A ferroelectric and ferroelastic 3D hexahedral curvilinear finite element

An isoparametric 3D electromechanical hexahedral finite element integrating a 3D phenomenological ferroelectric and ferroelastic constitutive law for domain switching effects is proposed. The model presents two internal variables which are the ferroelectric polarization (related to the electric field) and the ferroelastic strain (related to the mechanical stress). An implicit integration technique of the constitutive equations based on the return-mapping algorithm is developed. The mechanical strain tensor and the electric field vector are expressed in a curvilinear coordinate system in order to handle the transverse isotropy behavior of ferroelectric ceramics. The hexahedral finite element is implemented into the commercial finite element code Abaqus® via the subroutine user element. Some linear (piezoelectric) and non linear (ferroelectric and ferroelastic) benchmarks are considered as validation tests.     

Analysis of the electromechanical behavior of ferroelectric ceramics based on a nonlinear finite element model

A nonlinear finite element (FE) model based on domain switching was proposed to study the electromechanical behavior of ferroelectric ceramics. The incremental FE formulation was improved to avoid any calculation instability. The problems of mesh sensitivity and convergence, and the efficiency of the proposed nonlinear FE technique have been assessed to illustrate the versatility and potential accuracy of the said technique. The nonlinear electromechanical behavior, such as the hysteresis loops and butterfly curves, of ferroelectric ceramics subjected to both a uniform electric field and a point electric potential has been studied numerically. The results obtained are in good agreement with those of the corresponding theoretical and experimental analyses. Furthermore, the electromechanical coupling fields near (a) the boundary of a circular hole, (b) the boundary of an elliptic hole and (c) the tip of a crack, have been analyzed using the proposed nonlinear finite element method (FEM). The proposed nonlinear electromechanically coupled FEM is useful for the analysis of domain switching, deformation and fracture of ferroelectric ceramics.The project supported by the National Natural Science Foundation of China (10025209, 10132010 and 90208002), the Research Grants of the Council of the Hong Kong Special Administrative Region, China (HKU7086/02E) and the Key Grant Project of the Chinese Ministry of Education (0306)     

A phenomenological constitutive model for ferroelastic and ferroelectric hysteresis effects in ferroelectric ceramics

This paper is concerned with a macroscopic constitutive law for domain switching effects, which occur in ferroelectric ceramics. The three-dimensional model is thermodynamically consistent and is determined by two scalar valued functions: the Helmholtz free energy and a switching surface. In a kinematic hardening process the movement of the center of the switching surface is controlled by internal variables. In common usage, the remanent polarization and the irreversible strain are employed as internal variables. The novel aspect of the present work is to introduce an irreversible electric field, which serves instead of the remanent polarization as internal variable. The irreversible electric field has only theoretical meaning, but it makes the formulation very suitable for a finite element implementation, where displacements and the electric potential are the nodal degrees of freedom. The paper presents an appropriate implementation into a hexahedral finite brick element. The uni-axial constitutive model successfully reproduces the ferroelastic and the ferroelectric hysteresis as well as the butterfly hysteresis for ferroelectric ceramics. Furthermore it accounts for the mechanical depolarization effect, which occurs if the polarized ferroelectric ceramic is subjected to a compression stress.     

压电材料中切口/接头端部平面电弹性场奇异性有限元分析

为了对平面载荷作用下压电材料中切口或接头端部附近电弹性场奇异性问题进行分析，首先以应力平衡方程、Maxwell方程和和边界条件为基础，得到一种求解压电材料特征问题的弱式方程；其次，假定楔形切口或接头端部附近单元内位移和电势沿径向分布为指数形式，而周向方向分布则采用泡函数插值，将其代入弱式方程，建立一种只需对楔形切口或接头端部附近周边进行离散的一维简单有限元方法．压电材料的极化轴可以是任意方向．利用该有限元模型讨论了楔形切口角度、极化轴方向和边界条件对奇性场的影响．通过和其它特定情况下的现有解相比，证实了该文有限元数值方法的有效性，而且精度很高．     

Finite element simulation of a polycrystalline ferroelectric based on a multidomain single crystal switching model

In this paper, we compute the constitutive behavior of a ferroelectric ceramic by a plane strain finite element model, where each element represents a single grain in the polycrystal. The properties of a grain are described by the microscopic model for switching in multidomain single crystals of ferroelectric materials presented by Huber et al. [J. Mech. Phys. Solids 47 (1999) 1663]. The poling behavior of the polycrystal is obtained by employing the finite element formulation for electromechanical boundary value problems developed by Landis [Int. J. Numer. Meth. Eng. 55 (2002) 613]. In particular, we address the influence of the single grain properties and the interaction between grains, respectively.     

A finite element thermally coupled flow formulation for phase‐change problems

A finite element, thermally coupled incompressible flow formulation considering phase‐change effects is presented. This formulation accounts for natural convection, temperature‐dependent material properties and isothermal and non‐isothermal phase‐change models. In this context, the full Navier–Stokes equations are solved using a generalized streamline operator (GSO) technique. The highly non‐linear phase‐change effects are treated with a temperature‐based algorithm, which provides stability and convergence of the numerical solution. The Boussinesq approximation is used in order to consider the temperature‐dependent density variation. Furthermore, the numerical solution of the coupled problem is approached with a staggered incremental‐iterative solution scheme, such that the convergence criteria are written in terms of the residual vectors. Finally, this formulation is used for the solutions of solidification and melting problems validating some numerical results with other existing solutions obtained with different methodologies. Copyright © 2000 John Wiley & Sons, Ltd.     

Stress resultants plasticity with general closest point projection

In this paper, general closest point projection algorithm is derived for the elastoplastic behavior of a cross-section of a beam finite element. For given section deformations, the section forces (stress resultants) and the section tangent stiffness matrix are obtained as the response for the cross-section. Backward Euler time integration rule is used for the solution of the nonlinear evolution equations. The solution yields the general closest projection algorithm for stress resultants plasticity model. Algorithmic consistent tangent stiffness matrix for the section is derived. Numerical verification of the algorithms in a mixed formulation beam finite element proves the accuracy and robustness of the approach in simulating nonlinear behavior.     

铁电陶瓷PZT53复杂力电耦合行为的实验研究

通过实验研究了平行和垂直于极化方向的正应力对铁电陶瓷锆钛酸铅(PZT53)的电滞回线(E3-P3)和电致应变曲线(E-ε)的影响. 实验发现平行于极化方向的压应力对PZT53陶瓷的电滞回线、电致应变曲线形状以及矫顽场大小都有明显的影响,但是垂直于极化方向的拉、压应力只对PZT53陶瓷的电致应变曲线形状有明显的影响,但对电滞回线形状和矫顽场大小都没有显著影响. 采用畴翻转的模型详细解释了观察到的实验现象,所得结果为建立铁电陶瓷的多轴力、电耦合本构模型,提供了物理基础.     

Continuum thermodynamics of ferroelectric domain evolution: Theory, finite element implementation, and application to domain wall pinning

A continuum thermodynamics framework is devised to model the evolution of ferroelectric domain structures. The theory falls into the class of phase-field or diffuse-interface modeling approaches. Here a set of micro-forces and governing balance laws are postulated and applied within the second law of thermodynamics to identify the appropriate material constitutive relationships. The approach is shown to yield the commonly accepted Ginzburg-Landau equation for the evolution of the polarization order parameter. Within the theory a form for the free energy is postulated that can be applied to fit the general elastic, piezoelectric and dielectric properties of a ferroelectric material near its spontaneously polarized state. Thereafter, a principle of virtual work is specified for the theory and is implemented to devise a finite element formulation. The theory and numerical methods are used to investigate the fields near straight 180° and 90° domain walls and to determine the electromechanical pinning strength of an array of line charges on 180° and 90° domain walls.     

Mixed mode crack initiation in piezoelectric ceramic strip

When piezoelectric ceramics are subjected to mechanical and electrical load, they can fracture prematurely due to their brittle behavior. Hence, it is important to know the electro–elastic interaction and fracture behavior of piezoelectric materials. The problem of a through crack in a piezoelectric strip of finite thickness is studied in this paper. Fourier transforms are used to reduce the problem to the solution of singular integral equations. The model technique can solve for polarization in an arbitrary direction and material anisotropy. Numerical values of the crack-tip field amplification for a piezoelectric strip under in-plane electromechanical loading are obtained. Energy density factor criterion is applied to obtain the maximum of the minimum energy density and direction of crack initiation. The influence of crack length and crack position on stress intensity and energy density factors is discussed.     

An invariant formulation for phase field models in ferroelectrics

This paper introduces an electro-mechanically coupled phase field model for ferroelectric domain evolution based on an invariant formulation for transversely isotropic piezoelectric material behavior. The thermodynamic framework rests upon Gurtin’s notion of a micro-force system in conjunction with an associated micro-force balance. This leads to a formulation of the second law, from which a generalized Ginzburg–Landau evolution equation is derived. The invariant formulation of the thermodynamic potential provides a consistent way to obtain the order parameter dependent elastic stiffness, piezoelectric, and dielectric tensor. The model is reduced to 2d and implemented into a finite element framework. The material constants used in the simulations are adapted to meet the thermodynamic condition of a vanishing micro-force. It is found that the thermodynamic potential taken from the literature has to be extended in order to avoid a loss of positive definiteness of the stiffness and the dielectric tensor. The small-signal response is investigated in the presence and in the absence of the additional regularizing terms in the potential. The simulations show the pathological behavior of the model in case these terms are not taken into account. The paper closes with microstructure simulations concerning a ferroelectric nanodot subjected to an electric field, a cracked single crystal, and a ferroelectric bi-crystal.     

压电层合板结构振动控制的有限元法

利用有限元方法模拟压电结构的振动控制，从Ｈａｍｉｌｔｏｎ理论出发推导出具有压电传感器及激励器的层合板的电耦合动力方程，应用Ｌｙａｐｕｎｏｖ及负速度反馈控制算来实现振动的控制。     

Adaptive nodeless variable finite elements with flux-based formulation for thermal–structural analysis

A nodeless variable element method with the fluxbased formulation is developed to analyze two-dimensional thermal-structural problems. The nodeless variable formula- tion provides accurate temperature distributions to yield more accurate thermal stress solutions. The flux-based formulation is used to reduce the complexity in deriving the finite element equations as compared to the conventional finite element method. The solution accuracy is further improved by implementing an adaptive meshing technique to generate finite element meshes that can adapt and move along with the transient solution behavior. A version of a nearly optimal element size determination is proposed to provide high convergence rate of the predicted solutions. The combined procedure is evaluated by solving several thermal, structural, and thermal stress problems.     

A dynamic finite element method for inhomogeneous deformation and electromechanical instability of dielectric elastomer transducers

We present a three-dimensional nonlinear finite element formulation for dielectric elastomers. The mechanical and electrical governing equations are solved monolithically using an implicit time integrator, where the governing finite element equations are given for both static and dynamic cases. By accounting for inertial terms in conjunction with the Arruda–Boyce rubber hyperelastic constitutive model, we demonstrate the ability to capture the various modes of inhomogeneous deformation, including pull-in instability and wrinkling, that may result in dielectric elastomers that are subject to various forms of electrostatic loading. The formulation presented here forms the basis for needed computational tools that can elucidate the electromechanical behavior and properties of dielectric elastomers that are used for engineering applications.     

A 3D multi-field element for simulating the electromechanical coupling behavior of dielectric elastomers

We propose a multi-field implicit finite element method for analyzing the electromechanical behavior of dielectric elastomers. This method is based on a four-field variational principle, which includes displacement and electric potential for the electromechanical coupling analysis, and additional independent fields to address the incompressible constraint of the hyperelastic material. Linearization of the variational form and finite element discretization are adopted for the numerical implementation. A general FEM program framework is developed using C ++ based on the open-source finite element library deal.II to implement this proposed algorithm. Numerical examples demonstrate the accuracy, convergence properties, mesh-independence properties, and scalability of this method. We also use the method for eigenvalue analysis of a dielectric elastomer actuator subject to electromechanical loadings. Our finite element implementation is available as an online supplementary material.     

A thermomechanical model for the analysis of light alloy solidification in a composite mould

A coupled thermomechanical model to simulate light alloy solidification problems in permanent composite moulds is presented. This model is based on a general isotropic thermoelasto-plasticity theory and considers the different thermomechanical behaviours of each component of the mould as well as those of the solidifying material during its evolution from liquid to solid. To this end, plastic evolution equations, a phase-change variable and a specific free energy function are proposed in order to derive temperature-dependent material constitutive laws.The corresponding finite element formulation and the staggered scheme used to solve the coupled non-linear system of equations are also presented. Finally, the temperature and displacement predictions of the model are validated with laboratory measurements obtained during an experimental trial.     

A coupled temperature and strain rate dependent yield function for dynamic deformations of bcc metals

A coupled temperature and strain rate microstructure physically based yield function is proposed in this work. It is incorporated along with the Clausius–Duhem inequality and an appropriate free energy definition in a general thermodynamic framework for deriving a three-dimensional kinematical model for thermo-viscoplastic deformations of body centered cubic (bcc) metals. The evolution equations are expressed in terms of the material time derivatives of the elastic strain, accumulated plastic strain (isotropic hardening), and the back stress conjugate tensor (kinematic hardening). The viscoplastic multipliers are obtained using both the Consistency and Perzyna viscoplasticity models. The athermal yield function is employed instead of the static yield function in the case of the Perzyna viscoplasticity model. It is found that the static strain rate value, at which the material shows rate-independent behavior, varies with the material deformation temperature. Computational aspects of the proposed model are addressed through the finite element implementation with an implicit stress integration algorithm. Finite element simulations are performed by implementing the proposed viscoplasticity constitutive models in the commercial finite element program ABAQUS/Explicit [ABAQUS, 2003. User Manual, Version 6.3. Habbitt, Karlsson and Sorensen Inc., Providence, RI] via the user material subroutine coded as VUMAT. Numerical implementation for a simple compression problem meshed with one element is used to validate the proposed model implementation with applications to tantalum, niobium, and vanadium at low and high strain rates and temperatures. The analysis of a tensile shear banding is also investigated to show the effectiveness and the performance of the proposed framework in describing the strain localizations at high velocity impact. Results show mesh independency as a result of the viscoplastic regularization used in the proposed formulation.     

Three-dimensional general magneto-electro-elastic finite element model for multiphysics nonlinear analysis of layered composites

In this paper, by defining a general potential energy for the multiphase coupled multiferroics and applying the minimum energy principle, the coupled governing equations are derived. This system of equations is then discretized as a general three-dimensional(3D) finite element(FE) model based on the COMSOL software. After validating the formulation, it is then applied to the analysis and design of the common sandwich structure of multiferroics composites. Under the typical static loading, the ef...     

Computational modeling of domain wall interactions with dislocations in ferroelectric crystals

This paper provides a theoretical and numerical framework to investigate the interactions between domain walls and arrays of dislocations in ferroelectric single crystals. A phase-field approach is implemented in a non-linear finite element method to determine equilibrium solutions for the coupled electromechanical interactions between a domain wall and a dislocation array. The numerical simulations demonstrate the effect of the relative size and orientation of dislocations on 180° and 90° domain wall configurations. In addition, results for the pinning strength of dislocations in the case that domain walls move due the application of external electric field and shear stress are computed. The presented numerical results are compared with the findings reported for charged defects and it is shown that non-charged defects, such as dislocations, can also interact strongly with domain walls, and therefore affect the ferroelectric material behavior.     

On the constitutive modeling of coupled thermomechanical phase-change problems

This paper deals with a thermodynamically consistent numerical formulation for coupled thermoplastic problems including phase-change phenomena and frictional contact. The final goal is to get an accurate, efficient and robust numerical model, able for the numerical simulation of industrial solidification processes. Some of the current issues addressed in the paper are the following. A fractional step method arising from an operator split of the governing differential equations has been used to solve the nonlinear coupled system of equations, leading to a staggered product formula solution algorithm. Nonlinear stability issues are discussed and isentropic and isothermal operator splits are formulated. Within the isentropic split, a strong operator split design constraint is introduced, by requiring that the elastic and plastic entropy, as well as the phase-change induced elastic entropy due to the latent heat, remain fixed in the mechanical problem. The formulation of the model has been consistently derived within a thermodynamic framework. All the material properties have been considered to be temperature dependent. The constitutive behavior has been defined by a thermoviscous/elastoplastic free energy function, including a thermal multiphase change contribution. Plastic response has been modeled by a J2 temperature dependent model, including plastic hardening and thermal softening. The constitutive model proposed accounts for a continuous transition between the initial liquid state, the intermediate mushy state and the final solid state taking place in a solidification process. In particular, a pure viscous deviatoric model has been used at the initial fluid-like state. A thermomecanical contact model, including a frictional hardening and temperature dependent coupled potential, is derived within a fully consistent thermodinamical theory. The numerical model has been implemented into the computational finite element code COMET developed by the authors. Numerical simulations of solidification processes show the good performance of the computational model developed.