explicit finite element codes and therefore can be used for problems involving multiple crystals and also overall behavior of polycrystalline materials. The steps described here are general for anisotropic elastic and plastic response of crystals. The crystallographic axes of the lattice are explicitly stored and updated at each time step. A plastic predictor–elastic corrector scheme is used to calculate the plastic strain rates on all active slip systems based on a rate-dependent physics-based constitutive model without the need of further auxiliary assumptions. Finally we present the results of numerous calculations using a physics-based rate- and temperature-dependent model of copper and the effect of elastic unloading, elastic crystal anisotropy, and deformation-induced lattice rotation are emphasized.     

A non-local implicit gradient-enhanced model for unstable behaviors of pseudoelastic shape memory alloys in tensile loading

In this paper, a gradient-enhanced 3-D phenomenological model for shape memory alloys using the non-local theory is developed based on a 1-D constitutive model. The method utilizes a non-local field variable in its constitutive framework with an implicit gradient formulation in order to achieve results independent of the finite element discretization. An efficient numerical approach to implement the non-local gradient-enhanced model in finite element codes is proposed. The model is used to simulate stress drop at the onset of transformation, and its performance is evaluated using different experimental data. The potential of the presented numerical approach for behavior of shape memory alloys in eliminating mesh-dependent simulations is validated by conducting various localization problems. The numerical results show that the developed model can simulate the observed unstable behaviors such as stress drop and deviation of local strain from global strain during nucleation and propagation of martensitic phase.     

Strain gradient effects on microscopic strain field in a metal matrix composite

The purpose of this paper is to demonstrate the improved modeling accuracy of a finite-deformation strain gradient crystal plasticity formulation over its classical counterpart by conducting a joint experimental and numerical investigation of the microscopic details of the deformation of a whisker-reinforced metal-matrix composite. The lattice rotation distribution around whiskers is obtained in thin foils using a TEM technique and is then correlated with numerical predictions based on finite element analyses of a unit-cell of a single crystal matrix containing a rigid whisker. The matrix material is first characterized by a classical, scale-independent crystal plasticity theory. It is found that the classical theory predicts a lattice rotation distribution with a spatial gradient much higher than experimentally measured. A strain gradient crystal plasticity formulation is then applied to model the matrix. The strain gradient formulation accounts for both strain hardening and strain gradient hardening. The deformation thus predicted exhibits a strong dependence on the size of the whisker. For a constitutive length scale comparable to the whisker diameter, the spatial gradient of the lattice rotation is several times lower than that predicted by the classical theory, and hence correlates significantly better with the experimental results.     

橡胶类材料大变形本构关系及其有限元方法

讨论大变形拟不可压缩模胶类材料的本构关系及有限元分析方法，采用乘法分解，将变形梯度表示成等容和体积变形两部分，在此基础上，推导了克希荷夫应力和格林应力表示的Ｙｅｏｈ形式应变能模胶类材料的本构关系及数值处理方法，为处理不可压缩问题，采用三场变分原理，其中静水压力，体积膨胀，以及位移均作为独立变量进行处理，并指出该变分原理同胡－鹫津广义变分原理的联系，变形采用相容等参插值，压力及体积膨胀采用低阶插值，     

Formulation and integration of the standard linear viscoelastic solid with fractional order rate laws

A physically sound three-dimensional anisotropic formulation of the standard linear viscoelastic solid with integer or fractional order rate laws for a finite set of the pertinent internal variables is presented. It is shown that the internal variables can be expressed in terms of the strain as convolution integrals with kernels of Mittag–Leffler function type. A time integration scheme, based on the Generalized Midpoint rule together with the Grünwald algorithm for numerical fractional differentiation, for integration of the constitutive response is developed. The predictive capability of the viscoelastic model for describing creep, relaxation and damped dynamic responses is investigated both analytically and numerically. The algorithm and the present general linear viscoelastic model are implemented into the general purpose finite element code Abaqus. The algorithm is then used together with an explicit difference scheme for integration of structural responses. In numerical examples, the quasi-static and damped responses of a viscoelastic ballast material that is subjected to loads simulating the overrolling of a train are investigated.     

A new finite element method for strain gradient theories and applications to fracture analyses

A new compatible finite element method for strain gradient theories is presented. In the new finite element method, pure displacement derivatives are taken as the fundamental variables. The new numerical method is successfully used to analyze the simple strain gradient problems – the fundamental fracture problems. Through comparing the numerical solutions with the existed exact solutions, the effectiveness of the new finite element method is tested and confirmed. Additionally, an application of the Zienkiewicz–Taylor C1 finite element method to the strain gradient problem is discussed. By using the new finite element method, plane-strain mode I and mode II crack tip fields are calculated based on a constitutive law which is a simple generalization of the conventional J₂ deformation plasticity theory to include strain gradient effects. Three new constitutive parameters enter to characterize the scale over which strain gradient effects become important. During the analysis the general compressible version of Fleck–Hutchinson strain gradient plasticity is adopted. Crack tip solutions, the traction distributions along the plane ahead of the crack tip are calculated. The solutions display the considerable elevation of traction within the zone near the crack tip.     

Meso approaches for the creep damage behavior of nickel-base directionally solidified superalloys

IntroductionNickel-basehightemperatureresistancesuperalloysarsewidelyusedingasturbinesandjetengines.DireetionallysolidificationwasintroducedtoenhancecreepsbengthbyelindnahnggrainboundariesnormaltotheappliedstresswherevoidsarelikelytOoccurundercreepload.Inpractice,however,theappliedstressmaynotbeuniaxialnordirectedparalleltOthegrainboundaries.Singlecrystalswerethusdeveloped.CongregationoflowtempefAnremeltingelementsongrainboundaries,grainboundaryoxidation)etc.,areadditionalfactorsthatwoulddeg…     

Nonlocal implicit gradient-enhanced elasto-plasticity for the modelling of softening behaviour

An improved gradient-enhanced approach for softening elasto-plasticity is proposed, which in essence is fully nonlocal, i.e. an equivalent integral nonlocal format exists. The method utilises a nonlocal field variable in its constitutive framework, but in contrast to the integral models computes this nonlocal field with a gradient formulation. This formulation is considered ‘implicit’ in the sense that it strictly incorporates the higher-order gradients of the local field variable indirectly, unlike the common (explicit) gradient approaches. Furthermore, this implicit gradient formulation constitutes an additional partial differential equation (PDE) of the Helmholtz type, which is solved in a coupled fashion with the standard equilibrium condition. Such an approach is particularly advantageous since it combines the long-range interactions of an integral (nonlocal) model with the computational efficiency of a gradient formulation. Although these implicit gradient approaches have been successfully applied within damage mechanics, e.g. for quasi-brittle materials, the first attempts were deficient for plasticity. On the basis of a thorough comparison of the gradient-enhancements for plasticity and damage this paper rephrases the problem, which leads to a formulation that overcomes most reported problems. The two-dimensional finite element implementation for geometrically linear plain strain problems is presented. One- and two-dimensional numerical examples demonstrate the ability of this method to numerically model irreversible deformations, accompanied by the intense localisation of deformation and softening up to complete failure.     

Deformation and failure mechanisms of single crystal superalloy under temperature gradient

The crystallographic constitutive model under temperature gradient is developed and introduced to study the deformation and failure mechanisms of single crystal superalloy. Tensile tests of thin-walled pipe specimen at different temperatures without cooled air flow were carried out. Based on the experimental results, the temperature dependence of constitutive model was studied and the basic parameters of constitutive model were obtained. To investigate the deformation and failure mechanisms, the thin-walled pipe specimen with cooled air flow under temperature gradient were tested. Considered the fluid-solid interface (FSI), a finite element method (FEM) was proposed to simulate the process of tension. In FEM, the activation rate of slip system was defined as the failure law of specimen under temperature gradient. The simulation result was in good agreement with the experiment result. Furthermore, the fracture surface of the specimen was observed by the scanning electron microscopy (SEM). The microstructure revealed that the slip deformation belonged to {1 1 1} crystalplane is a principal failure mechanism of single crystal superalloy under temperature gradient. The results of the SEM also implied that the proposed FEM method can be used to systemically study the deformation and failure behavior of single crystal superalloy cooled blade.     

延性单晶非均匀变形的三维有限元模拟

对延性单晶在拉伸载荷作用下的应变局域化和颈缩等非均匀变形过程进行了三维有限元数值模拟。将相关晶体塑性本构模型及一种新的数值积分方法补充到ABAQUS6.1商用有限元软件中。该方法的特点是，利用晶体塑性的动力学方程，获得一个关于晶体弹性变形梯度的演化方程，采用半隐式积分方案进行求解。本文推导出一种新的应力变本构矩阵。按此方式更新本构矩阵，计算速度和计算稳定性大大提高。加载方式，边界条件和变形程度等因素影响着滑移系的启动状况，这是平面模型所不能预测的。本文利用三维有限元方法模拟了不同取向下滑移系的启动状况，全面地考虑了FCC单晶材料12个可能滑移系在变形过程中的启动状况，合理地模拟了FCC面心立方单晶沿不同取向加载时晶轴旋转导致的应变局域化和颈缩等非均匀变形过程。     

A mixed finite element scheme for viscoelastic flows with XPP model

A mixed finite element formulation for viscoelastic flows is derived in this paper, in which the FIC （finite incremental calculus） pressure stabilization process and the DEVSS （discrete elastic viscous stress splitting） method using the Crank-Nicolson-based split are introduced within a general framework of the iterative version of the fractional step algorithm. The SU （streamline-upwind） method is particularly chosen to tackle the convective terms in constitutive equations of viscoelastic flows. Thanks to the proposed scheme the finite elements with equal low-order interpolation approximations for stress-velocity-pressure variables can be successfully used even for viscoelastic flows with high Weissenberg numbers. The XPP （extended Pom-Pom） constitutive model for describing viscoelastic behaviors is particularly integrated into the proposed scheme. The numerical results for the 4：1 sudden contraction flow problem demonstrate prominent stability, accuracy and convergence rate of the proposed scheme in both pressure and stress distributions over the flow domain within a wide range of the Weissenberg number, particularly the capability in reproducing the results, which can be used to explain the ＂die swell＂ phenomenon observed in the polymer injection molding process.     

Spatial representation of evolving anisotropy at large strains

A phenomenological model for evolving anisotropy at large strains is presented. The model is formulated using spatial quantities and the anisotropic properties of the material is modeled by including structural variables. Evolution of anisotropy is accounted for by introducing substructural deformation gradients which are linear maps similar to the usual deformation gradient. The evolution of the substructural deformation gradients is governed by the substructural plastic velocity gradients in a manner similar to that for the continuum. Certain topics related to the numerical implementation are discussed and a simple integration scheme for the local constitutive equations is developed. To demonstrate the capabilities of the model it is implemented into a finite element code. Two numerical examples are considered: deformation of uniform plate with circular hole and the drawing of a cup. In the two examples it is assumed that initial cubic material symmetry applies to both the elastic and plastic behavior. To be specific, a polyconvex Helmholtz free energy function together with a yield function of quadratic type is adopted.     

A Newton method for three-dimensional fretting problems

The present paper concerns the numerical treatment of fretting problems using a finite element analysis. The governing equations resulting from a formal finite element discretization of an elastic body with a potential contact surface are considered in a quasi-static setting. The constitutive equations of the potential contact surface are Signorinis contact conditions, Coulombs law of friction and Archards law of wear. Using a backward Euler time discretization and an approach based on projections, the governing equations are written as an augmented Lagrangian formulation which is implemented and solved using a Newton algorithm for three-dimensional fretting problems of didactic nature. Details concerning the implementation are provided.     

Two-dimensional modeling of heterogeneous structures using graded finite element and boundary element methods

In the present work, graded finite element and boundary element methods capable of modeling behaviors of structures made of nonhomogeneous functionally graded materials (FGMs) composed of two constituent phases are presented. A numerical implementation of Somigliana’s identity in two-dimensional displacement fields of the isotropic nonhomogeneous problems is presented using the graded elements. Based on the constitutive and governing equations and the weighted residual technique, effective boundary element formulations are implemented for elastic nonhomogeneous isotropic solid models. Results of the finite element method are derived based on a Rayleigh–Ritz energy formulation. The heterogeneous structures are made of combined ceramic–metal materials, in which the material properties vary continuously along the in-plane or thickness directions according to a power law. To verify the present work, three numerical examples are provided in the paper.     

Modeling single crystals: time integration,tangent operators,sensitivity analysis and shape optimization

In this paper, a comprehensive overview of the numerical analysis of single crystalline materials at high temperatures is presented, including implicit higher order time integration, consistent linearization and respective sensitivity analysis. Both a phenomenological and a crystallographic model are employed to simulate the mechanical isothermal behavior of the nickel-based superalloy CMSX-4 at 950°C in a finite element environment. A shape optimization methodology for testing specimen design based on extensive finite element computations is presented. The sensitivity analysis according to the chosen time integration scheme is performed leading to an algorithm for simultaneous analysis and design (SAND). Examples for the shape optimization of a cruciform specimen for biaxial tensile experiments at high temperatures are given and discussed in detail.     

Crystal plasticity model with enhanced hardening by geometrically necessary dislocation accumulation

A strain gradient dependent crystal plasticity approach is used to model the constitutive behaviour of polycrystal FCC metals under large plastic deformation. Material points are considered as aggregates of grains, subdivided into several fictitious grain fractions: a single crystal volume element stands for the grain interior whereas grain boundaries are represented by bi-crystal volume elements, each having the crystallographic lattice orientations of its adjacent crystals. A relaxed Taylor-like interaction law is used for the transition from the local to the global scale. It is relaxed with respect to the bi-crystals, providing compatibility and stress equilibrium at their internal interface. During loading, the bi-crystal boundaries deform dissimilar to the associated grain interior. Arising from this heterogeneity, a geometrically necessary dislocation (GND) density can be computed, which is required to restore compatibility of the crystallographic lattice. This effect provides a physically based method to account for the additional hardening as introduced by the GNDs, the magnitude of which is related to the grain size. Hence, a scale-dependent response is obtained, for which the numerical simulations predict a mechanical behaviour corresponding to the Hall-Petch effect. Compared to a full-scale finite element model reported in the literature, the present polycrystalline crystal plasticity model is of equal quality yet much more efficient from a computational point of view for simulating uniaxial tension experiments with various grain sizes.     

Numerical implementation of a thermo-elastic–plastic constitutive equation in consideration of transformation plasticity in welding

Finite element analysis of welding processes, which entail phase evolution, heat transfer and deformations, is considered in this paper. Attention focuses on numerical implementation of the thermo-elastic–plastic constitutive equation proposed by Leblond et al. [J. Mech. Phys. Solids 34(4) (1986a) 395; J. Mech. Phys. Solids 34(4) (1986b) 411] in consideration of the transformation plasticity. Based upon the multiplicative decomposition of deformation gradient, hyperelastoplastic formulation is borrowed for efficient numerical implementation, and the algorithmic consistent moduli for elastic–plastic deformations including transformation plasticity are obtained in the closed form. The convergence behavior of the present implementation is demonstrated via a couple of numerical examples.     

Characterization of macroscopic tensile strength of polycrystalline metals with two-scale finite element analysis

The objective of this contribution is to develop an elastic-plastic-damage constitutive model for crystal grain and to incorporate it with two-scale finite element analyses based on mathematical homogenization method, in order to characterize the macroscopic tensile strength of polycrystalline metals. More specifically, the constitutive model for single crystal is obtained by combining hyperelasticity, a rate-independent single crystal plasticity and a continuum damage model. The evolution equations, stress update algorithm and consistent tangent are derived within the framework of standard elastoplasticity at finite strain. By employing two-scale finite element analysis, the ductile behaviour of polycrystalline metals and corresponding tensile strength are evaluated. The importance of finite element formulation is examined by comparing performance of several finite elements and their convergence behaviour is assessed with mesh refinement. Finally, the grain size effect on yield and tensile strength is analysed in order to illustrate the versatility of the proposed two-scale model.