Co-reporter:Sudipto Mandal, Brian T. Gockel, Anthony D. Rollett
Materials & Design 2017 Volume 132(Volume 132) pp:
Publication Date(Web):15 October 2017
DOI:10.1016/j.matdes.2017.06.050
•Canonical correlation analysis (CCA) used for quantifying parameter sensitivities in a constitutive model.•Conventionally used local sensitivity techniques were compared to global methods.•CCA, a multivariate global sensitivity technique, facilitated a better understanding of parameter interrelationships.•Independent validation tests were conducted based on both experimental observations and literature sources•Both validation exercises showed that CCA predictions match the trends in optimized parameters for titanium alloys.Successful modeling of a material's deformation behavior is dependent on the development of realistic constitutive models that can mimic the actual response of the material of interest. In-depth knowledge about the parameters in a constitutive model will lead to a better understanding of the relationship between flow stress and deformation conditions and will eventually aid in better design of the deformation process. Curve-fitting is generally employed to calibrate constitutive models using experimental data. However, the relative impact of constitutive model parameters on the mechanical response for different models has not been extensively explored. In this study, both local and global sensitivity analysis methods are used to understand and quantify the contribution of the parameters. Canonical correlation analysis (CCA) has been used to understand the effect of constitutive model parameters on the flow stress behavior of titanium alloys. This analysis has been performed for the Mechanical Threshold Stress (MTS) model, which is a constitutive description based on the physics of dislocation motion. The limitations of local sensitivity methods have been highlighted and it has been shown that CCA provides a measure of both an individual variable's contribution and the effectiveness of the parameter set as a whole.Download high-res image (239KB)Download full-size image
Co-reporter:Sudipto Mandal, Brian T. Gockel, Shanoob Balachandran, Dipankar Banerjee, Anthony D. Rollett
International Journal of Plasticity 2017 Volume 94(Volume 94) pp:
Publication Date(Web):1 July 2017
DOI:10.1016/j.ijplas.2017.02.008
•Constitutive modeling of uniaxial compression tests for Ti-5553 in both the single-phase and two-phase regimes.•Voce and Mechanical Threshold Stress (MTS) models implemented in the viscoplastic self-consistent (VPSC) framework.•Voce model shown to fit the individual deformation responses accurately; however, no consistent trends observed.•Dislocation-based MTS model shown to fit for a wide range of deformation conditions accurately using the same parameters.•Validation of the single-phase MTS model, showing that same parameter set is applicable to the set of related alloys.Titanium alloy Ti-5Al-5Mo-5V-3Cr (Ti-5553) is a near beta alloy used in structural aircraft components because of its excellent mechanical properties. Simulating the mechanical response of this material using constitutive models is an important step in understanding the relationship between its microstructure and properties. Uniaxial compression tests were conducted at temperatures both below and above the β transus and at different loading rates. A viscoplastic self-consistent (VPSC) model was used to match the stress-strain response of the Ti-5553 alloy based on uniaxial compression tests across a range of temperatures and strain rates. Sets of parameter values were determined for two different hardening models, namely the modified Voce model, which is empirical, and the Mechanical Threshold Stress (MTS) model, which is based on dislocation theory. No consistent trends in the Voce parameter values were found as a function of temperature or strain rate. By contrast, the physically-based MTS model, which is explicitly designed to cover wide ranges of deformation conditions, was able to fit a wide range of temperatures and strain rates. It was further validated by comparison with experimental measurements with other β titanium alloys that had similar compositions.Download high-res image (263KB)Download full-size image
Co-reporter:S.P. Donegan, A.D. Rollett
Acta Materialia 2015 Volume 96() pp:212-228
Publication Date(Web):1 September 2015
DOI:10.1016/j.actamat.2015.06.019
Abstract
A numerical method for solving the thermoelastic problem in heterogeneous polycrystals based on fast Fourier transforms is applied to thermal barrier coating systems. Several high resolution microstructures are generated synthetically to approximate thermal barrier coatings, with control over the grain size, grain morphology, and texture. Interfaces between coating layer materials are further modified by applying a localized Potts model to introduce interface rumpling. The global results of residual stress and elastic energy density are compared across the various microstructure instantiations. The local variations in elastic energy density are correlated to the amount of interface rumpling. The simulation result are also compared to an analytical result for an idealized interface morphology. The implications of the behavior of the local variations in elastic energy density are discussed in the context of thermal barrier coating failure.
Co-reporter:B.S. Anglin, R.A. Lebensohn, A.D. Rollett
Computational Materials Science 2014 Volume 87() pp:209-217
Publication Date(Web):May 2014
DOI:10.1016/j.commatsci.2014.02.027
•A full-field thermoelastic spectral method is presented.•Spherical and cylindrical, homogeneous and inhomogeneous inclusion configurations are studied.•The spectral method predictions show agreement with analytical solutions for different geometries.•The effect of voxelization on local fields near interfaces is also assessed.A numerical method based on Fast Fourier Transforms to compute the thermoelastic response of heterogeneous materials is presented and validated by comparison with analytical solutions of the Eshelby inclusion problem. Spherical and cylindrical, homogeneous and inhomogeneous inclusion configurations are used to validate the results of the proposed spectral method. Dependencies of the numerical solutions on homogeneity, geometry and resolution are also explored, and the differences with respect to known analytical solutions are quantified and discussed. In the case of homogeneous inclusions, the proposed numerical method is direct, i.e. does not require iteration. Using enough resolution, the micromechanical fields predicted for these simple geometries are shown to be in good agreement with the analytical results. The specific way in which inclusions are voxelized is also explored, and its effect on local fields near interfaces is assessed.
Co-reporter:A.D. Rollett, D. Raabe
Computational Materials Science 2001 Volume 21(Issue 1) pp:69-78
Publication Date(Web):May 2001
DOI:10.1016/S0927-0256(00)00216-0
A brief summary of simulation techniques for recrystallization is given. The limitations of the Potts model and the cellular automaton model as used in their standard forms for grain growth and recrystallization are noted. A new approach based on a hybrid of the Potts model (MC) and the cellular automaton (CA) model is proposed in order to obtain the desired limiting behavior for both curvature-driven and stored energy-driven grain boundary migration.