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Katarzyna Kowalczyk-Gajewska

Publications and source records attributed to Katarzyna Kowalczyk-Gajewska.

9 recordsLinked to original sources

Quantifying the effects of particle clustering in random thermoelastic composites -- numerical and mean-field analyses

The effect of space distribution of randomly-placed particles in a representative composite volume on the thermoelastic effective properties and local stress and strain distribution is analyzed. Quantitative assessment is performed using both the full-field finite element analyses and the mean-field interaction model, known also as a ''cluster'' model. The latter model is developed in the multi-family setting enabling one to study the mean stress and strain separately for each inclusion of the representative unit cell. The particles are assumed to be spherical and of equal size, while considered examples differ by the volume fraction of inclusions and mean nearest-neighbour distances.

cond-mat.soft↗

Modeling the Effects of Slip, Twinning, and Notch on the Deformation of Single-Crystal Austenitic Manganese Steel

The objective of this work is to deconvolute the interaction of slip, twinning, and notch on the deformation response of an austenitic manganese (Hadfield) steel using detailed finite element simulations. The simulations employ a rate-dependent crystal plasticity constitutive model that incorporates both slip and twinning deformation mechanisms. The model accounts for the spatially non-uniform appearance of new twin-related orientations, hardening due to slip--twin interactions, and modified properties of the twinned crystal. Limited experiments on single-crystal dog-bone and single-edge notch specimens, with two crystal orientations, are also conducted to aid the simulation. Several features of the experimental observations are accurately captured in the simulations. For example, simulations accurately capture distinct stress--strain responses associated with different crystallographic orientations, including variations in initial hardening behavior followed by either decreasing or increasing hardening depending on the dominant deformation mechanisms. The simulation also captures the observed orientation-dependent asymmetric deformation of the notch in single-edge notch specimens. Additionally, by selectively activating deformation mechanisms, the role of twinning is isolated and its influence on both global and local response is clearly demonstrated. These results provide a mechanistic understanding of how deformation mode interactions and local geometry (i.e., notch) influence the response of these materials.

cond-mat.mtrl-sci↗

An additive Mori-Tanaka scheme for elastic-viscoplastic composites based on a modified tangent linearization

Mean-field modeling based on the Eshelby inclusion problem poses some difficulties when the non-linear Maxwell-type constitutive law is used for elasto-viscoplasticity. One difficulty is that this behavior involves different orders of time differentiation, which leads a long-term memory effect. One of the possible solutions to this problem is the additive interaction law. Generally, mean field models solely use the mean values of stress and strain fields per phase, while variational approaches consider the second moments of stresses and strains. It is seen that the latter approach improves model predictions allowing to account for stress fluctuation within the phases. However, the complexity of the variational formulations still makes them difficult to apply in the large scale finite element calculations and for non-proportional loadings. Thus, there is a need to include the second moments within homogenization models based on the additive interaction law. In the present study, the incorporation of the second moments of stresses into the formulation of the additive Mori-Tanaka model of two-phase elastic-viscoplastic material is discussed. A modified tangent linearization of the viscoplastic law is proposed, while the Hill-Mandel's lemma is used to track the evolution of second moments of stresses. To study the model performance and efficiency, the results are compared to the full-field numerical calculations and predictions of other models available in the literature. Very good performance of the modified tangent linearization is demonstrated from these benchmarks for both monotonic and non monotonic loading responses.

physics.comp-ph↗

Anisotropic effect of regular particle distribution in elastic-plastic composites: The modified tangent cluster model and numerical homogenization

The goal of this paper is to develop a reliable analytical approach to finding the effective elastic-plastic response of metal matrix composites (MMC) and porous metals (PM) with a predefined particle or void distribution, as well as to examine the anisotropy induced by regular inhomogeneity arrangements. The proposed framework is based on the idea of Molinari & El Mouden (1996) to improve classical mean-field models of thermoelastic media by taking into account the interactions between each pair of inhomogeneities within the material volume, known as a cluster model. Both elastic and elasto-plastic regimes are examined. A new extension of the original formulation, aimed to account for the non-linear plastic regime, is performed with the use of the modified tangent linearization of the metal matrix constitutive law. The model uses the second stress moment to track the accumulated plastic strain in the matrix. In the examples, arrangements of spherical inhomogeneities in three Bravais lattices of cubic symmetry (Regular Cubic, Body-Centered Cubic and Face-Centered Cubic) are considered for two basic material scenarios: "hard-in-soft" (MMC) and "soft-in-hard" (PM). As a means of verification, the results of micromechanical mean-field modeling are compared with those of numerical homogenization performed using the Finite Element Method (FEM). In the elastic regime, a comparison is also made with several other micromechanical models dedicated to periodic composites. Within both regimes, the results obtained by the cluster model are qualitatively and quantitatively consistent with FEM calculations, especially for volume fractions of inclusions up to 40%.

cond-mat.mtrl-sci↗

The effect of initial texture on multiple necking formation in polycrystalline thin rings subjected to dynamic expansion

In this paper, we have investigated, using finite element calculations, the effect of initial texture on the formation of multiple necking patterns in ductile metallic rings subjected to rapid radial expansion. The mechanical behavior of the material has been modeled with the elasto-viscoplastic single crystal constitutive model developed by \citet{marin2006}. The polycrystalline microstructure of the ring has been generated using random Voronoi seeds. Both $5000$ grain and $15000$ grain aggregates have been investigated, and for each polycrystalline aggregate three different spatial distributions of grains have been considered. The calculations have been performed within a wide range of strain rates varying from $1.66 \cdot 10^4 ~ \text{s}^{-1}$ to $3.33 \cdot 10^5 ~ \text{s}^{-1}$, and the rings have been modeled with four different initial textures: isotropic texture, $\left\langle 001\right\rangle\parallelΘ$ Goss texture, $\left\langle 001\right\rangle\parallel$ R Goss texture and $\left\langle 111\right\rangle\parallel$ Z fiber texture. The finite element results show that: (i) the spatial distribution of grains affects the location of the necks, (ii) the decrease of the grain size delays the formation of the necking pattern and increases the number of necks, (iii) the initial texture affects the number of necks, the location of the necks, and the necking time, (iv) the development of the necks is accompanied by a local increase of the slip activity. This work provides new insights into the effect of crystallographic microstructure on dynamic plastic localization and guidelines to tailor the initial texture in order to delay dynamic necking formation and, thus, to improve the energy absorption capacity of ductile metallic materials at high strain rates.

cond-mat.mtrl-sci↗

Cylindrical void growth vs. grain fragmentation in FCC single crystals: CPFEM study for two types of loading conditions

The crystal plasticity finite element method (CPFEM) is used to investigate the coupling between the cylindrical void growth or collapse and grain refinement in face-centered cubic (FCC) single crystals. A 2D plane strain model with one void is used. The effect of the initial lattice orientation, similarities, and differences between stress- and strain-driven loading scenarios are explored. To this end, boundary conditions are enforced in two different ways. The first one is based on maintaining constant in-plane stress biaxiality via a dedicated truss element, while the second one is imposing a constant displacement biaxiality factor. Uniaxial and biaxial loading cases are studied. For the uniaxial loading case a special configuration, which enforces an equivalent pattern of plastic deformation in the pristine crystal, is selected in order to investigate the mutual interactions between the evolving void and the developed lattice rotation heterogeneity. Next, biaxial loading cases are considered for three crystal orientations, one of which is not symmetric with respect to loading directions. It is analysed how stress or strain biaxility factors and initial lattice orientation influence the void evolution in terms of its size and shape. Moreover, the consequences of variations in the resulting heterogeneity of lattice rotation are studied in the context of the grain refinement phenomenon accompanying the void evolution. Scenarios that may lead to more advanced grain fragmentation are identified.

cond-mat.mtrl-sci↗

Atomistic and mean-field estimates of effective stiffness tensor of nanocrystalline materials of hexagonal symmetry

Anisotropic core-shell model of a nano-grained polycrystal is extended to estimate the effective elastic stiffness of several metals of hexagonal crystal lattice symmetry. In the approach the bulk nanocrystalline material is described as a two-phase medium with different properties for a grain boundary zone and a grain core. While the grain core is anisotropic, the boundary zone is isotropic and has a thickness defined by the cutoff radius of a corresponding atomistic potential for the considered metal. The predictions of the proposed meanfield model are verified with respect to simulations performed with the use of the Large-scale Atomic/Molecular Massively Parallel Simulator, the Embedded Atom Model, and the molecular statics method. The effect of the grain size on the overall elastic moduli of nanocrystalline material with random distribution of orientations is analysed.

physics.comp-ph↗

Atomistic and mean-field estimates of effective stiffness tensor of nanocrystalline materials of cubic symmetry

Anisotropic core-shell model of a nano-grained polycrystal, proposed recently for nanocrystalline copper, is applied to estimate elastic effective properties for a set of crystals of cubic symmetry. Materials selected for analysis differ in the lattice geometry (face-centered cubic vs. body-centered cubic) as well as the value of a Zener factor: a ratio of two shear moduli defining elastic anisotropy of a cubic crystal. The predictions are verified by means of the atomistic simulations. The dependence of the overall bulk and shear moduli on the average grain diameter is analysed. In the mean-field approach the thickness of the shell is specified by the \emph{cutoff radius} of a corresponding atomistic potential, while the grain shell is isotropic and its properties are identified by molecular simulations performed for very small grains with approximately all atoms belonging to the grain boundary zone. It is shown that the core-shell model provides predictions of satisfactory qualitative and quantitative agreement with atomistic simulations. Performed study indicates that the variation of the bulk and shear moduli with the grain size changes qualitatively when the Zener anisotropy factor is smaller or greater than one.

physics.comp-ph↗

Atomistic and mean-field estimates of effective stiffness tensor of nanocrystalline copper

The full elasticity tensor for nano-crystalline copper is derived in molecular simulations by performing numerical tests for a set of generated samples of the polycrystalline material. The results are analysed with respect to the anisotropy degree of the overall stiffness tensor resulting from the limited number of grain orientations and their spatial distribution. The dependence of the overall bulk and shear moduli of an isotropized polycrystal on the average grain diameter is analysed. It is found that while the shear modulus decreases with grain size, the bulk modulus shows negligible dependence on the grain diameter and is close to the bulk modulus of a single crystal. A closed-form mean-field model of effective elastic properties for a bulk nano-grained polycrystal with cubic grains, i.e. made of a material with cubic symmetry, is formulated. In the model all parameters are based on the data for a single crystal and on the averaged grain size without any need for additional fitting. It is shown that the proposed model provides predictions of satisfactory qualitative and quantitative agreement with atomistic simulations.

physics.comp-ph↗