A fundamental prerequisite for the micromechanical simulation of fatigue is the appropriate modelling of the effective cyclic properties of the considered material. Therefore, kinematic hardening formulations on the slip system level are of crucial importance due to their fundamental relevance in cyclic material modelling. The focus of this study is the comparison of three different kinematic hardening models (Armstrong Frederick, Chaboche, and Ohno–Wang). In this work, investigations are performed on the modelling and prediction of the cyclic stress-strain behavior of the martensitic high-strength steel SAE 4150 for two different total strain ratios (R ε = −1 and R ε = 0). In the first step, a three-dimensional martensitic microstructure model is developed by using multiscale Voronoi tessellations. Based on this martensitic representative volume element, micromechanical simulations are performed by a crystal plasticity finite element model. For the constitutive model calibration, a new multi-objective calibration procedure incorporating a sensitivity analysis as well as an evolutionary algorithm is presented. The numerical results of different kinematic hardening models are compared to experimental data with respect to the appropriate modelling of the Bauschinger effect and the mean stress relaxation behavior at R ε = 0. It is concluded that the Ohno–Wang model is superior to the Armstrong Frederick and Chaboche kinematic hardening model at R ε = −1 as well as at R ε = 0.

Micromechanical modeling of material behavior has become an accepted approach to describe the macroscopic mechanical properties of polycrystalline materials in a microstructure-sensitive way. The microstructure is modeled by a representative volume element (RVE), and the anisotropic mechanical behavior of individual grains is described by a crystal plasticity model. Such micromechanical models are subjected to mechanical loads in a finite element (FE) simulation and their macroscopic behavior is obtained from a homogenization procedure. However, such micromechanical simulations with a discrete representation of the material microstructure are computationally very expensive, in particular when conducted for 3D models, such that it is prohibitive to apply them for process simulations of macroscopic components. In this work, we suggest a new approach to develop microstructure-sensitive, yet flexible and numerically efficient macroscopic material models by using micromechanical simulations for training Machine Learning (ML) algorithms to capture the mechanical response of various microstructures under different loads. In this way, the trained ML algorithms represent a new macroscopic constitutive relation, which is demonstrated here for the case of damage modeling. In a second application of the combination of ML algorithms and micromechanical modeling, a proof of concept is presented for the application of trained ML algorithms for microstructure design with respect to desired mechanical properties. The input data consist of different stress-strain curves obtained from micromechanical simulations of uniaxial testing of a wide range of microstructures. The trained ML algorithm is then used to suggest grain size distributions, grain morphologies and crystallographic textures, which yield the desired mechanical response for a given application. For validation purposes, the resulting grain microstructure parameters are used to generate RVEs, accordingly and the macroscopic stress-strain curves for those microstructures are calculated and compared with the target quantities. The two examples presented in this work, demonstrate clearly that ML methods can be trained by micromechanical simulations, which capture material behavior and its relation to Reimann et al. Application of Micromechanical Modeling on Machine Learningmicrostructural mechanisms in a physically sound way. Since the quality of the ML algorithms is only as good as that of the micromechanical model, it is essential to validate these models properly. Furthermore, this approach allows a hybridization of experimental and numerical data.

Abstract

Fatigue is an important mechanism for the failure of components in many engineering applications and a significant proportion of the fatigue life is spent in the crack initiation phase. Although a large number of research work addresses fatigue life and fatigue crack growth, the problem of modeling crack initiation remains a major challenge in the scientific and engineering community. In the present work, a micromechanical model is developed and applied to study fatigue crack initiation. In particular, the effect of different hardening mechanisms on fatigue crack initiation is investigated. To accomplish this, a model describing the evolution of the particular dislocation structures observed under cyclic plastic deformation is implemented and applied on randomly generated representative microstructures to investigate fatigue crack initiation. Finally, a method is presented to calculate the S-N curve for the polycrystalline materials. With this work, it is demonstrated how the micromechanical modeling can support the understanding of damage and failure mechanisms occurring during fatigue.

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