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Complementing a continuum thermodynamic approach to constitutive modeling with symbolic regression

Journal of the Mechanics and Physics of Solids

Garbrecht, Karl; Birky, Donovan; Lester, Brian T.; Emery, John M.; Hochhalter, Jacob

An interpretable machine learning method, physics-informed genetic programming-based symbolic regression (P-GPSR), is integrated into a continuum thermodynamic approach to developing constitutive models. The proposed strategy for combining a thermodynamic analysis with P-GPSR is demonstrated by generating a yield function for an idealized material with voids, i.e., the Gurson yield function. First, a thermodynamic-based analysis is used to derive model requirements that are exploited in a custom P-GPSR implementation as fitness criteria or are strongly enforced in the solution. The P-GPSR implementation improved accuracy, generalizability, and training time compared to the same GPSR code without physics-informed fitness criteria. The yield function generated through the P-GPSR framework is in the form of a composite function that describes a class of materials and is characteristically more interpretable than GPSR-derived equations. The physical significance of the input functions learned by P-GPSR within the composite function is acquired from the thermodynamic analysis. Fundamental explanations of why the implemented P-GPSR capabilities improve results over a conventional GPSR algorithm are provided.

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Bayesian optimal experimental design for constitutive model calibration

International Journal of Mechanical Sciences

Ricciardi, Denielle; Seidl, Daniel T.; Lester, Brian T.; Jones, Elizabeth M.; Jones, Amanda

Computational simulation is increasingly relied upon for high/consequence engineering decisions, which necessitates a high confidence in the calibration of and predictions from complex material models. However, the calibration and validation of material models is often a discrete, multi-stage process that is decoupled from material characterization activities, which means the data collected does not always align with the data that is needed. To address this issue, an integrated workflow for delivering an enhanced characterization and calibration procedure—Interlaced Characterization and Calibration (ICC)—is introduced and demonstrated. Further, this framework leverages Bayesian optimal experimental design (BOED), which creates a line of communication between model calibration needs and data collection capabilities in order to optimize the information content gathered from the experiments for model calibration. Eventually, the ICC framework will be used in quasi real-time to actively control experiments of complex specimens for the calibration of a high-fidelity material model. This work presents the critical first piece of algorithm development and a demonstration in determining the optimal load path of a cruciform specimen with simulated data. Calibration results, obtained via Bayesian inference, from the integrated ICC approach are compared to calibrations performed by choosing the load path a priori based on human intuition, as is traditionally done. The calibration results are communicated through parameter uncertainties which are propagated to the model output space (i.e. stress–strain). In these exemplar problems, data generated within the ICC framework resulted in calibrated model parameters with reduced measures of uncertainty compared to the traditional approaches.

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A publicly available PyTorch-$\mathrm{ABAQUS}$ $\mathrm{UMAT}$ deep-learning framework for level-set plasticity

Mechanics of Materials

Suh, Hyoung S.; Kweon, Chulmin; Lester, Brian T.; Kramer, Sharlotte L.; Sun, Waiching

Here this paper introduces a publicly available PyTorch-ABAQUS deep-learning framework of a family of plasticity models where the yield surface is implicitly represented by a scalar-valued function. In particular, our focus is to introduce a practical framework that can be deployed for engineering analysis that employs a user-defined material subroutine (UMAT/VUMAT) for ABAQUS, which is written in FORTRAN. To accomplish this task while leveraging the back-propagation learning algorithm to speed up the neural-network training, we introduce an interface code where the weights and biases of the trained neural networks obtained via the PyTorch library can be automatically converted into a generic FORTRAN code that can be a part of the UMAT/VUMAT algorithm. To enable third-party validation, we purposely make all the data sets, source code used to train the neural-network-based constitutive models, and the trained models available in a public repository. Furthermore, the practicality of the workflow is then further tested on a dataset for anisotropic yield function to showcase the extensibility of the proposed framework. A number of representative numerical experiments are used to examine the accuracy, robustness and reproducibility of the results generated by the neural network models.

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Tearing parameter failure integration with the multilevel solver

Vignes, Chet V.; Lester, Brian T.

The tearing parameter criterion and material softening failure method currently used in the multilinear elastic-plastic constitutive model was added as an option to modular failure capabilities. The modular failure implementation was integrated with the multilevel solver for multi-element simulations. Currently, this implementation is only available to the J2 plasticity model due to the formulation of the material softening approach. The implementation compared well with multilinear elastic-plastic model results for a uniaxial tension test, a simple shear test, and a representative structural problem. Necessary generalizations of the failure method to extend it as a modular option for all plasticity models are highlighted.

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Library of Advanced Materials for Engineering (LAMÉ) 5.10

Lester, Brian T.; Long, Kevin N.; Scherzinger, William M.; Vignes, Chet V.; Reedlunn, Benjamin R.

Accurate and efficient constitutive modeling remains a cornerstone issue for solid mechanics analysis. Over the years, the LAMÉ advanced material model library has grown to address this challenge by implementing models capable of describing material systems spanning soft polymers to stiff ceramics including both isotropic and anisotropic responses. Inelastic behaviors including (visco)plasticity, damage, and fracture have all incorporated for use in various analyses. This multitude of options and flexibility, however, comes at the cost of many capabilities, features, and responses and the ensuing complexity in the resulting implementation. Therefore, to enhance confidence and enable the utilization of the LAMÉ library in application, this effort seeks to document and verify the various models in the LAMÉ library. Specifically, the broader strategy, organization, and interface of the library itself is first presented. The physical theory, numerical implementation, and user guide for a large set of models is then discussed. Importantly, a number of verification tests are performed with each model to not only have confidence in the model itself but also highlight some important response characteristics and features that may be of interest to end-users. Finally, in looking ahead to the future, approaches to add material models to this library and further expand the capabilities are presented.

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Validation of material models for puncture of 7075-T651 aluminum plate

International Journal of Solids and Structures

Corona, Edmundo C.; Spletzer, Matthew; Lester, Brian T.; Fietek, Carter J.

Plate puncture simulations are challenging computational tasks that require advanced material models including high strain rate and thermal-mechanical effects on both deformation and failure, plus finite element techniques capable of representing large deformations and material failure. The focus of this work is on the material issues, which require large sets of experiments, flexible material models and challenging calibration procedures. In this study, we consider the puncture of 12.7 mm thick, 7075-T651 aluminum alloy plates by a cylindrical punch with a hemispherical nose and diameter of 12.7 mm. The plasticity and ductile failure models were isotropic with calibration data obtained from uniaxial tension tests at different temperatures and strain rates plus quasi-static notched tension tests and shear-dominated tests described here. Sixteen puncture experiments were conducted to identify the threshold penetration energy, mode of puncture and punch acceleration during impact, The punch was mounted on a 139 kg mass and dropped on the plates with different impact speeds. Since the mass was the same in all tests, the quantity of interest was the impact speed. The axis and velocity of the punch were perpendicular to the plate surface. The mean threshold punch speed was 3.05 m/s, and the mode of failure was plugging by thermal-mechanical shear banding accompanied by scabbing fragments. Application of the material models in simulations of the tests yielded accurate estimates of the threshold puncture speed and of the mode of failure. Time histories of the punch acceleration compared well between simulation and test. Remarkably, the success of the simulations occurred in spite of even the smallest element used being larger than the width of the shear bands.

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Library of Advanced Materials for Engineering (LAM) 5.8

Lester, Brian T.; Vignes, Chet V.; Scherzinger, William M.; Long, Kevin N.; Reedlunn, Benjamin R.; Cundiff, Kenneth N.

Accurate and efficient constitutive modeling remains a cornerstone issue for solid mechanics analysis. Over the years, the LAMÉ advanced material model library has grown to address this challenge by implementing models capable of describing material systems spanning soft polymers to stiff ceramics including both isotropic and anisotropic responses. Inelastic behaviors including (visco)plasticity, damage, and fracture have all incorporated for use in various analyses. This multitude of options and flexibility, however, comes at the cost of many capabilities, features, and responses and the ensuing complexity in the resulting implementation. Therefore, to enhance confidence and enable the utilization of the LAMÉ library in application, this effort seeks to document and verify the various models in the LAMÉ library. Specifically, the broader strategy, organization, and interface of the library itself is first presented. The physical theory, numerical implementation, and user guide for a large set of models is then discussed. Importantly, a number of verification tests are performed with each model to not only have confidence in the model itself but also highlight some important response characteristics and features that may be of interest to end-users. Finally, in looking ahead to the future, approaches to add material models to this library and further expand the capabilities are presented.

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Library of Advanced Materials for Engineering ((LAMÉ) 5.6

Lester, Brian T.; Scherzinger, William M.; Long, Kevin N.; Vignes, Chet V.; Reedlunn, Benjamin R.

Accurate and efficient constitutive modeling remains a cornerstone issue for solid mechanics analysis. Over the years, the LAMÉ advanced material model library has grown to address this challenge by implementing models capable of describing material systems spanning soft polymers to stiff ceramics including both isotropic and anisotropic responses. Inelastic behaviors including (visco)plasticity, damage, and fracture have all incorporated for use in various analyses. This multitude of options and flexibility, however, comes at the cost of many capabilities, features, and responses and the ensuing complexity in the resulting implementation. Therefore, to enhance confidence and enable the utilization of the LAMÉ library in application, this effort seeks to document and verify the various models in the LAMÉ library. Specifically, the broader strategy, organization, and interface of the library itself is first presented. The physical theory, numerical implementation, and user guide for a large set of models is then discussed. Importantly, a number of verification tests are performed with each model to not only have confidence in the model itself but also highlight some important response characteristics and features that may be of interest to end-users. Finally, in looking ahead to the future, approaches to add material models to this library and further expand the capabilities are presented.

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Library of Advanced Materials for Engineering (LAMÉ) 5.4

Lester, Brian T.; Long, Kevin N.; Scherzinger, William M.; Reedlunn, Benjamin R.; Vignes, Chet V.

Accurate and efficient constitutive modeling remains a cornerstone issue for solid mechanics analysis. Over the years, the LAMÉ advanced material model library has grown to address this challenge by implementing models capable of describing material systems spanning soft polymers to stiff ceramics including both isotropic and anisotropic responses. Inelastic behaviors including (visco)plasticity, damage, and fracture have all incorporated for use in various analyses. This multitude of options and flexibility, however, comes at the cost of many capabilities, features, and responses and the ensuing complexity in the resulting implementation. Therefore, to enhance confidence and enable the utilization of the LAMÉ library in application, this effort seeks to document and verify the various models in the LAMÉ library. Specifically, the broader strategy, organization, and interface of the library itself is first presented. The physical theory, numerical implementation, and user guide for a large set of models is then discussed. Importantly, a number of verification tests are performed with each model to not only have confidence in the model itself but also highlight some important response characteristics and features that may be of interest to end-users. Finally, in looking ahead to the future, approaches to add material models to this library and further expand the capabilities are presented.

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Inclusion of tearing parameter failure capabilities in modular failure

Vignes, Chet V.; Lester, Brian T.

The tearing parameter criterion and failure propagation method currently used in the multilinear elastic-plastic constitutive model was added as an option to modular failure capabilities. Currently, this implementation is only available to the J2 plasticity model due to the formulation of the failure propagation approach. The implementation was verified against analytical solutions for both a uniaxial tension and a pure shear boundary-value problem. Possible improvements to, and necessary generalizations of, the failure method to extend it as a modular option for all plasticity models are highlighted.

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Library of Advanced Materials for Engineering (LAMÉ) 5.2

Lester, Brian T.; Scherzinger, William M.; Long, Kevin N.; Vignes, Chet V.

Accurate and efficient constitutive modeling remains a cornerstone issue for solid mechanics analysis. Over the years, the LAMÉ advanced material model library has grown to address this challenge by implementing models capable of describing material systems spanning soft polymers to stiff ceramics including both isotropic and anisotropic responses. Inelastic behaviors including (visco)plasticity, damage, and fracture have all incorporated for use in various analyses. This multitude of options and flexibility, however, comes at the cost of many capabilities, features, and responses and the ensuing complexity in the resulting implementation. Therefore, to enhance confidence and enable the utilization of the LAMÉ library in application, this effort seeks to document and verify the various models in the LAMÉ library. Specifically, the broader strategy, organization, and interface of the library itself is first presented. The physical theory, numerical implementation, and user guide for a large set of models is then discussed. Importantly, a number of verification tests are performed with each model to not only have confidence in the model itself but also highlight some important response characteristics and features that may be of interest to end-users. Finally, in looking ahead to the future, approaches to add material models to this library and further expand the capabilities are presented.

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Comprehensive Material Characterization and Simultaneous Model Calibration for Improved Computational Simulation Credibility

Seidl, Daniel T.; Jones, Elizabeth M.; Lester, Brian T.

Computational simulation is increasingly relied upon for high-consequence engineering decisions, and a foundational element to solid mechanics simulations is a credible material model. Our ultimate vision is to interlace material characterization and model calibration in a real-time feedback loop, where the current model calibration results will drive the experiment to load regimes that add the most useful information to reduce parameter uncertainty. The current work investigated one key step to this Interlaced Characterization and Calibration (ICC) paradigm, using a finite load-path tree to incorporate history/path dependency of nonlinear material models into a network of surrogate models that replace computationally-expensive finite-element analyses. Our reference simulation was an elastoplastic material point subject to biaxial deformation with a Hill anisotropic yield criterion. Training data was generated using either a space-filling or adaptive sampling method, and surrogates were built using either Gaussian process or polynomial chaos expansion methods. Surrogate error was evaluated to be on the order of 10⁻5 and 10⁻3 percent for the space-filling and adaptive sampling training data, respectively. Direct Bayesian inference was performed with the surrogate network and with the reference material point simulator, and results agreed to within 3 significant figures for the mean parameter values, with a reduction in computational cost over 5 orders of magnitude. These results bought down risk regarding the surrogate network and facilitated a successful FY22-24 full LDRD proposal to research and develop the complete ICC paradigm.

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Impact of Integration Scheme on Performance of Anisotropic Plasticity Models

Lester, Brian T.; Scherzinger, William M.

Given the prevalent role of metals in a variety of industries, schemes to integrate corresponding constitutive models in finite element applications have long been studied. A number of formulations have been developed to accomplish this task; each with their own advantages and costs. Often the focus has been on ensuring the accuracy and numerical stability of these algorithms to enable robust integration. While important, emphasis on these performance metrics may often come at the cost of computational expense potentially neglecting the needs of individual problems. In the current work, the performance of two of the most common integration methods for anisotropic plasticity -- the convex cutting plane (CCP) and closest point projection (CPP) -- across a variety of metrics is assessed; including accuracy and cost. A variety of problems are considered ranging from single elements to large representative simulations including both implicit quasistatic and explicit transient dynamic type responses. The relative performance of each scheme in the different instances is presented with an eye towards guidance on when the different algorithms may be beneficial.

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A constitutive model for glass–ceramic materials

Mechanics of Materials

Lester, Brian T.; Long, Kevin N.

Glass–ceramics have received recent attention for use in glass–ceramic to metal hermetic seals. Due to their heterogeneous microstructure, these materials exhibit a number of advantageous responses over conventional glass based seals. Key amongst them is the possibility of a controllable thermal strain response and apparent coefficient of thermal expansion which may be used to minimize thermally induced residual stresses for aforementioned seals. These behaviors result from an inorganic glass matrix and variety of crystalline ceramic phases including silica polymorph(s) that may undergo reversible solid-to-solid transformations with associated inelastic strain. Correspondingly, these materials exhibit complex thermomechanical responses associated with multiple inelastic mechanisms (viscoelasticity and phase transformation). While modeling these behaviors is essential for developing and analyzing the corresponding applications, no such model exists. Therefore, in this work a three-dimensional continuum constitutive model for glass–ceramic materials combining these various inelastic mechanisms is developed via an internal state variable approach. A corresponding fully implicit three dimensional numerical formulation is also proposed and implemented. The model is used to simulate existing experiments and validate the proposed formalism. As an example, the simple seal problem of a glass–ceramic seal inside a concentric metal shell is explored. Finally, the impact of the cooling rates, viscoelastic shift factors, and inelastic strain on final residual stress state are all investigated and the differing contributions highlighted.

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Thermal-Mechanical Elastic-Plastic and Ductile Failure Model Calibrations for 6061-T651 Aluminum Alloy from Plate

Corona, Edmundo C.; Kramer, Sharlotte L.; Lester, Brian T.; Jones, Amanda; Sanborn, Brett S.; Fietek, Carter J.

Numerical simulations of metallic structures undergoing rapid loading into the plastic range require material models that accurately represent the response. In general, the material response can be seen as having four interrelated parts: the baseline response under slow loading, the effect of strain rate, the conversion of plastic work into heat and the effect of temperature. In essence, the material behaves in a thermal-mechanical manner if the loading is fast enough so when heat is generated by plastic deformation it raises the temperature and therefore influences the mechanical response. In these cases, appropriate models that can capture the aspects listed above are necessary. The matters of interest here are the elastic-plastic response and ductile failure behavior of 6061-T651 aluminum alloy under the conditions described above. The work was accomplished by first designing and conducting a material test program to provide data for the calibration of a modular $J_2$ plasticity model with isotropic hardening as well as a ductile failure model. Both included modules that accounted for temperature and strain rate dependence. The models were coupled with an adiabatic heating module to calculate the temperature rise due to the conversion of plastic work to heat. The test program included uniaxial tension tests conducted at room temperature, 150 and 300 C and at strain rates between 10–4 and 103 1/s as well as four geometries of notched tension specimens and two tests on specimens with shear-dominated deformations. The test data collected allowed the calibration of both the plasticity and the ductile failure models. Most test specimens were extracted from a single piece of plate to maintain consistency. Notched tension tests came from a possibly different plate, but from the same lot. When using the model in structural finite element calculations, element formulations and sizes different from those used to model the test specimens in the calibration are likely to be used. A brief investigation demonstrated that the failure model can be particularly sensitive to the element selection and provided an initial guide to compensate in a specific example.

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Library of Advanced Materials for Engineering (LAMÉ) 5.0

Lester, Brian T.; Scherzinger, William M.; Long, Kevin N.; Reedlunn, Benjamin R.; Vignes, Chet V.

Accurate and efficient constitutive modeling remains a cornerstone issue for solid mechanics analysis. Over the years, the LAMÉ advanced material model library has grown to address this challenge by implementing models capable of describing material systems spanning soft polymers to stiff ceramics including both isotropic and anisotropic responses. Inelastic behaviors including (visco)plasticity, damage, and fracture have all incorporated for use in various analyses. This multitude of options and flexibility, however, comes at the cost of many capabilities, features, and responses and the ensuing complexity in the resulting implementation. Therefore, to enhance confidence and enable the utilization of the LAMÉ library in application, this effort seeks to document and verify the various models in the LAMÉ library. Specifically, the broader strategy, organization, and interface of the library itself is first presented. The physical theory, numerical implementation, and user guide for a large set of models is then discussed. Importantly, a number of verification tests are performed with each model to not only have confidence in the model itself but also highlight some important response characteristics and features that may be of interest to end-users. Finally, in looking ahead to the future, approaches to add material models to this library and further expand the capabilities are presented

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Thermal-Mechanical Elastic-Plastic and Ductile Failure Model Calibrations for 304L Stainless Steel Alloy

Corona, Edmundo C.; Kramer, Sharlotte L.; Lester, Brian T.; Jones, Amanda; Sanborn, Brett S.; Shand, Lyndsay S.; Fietek, Carter J.

Numerical simulations of metallic structures undergoing rapid loading into the plastic range require material models that accurately represent the response. In general, the material response can be seen as having four interrelated parts: the baseline response under slow loading, the effect of strain rate, the conversion of plastic work into heat and the effect of temperature. In essence, the material behaves in a thermal-mechanical manner if the loading is fast enough so when heat is generated by plastic deformation it raises the temperature and therefore influences the mechanical response. In these cases, appropriate models that can capture the aspects listed above are necessary. The material of interest here is 304L stainless steel, and the objective of this work is to calibrate thermal-mechanical models: one for the constitutive behavior and another for failure. The work was accomplished by first designing and conducting a material test program to provide data for the calibration of the models. The test program included uniaxial tension tests conducted at room temperature, 150 and 300 C and at strain rates between 10–4 and 103 1/s. It also included notched tension and shear-dominated compression hat tests specifically designed to calibrate the failure model. All test specimens were extracted from a single piece of plate to maintain consistency. The constitutive model adopted was a modular $J_2$ plasticity model with isotropic hardening that included rate and temperature dependence. A criterion for failure initiation based on a critical value of equivalent plastic strain fitted the failure data appropriately and was adopted. Possible ranges of the values of the parameters of the models were determined partially on historical data from calibrations of the same alloy from other lots and are given here. The calibration of the parameters of the models were based on finite element simulations of the various material tests using relatively ne meshes and hexahedral elements. When using the model in structural finite element calculations, however, element formulations and sizes different from those in the calibration are likely to be used. A brief investigation demonstrated that the failure initiation predictions can be particularly sensitive to the element selection and provided an initial guide to compensate for the effect of element size in a specific example.

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Effects of Convection On Experimental Investigation Of Heat Generation During Plastic Deformation

ASME International Mechanical Engineering Congress and Exposition, Proceedings (IMECE)

Hodges, Wyatt L.; Phinney, Leslie M.; Lester, Brian T.; Talamini, Brandon T.; Jones, Amanda

In order to predict material failure accurately, it is critical to have knowledge of deformation physics. Uniquely challenging is determination of the conversion coefficient of plastic work into thermal energy. Here, we examine the heat transfer problem associated with the experimental determination of β in copper and stainless steel. A numerical model of the tensile test sample is used to estimate temperature rises across the mechanical test sample at a variety of convection coefficients, as well as to estimate heat losses to the chamber by conduction and convection. This analysis is performed for stainless steel and copper at multiple environmental conditions. These results are used to examine the relative importance of convection and conduction as heat transfer pathways. The model is additionally used to perform sensitivity analysis on the parameters that will ultimately determine b. These results underscore the importance of accurate determination of convection coefficients and will be used to inform future design of samples and experiments. Finally, an estimation of convection coefficient for an example mechanical test chamber is detailed as a point of reference for the modeling results.

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Coulombic friction in metamaterials to dissipate mechanical energy

Extreme Mechanics Letters

Garland, Anthony G.; Adstedt, Katarina M.; Casias, Adrian L.; Laros, James H.; White, Benjamin C.; Mook, William M.; Kaehr, Bryan J.; Jared, Bradley H.; Lester, Brian T.; Leathe, Nicholas L.; Schwaller, Eric; Boyce, Brad B.

Product designs from a wide range of industries such as aerospace, automotive, biomedical, and others can benefit from new metamaterials for mechanical energy dissipation. In this study, we explore a novel new class of metamaterials with unit cells that absorb energy via sliding Coulombic friction. Remarkably, even materials such as metals and ceramics, which typically have no intrinsic reversible energy dissipation, can be architected to provide dissipation akin to elastomers. The concept is demonstrated at different scales (centimeter to micrometer), with different materials (metal and polymer), and in different operating environments (high and low temperatures), all showing substantial dissipative improvements over conventional non-contacting lattice unit cells. Further, as with other ‘programmable’ metamaterials, the degree of Coulombic absorption can be tailored for a given application. An analytic expression is derived to allow rapid first-order optimization. This new class of Coulombic friction energy absorbers can apply broadly to many industrial sectors such as transportation (e.g. monolithic shock absorbers), biomedical (e.g. prosthetics), athletic equipment (e.g. skis, bicycles, etc.), defense (e.g. vibration tolerant structures), and energy (e.g. survivable electrical grid components).

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Library of Advanced Materials for Engineering (LAMÉ) 4.58

Lester, Brian T.; Long, Kevin N.; Scherzinger, William M.; Vignes, Chet V.; Reedlunn, Benjamin R.

Accurate and efficient constitutive modeling remains a cornerstone issue for solid mechanics analysis. Over the years, the LAMÉ advanced material model library has grown to address this challenge by implementing models capable of describing material systems spanning soft polymers to stiff ceramics including both isotropic and anisotropic responses. Inelastic behaviors including (visco)plasticity, damage, and fracture have all incorporated for use in various analyses. This multitude of options and flexibility, however, comes at the cost of many capabilities, features, and responses and the ensuing complexity in the resulting implementation. Therefore, to enhance confidence and enable the utilization of the LAMÉ library in application, this effort seeks to document and verify the various models in the LAMÉ library. Specifically, the broader strategy, organization, and interface of the library itself is first presented. The physical theory, numerical implementation, and user guide for a large set of models is then discussed. Importantly, a number of verification tests are performed with each model to not only have confidence in the model itself but also highlight some important response characteristics and features that may be of interest to end-users. Finally, in looking ahead to the future, approaches to add material models to this library and further expand the capabilities are presented.

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Modular Growth and Nucleation Formulations in Modular Plasticity Models

Lester, Brian T.; Scherzinger, William M.

Recent investigations like the second and third Sandia Fracture Challenges have characterized and demonstrated the performance of a variety of failure techniques and models. These surveys have considered a wide breadth of models encapsulating both general failure criteria as well as those focusing on pore nucleation and growth. Extensive reviews exist on both topics. The former category generally consists of classic models like the Johnson-Cook or Wilkins criteria. These models were recently added to modular plasticity models in the Library of Advanced Materials for Engineering (LAME) as criteria for use with element death capabilities. The latter category was not treated in that effort. There exists a large class of failure models based on predicting the evolution of pores and failure associated with such microstructures. While the exact mechanisms and corresponding impact on the macroscale behavior remain an active area of research, a large suite of formulations have been proposed combining different features of both pore nucleation and subsequent growth. The most famous of these are based on the popular Gurson model of pore growth derived via micromechanical analysis assuming a plastically incompressible matrix. Numerous other models exist for both growth and nucleation and the Cocks-Ashby growth and Horstemeyer-Gokhale nucleation models have been used successfully in recent Sandia Fracture Challenges. This specific combination is colloquially referred to as the "BCJ-failure model as it has been frequently used with the Bammann-Chisea-Johnson plasticity model.

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Modular Linear Thermoviscoelastic Model

Lester, Brian T.; Long, Kevin N.

Time-dependent, viscoelastic responses of materials like polymers and glasses have long been studied. As such, a variety of models have been put forth to describe the behavior including simple rheological models (e.g. Maxwell, Kelvin), linear "fading memory" theories, and hereditary integral based linear thermal viscoelastic approaches as well as more recent nonlinear theories that are either integral, fictive temperature, or differential internal state variable based. The current work details a new LINEAR_THERMOVISCOELASTIC model that has been added to LAME. This formulation represents a viscoelastic theory that neglects some of the phenomenological details of the PEC/SPEC models in favor of efficiency and simplicity. Furthermore, this new model is a first step towards developing "modular" viscoelastic capabilities akin to those available with hardening descriptions for plasticity models in LAME. Specifically, multiple different (including user-defined) shift-factor forms are implemented with each being easily selected via parameter specification rather than requiring distinct material models.

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Library of Advanced Materials for Engineering (LAM) 4.56

Lester, Brian T.; Long, Kevin N.; Scherzinger, William M.; Vignes, Chet V.

Accurate and efficient constitutive modeling remains a cornerstone issue for solid mechanics analysis. Over the years, the LAME advanced material model library has grown to address this challenge by implementing models capable of describing material systems spanning soft polymers to stiff ceramics including both isotropic and anisotropic responses. Inelastic behaviors including (visco)plasticity, damage, and fracture have all incorporated for use in various analyses. This multitude of options and flexibility, however, comes at the cost of many capabilities, features, and responses and the ensuing complexity in the resulting implementation. Therefore, to enhance confidence and enable the utilization of the LAME library in application, this effort seeks to document and verify the various models in the LAME library. Specifically, the broader strategy, organization, and interface of the library itself is first presented. The physical theory, numerical implementation, and user guide for a large set of models is then discussed. Importantly, a number of verification tests are performed with each model to not only have confidence in the model itself but also highlight some important response characteristics and features that may be of interest to end-users. Finally, in looking ahead to the future, approaches to add material models to this library and further expand the capabilities are presented.

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Adiabatic Heating in Modular Plasticity Models

Lester, Brian T.; Scherzinger, William M.

Plastic deformations in metals are dissipative. Some fraction of the dissipated mechanical energy (plastic work) is converted into thermal energy and serves as a heat source. In cases where the heat cannot be readily transferred to the environment, the local temperature will increase thereby producing variations in mechanical behaviors associated with temperature-dependent properties (e.g. thermal softening due to decreasing yield strengths). This issue is often referred to as "adiabatic heating as an adiabatic temperature condition corresponds to the limiting case where no heat transfer takes place. The impact of converting plastic work into heat on the mechanical response of metals has been long studied. Nonetheless, it still remains an issue. For instance, with respect to ductile failure, the second Sandia Fracture Challenge noted that accounting for plastic heat generation was necessary for predictions under dynamic loading conditions. Furthermore, both experimental and modeling efforts continue to be pursued to better describe and understand the effect of plastic work conversion into heat on structural responses. Noting the need for capturing plastic work conversion into heat in structural analyses, a simple and fairly traditional representation of these responses has been added into existing modular plasticity models in the Library of Advanced Materials for Engineering (LAME). Here, these capabilities are briefly described with the underlying theory and numerical implementation discussed in Sections 2 and 3, respectively. Examples of syntax are given in Section 4 and some verification exercises are found in Section 5. Simple structural analyses are presented in Section 6 to briefly highlight the impact of these features and concluding thoughts are given.

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Material Testing for Shear-Dominated Ductile Failure

Corona, Edmundo C.; Kramer, Sharlotte L.; Lester, Brian T.

An initial foray into the design of specimens that can be used to provide data about the quasistatic ductile failure of metals when subjected to shear-dominated (low triaxiality) states of stress was undertaken. Four specimen geometries made from two materials with different ductility (Al 7075, lower ductility and steel A286, higher ductility) were considered as candidates. Based on results from analysis and experimentation, it seems that two show promise for further consideration. Whereas preliminary results indicate that the Johnson-Cook model fit the failure data for Al 7075 well, it did not fit the data for steel A286. Further work is needed to consolidate the results and evaluate other failure models that may fit the steel data better, as well as to extend the results of this work to the dynamic loading regime.

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Library of Advanced Materials for Engineering (LAME) 4.54

Lester, Brian T.; Scherzinger, William M.

Accurate and efficient constitutive modeling remains a cornerstone issue for solid mechanics analysis. Over the years, the LAMÉ advanced material model library has grown to address this challenge by implementing models capable of describing material systems spanning soft polymers to stiff ceramics including both isotropic and anisotropic responses. Inelastic behaviors including (visco)plasticity, damage, and fracture have all incorporated for use in various analyses. This multitude of options and flexibility, however, comes at the cost of many capabilities, features, and responses and the ensuing complexity in the resulting implementation. Therefore, to enhance confidence and enable the utilization of the LAMÉ library in application, this effort seeks to document and verify the various models in the LAMÉ library. Specifically, the broader strategy, organization, and interface of the library itself is first presented. The physical theory, numerical implementation, and user guide for a large set of models is then discussed. Importantly, a number of verification tests are performed with each model to not only have confidence in the model itself but also highlight some important response characteristics and features that may be of interest to end-users. Finally, in looking ahead to the future, approaches to add material models to this library and further expand the capabilities are presented.

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Numerical Integration of Viscoelastic Models

Lester, Brian T.; Long, Kevin N.

Accurate modeling of viscoelasticity remains an important consideration for a variety of materials (e.g. polymers and inorganic glasses). As such, over the previous decades a substantial body of work has been dedicated to developing appropriate constitutive models for viscoelasticity ranging from initial considerations of linear thermoviscoelasticity to more complex non-linear formulations incorporating fictive temperatures or potential energy clocks including the use of both internal state variable(ISV) and hereditary integral representations. Nonetheless, relatively limited (in comparison to plasticity) attention has been paid to the numerical integration of such schemes. In terms of integral based formulations, Taylor et al. first considered the problem of the integration of a linear viscoelasticity model. That work focused on the integration of the hereditary integrals and demonstrated improved performance of the new scheme with a custom finite element code over an existing finite difference reference. Chambers and Becker, using a free volume based shift factor, also considered the integration of the hereditary integrals and the impact on the problem of a pressurized thick-walled cylinder and developed an adaptive scheme to bound the error. Chambers later developed three-point Gauss and composite integration schemes for the hereditary integrals and noted improved accuracy. With respect to ISV-based schemes, formulations for the non-linear Schapery model have been proposed. However, in those efforts greater attention was paid to convergence of the non-linear solution scheme than impact of numerical integration. Various authors (e.g. Holzapfel and Simo and Hughes) have also studied the use of convolution integrals with differential forms of ISVs for temperature-independent formulations. Regardless, while the "potential energy clock" (PEC) and "simplified potential energy clock"(SPEC) models have been used to study a variety of non-linear responses (e.g.), limited attention has been paid to the numerical performance. As will be discussed later, the "clock" at the center of the formulations includes temperature and complex history dependence making the numerical integration of such a model even more challenging. Thus, in the current work an initial effort towards characterizing the numerical integration of the constitutive model through simplified problems is performed. To that end, in Section 2 the theory of the model is briefly presented while the numerical integration is discussed in Section 3. Results of various studies characterizing the numerical behavior and performance are then given in Section 4. Finally, some concluding remarks and thoughts for follow on works are provided in Section 5.

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Failure Formulations in Modular Plasticity Models

Lester, Brian T.; Scherzinger, William M.

Computational prediction of ductile failure remains a challenging and important problem as demonstrated by the recent Sandia Fracture Challenges. In addition to emphasizing the complexity of such problems, the variety of solution strategies also highlighted the number of possible approaches to this problem. A common engineering approach for such efforts is to use a failure model in conjunction with element deletion. In the second Sandia Fracture Challenge, for instance, nine of the fourteen teams used some form of element deletion. For such schemes, a critical decision pertains to the selection of the appropriate failure model; of which many may be found in the literature (see the review of Corona and Reedlunn). The variety may also be observed in the aforementioned second Sandia Fracture Challenge in which at least eight different failure criteria are listed for the nine element deletion based approaches. The selection of the appropriate failure model is a difficult challenge depending on the material being considered and such criteria can variously depend on stress state (i.e. triaxiality, Lode angle) and loading conditions (i.e. strain rate, temperature). Separate implementations of each criteria with different plasticity models can be a repetitive and cumbersome process which may limit available models for an engineering analyst. To mitigate this issue, an effort was pursued to flexibly implement failure models in which different failure models could be specified and utilized within the same elastic-plastic constitutive routine by simply changing the input syntax. Similarly, the same models are implemented across a suite of elastic-plastic formulations enabling consistent definitions. As will be discussed later, a specific "modular failure" model is also implemented which allows for the selection or specification of different dependencies depending on the current need. At this stage, this effort is limited to defining failure models; progression/damage evolution in the constitutive model is not treated and left to future efforts.

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Glass-Ceramic Material Modeling

Lester, Brian T.; Long, Kevin N.

Glass-ceramics are a unique class of materials in which the growth of a ceramic phase(s) may be induced in an inorganic glass resulting in a microstructurally heterogeneous material with both glass and ceramic phases. This specialized processing is often referred to as "ceramming''. A wide variety of such materials have been developed through the use of different initial glass compositions and thermomechanical processing routes and that have enabled applications in dentistry, consumer kitchenware, and telescopes mirrors. These materials may also exhibit large apparent coefficients of thermal expansion making them attractive for consideration in glass-ceramic seals. These large apparent coefficients of thermal expansion often arise from silica polymorphs, such as cristobalite, undergoing a solid-to-solid phase transformations producing additional non-linearity in the effective material response.

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Modular Plane Stress Plasticity Material Model

Lester, Brian T.; Scherzinger, William M.

A variety of recent work has expanded capabilities in LAMÉ with respect to anisotropic and modular plasticity model. In this context, modular refers to a flexible framework and consistent implementation such that different hardening functional forms may all be incorporated into the same material model implementation rather than needing a new model for each description. However, such work has been focused on three-dimensional formulations and limited attention has been paid to structural formulations; i.e. for use with beam or shell elements. As a first step to bringing some of these recent advances towards structural elements, modular isotropic hardening capabilities will be added to the J2 von Mises plane-stress plasticity formulation of Simo and Taylor. To accomplish this effort, in Section 2 and 3 the theory and numerical formulation of the model are given. Specific functional forms of the hardening and example syntax to use them are then presented in Section 4 while verification exercises are documented in Section 5. Finally, some concluding thoughts about future work are given in Section 6.

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Library of Advanced Materials for Engineering (LAME) 4.52

Lester, Brian T.; Scherzinger, William M.

Accurate and efficient constitutive modeling remains a cornerstone issue for solid mechanics analysis. Over the years, the LAME advanced material model library has grown to address this challenge by implementing models capable of describing material systems spanning soft polymers to stiff ceramics including both isotropic and anisotropic responses. Inelastic behaviors including (visco)plasticity, damage, and fracture have all incorporated for use in various analyses. This multitude of options and flexibility, however, comes at the cost of many capabilities, features, and responses and the ensuing complexity in the resulting implementation. Therefore, to enhance confidence and enable the utilization of the LAME library in application, this effort seeks to document and verify the various models in the LAME library. Specifically, the broader strategy, organization, and interface of the library itself is first presented. The physical theory, numerical implementation, and user guide for a large set of models is then discussed. Importantly, a number of verification tests are performed with each model to not only have confidence in the model itself but also highlight some important response characteristics and features that may be of interest to end-users. Finally, in looking ahead to the future, approaches to add material models to this library and further expand the capabilities are presented.

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Library of Advanced Materials for Engineering (LAMÉ) 4.50

Merewether, Mark T.; Crane, Nathan K.; Plews, Julia A.; de Frias, Gabriel J.; Le, San L.; Littlewood, David J.; Mosby, Matthew D.; Pierson, Kendall H.; Porter, V.L.; Shelton, Timothy S.; Thomas, Jesse D.; Tupek, Michael R.; Veilleux, Michael V.; Xavier, Patrick G.; Scherzinger, William M.; Lester, Brian T.

Accurate and efficient constitutive modeling remains a cornerstone issue for solid mechanics analysis. Over the years, the LAMÉ advanced material model library has grown to address this challenge by implementing models capable of describing material systems spanning soft polymers to stiff ceramics including both isotropic and anisotropic responses. Inelastic behaviors including (visco)plasticity, damage, and fracture have all incorporated for use in various analyses. This multitude of options and flexibility, however, comes at the cost of many capabilities, features, and responses and the ensuing complexity in the resulting implementation. Therefore, to enhance confidence and enable the utilization of the LAMÉ library in application, this effort seeks to document and verify the various models in the LAMÉ library. Specifically, the broader strategy, organization, and interface of the library itself is first presented. The physical theory, numerical implementation, and user guide for a large set of models is then discussed. Importantly, a number of verification tests are performed with each model to not only have confidence in the model itself but also highlight some important response characteristics and features that may be of interest to end-users. Finally, in looking ahead to the future, approaches to add material models to this library and further expand the capabilities are presented.

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Born Qualified Grand Challenge LDRD Final Report

Roach, R.A.; Argibay, Nicolas A.; Allen, Kyle M.; Balch, Dorian K.; Beghini, Lauren L.; Bishop, Joseph E.; Boyce, Brad B.; Brown, Judith A.; Burchard, Ross L.; Chandross, M.; Cook, Adam W.; DiAntonio, Christopher D.; Dressler, Amber D.; Forrest, Eric C.; Ford, Kurtis R.; Ivanoff, Thomas I.; Jared, Bradley H.; Johnson, Kyle J.; Kammler, Daniel K.; Koepke, Joshua R.; Kustas, Andrew K.; Lavin, Judith M.; Leathe, Nicholas L.; Lester, Brian T.; Madison, Jonathan D.; Mani, Seethambal S.; Martinez, Mario J.; Moser, Daniel M.; Rodgers, Theron R.; Seidl, Daniel T.; Brown-Shaklee, Harlan J.; Stanford, Joshua S.; Stender, Michael S.; Sugar, Joshua D.; Swiler, Laura P.; Taylor, Samantha T.; Trembacki, Bradley T.

This SAND report fulfills the final report requirement for the Born Qualified Grand Challenge LDRD. Born Qualified was funded from FY16-FY18 with a total budget of ~$13M over the 3 years of funding. Overall 70+ staff, Post Docs, and students supported this project over its lifetime. The driver for Born Qualified was using Additive Manufacturing (AM) to change the qualification paradigm for low volume, high value, high consequence, complex parts that are common in high-risk industries such as ND, defense, energy, aerospace, and medical. AM offers the opportunity to transform design, manufacturing, and qualification with its unique capabilities. AM is a disruptive technology, allowing the capability to simultaneously create part and material while tightly controlling and monitoring the manufacturing process at the voxel level, with the inherent flexibility and agility in printing layer-by-layer. AM enables the possibility of measuring critical material and part parameters during manufacturing, thus changing the way we collect data, assess performance, and accept or qualify parts. It provides an opportunity to shift from the current iterative design-build-test qualification paradigm using traditional manufacturing processes to design-by-predictivity where requirements are addressed concurrently and rapidly. The new qualification paradigm driven by AM provides the opportunity to predict performance probabilistically, to optimally control the manufacturing process, and to implement accelerated cycles of learning. Exploiting these capabilities to realize a new uncertainty quantification-driven qualification that is rapid, flexible, and practical is the focus of this effort.

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An evolving effective stress approach to anisotropic distortional hardening

International Journal of Solids and Structures

Lester, Brian T.; Scherzinger, William M.

A new yield surface with an evolving effective stress definition is proposed for consistently and efficiently describing anisotropic distortional hardening. Specifically, a new internal state variable is introduced to capture the thermodynamic evolution between different effective stress definitions. The corresponding yield surface and evolution equations of the internal variables are derived from thermodynamic considerations enabling satisfaction of the second law. A closest point projection return mapping algorithm for the proposed model is formulated and implemented for use in finite element analyses. Select constitutive and larger scale boundary value problems are solved to explore the capabilities of the model and examine the impact of distortional hardening on constitutive and structural responses. Importantly, these simulations demonstrate the tractability of the proposed formulation in investigating large-scale problems of interest.

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Changing the Engineering Design & Qualification Paradigm in Component Design & Manufacturing (Born Qualified)

Roach, R.A.; Bishop, Joseph E.; Jared, Bradley H.; Keicher, David M.; Cook, Adam W.; Whetten, Shaun R.; Forrest, Eric C.; Stanford, Joshua S.; Boyce, Brad B.; Johnson, Kyle J.; Rodgers, Theron R.; Ford, Kurtis R.; Martinez, Mario J.; Moser, Daniel M.; van Bloemen Waanders, Bart G.; Chandross, M.; Abdeljawad, Fadi F.; Allen, Kyle M.; Stender, Michael S.; Beghini, Lauren L.; Swiler, Laura P.; Lester, Brian T.; Argibay, Nicolas A.; Brown-Shaklee, Harlan J.; Kustas, Andrew K.; Sugar, Joshua D.; Kammler, Daniel K.; Wilson, Mark A.

Abstract not provided.

Verification of the Skorohod-Olevsky Viscous Sintering (SOVS) Model

Lester, Brian T.

Sintering refers to a manufacturing process through which mechanically pressed bodies of ceramic (and sometimes metal) powders are heated to drive densification thereby removing the inherit porosity of green bodies. As the body densifies through the sintering process, the ensuing material flow leads to macroscopic deformations of the specimen and as such the final configuration differs form the initial. Therefore, as with any manufacturing step, there is substantial interest in understanding and being able to model the sintering process to predict deformation and residual stress. Efforts in this regard have been pursued for face seals, gear wheels, and consumer products like wash-basins. To understand the sintering process, a variety of modeling approaches have been pursued at different scales.

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Trust-region based return mapping algorithm for implicit integration of elastic-plastic constitutive models

International Journal for Numerical Methods in Engineering

Lester, Brian T.; Scherzinger, William M.

Here, a new method for the solution of the non-linear equations forming the core of constitutive model integration is proposed. Specifically, the trust-region method that has been developed in the numerical optimization community is successfully modified for use in implicit integration of elastic-plastic models. Although attention here is restricted to these rate-independent formulations, the proposed approach holds substantial promise for adoption with models incorporating complex physics, multiple inelastic mechanisms, and/or multiphysics. As a first step, the non-quadratic Hosford yield surface is used as a representative case to investigate computationally challenging constitutive models. The theory and implementation are presented, discussed, and compared to other common integration schemes. Multiple boundary value problems are studied and used to verify the proposed algorithm and demonstrate the capabilities of this approach over more common methodologies. Robustness and speed are then investigated and compared to existing algorithms. Through these efforts, it is shown that the utilization of a trust-region approach leads to superior performance versus a traditional closest-point projection Newton-Raphson method and comparable speed and robustness to a line search augmented scheme.

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Trust-region based return mapping algorithm for implicit integration of elastic-plastic constitutive models

International Journal for Numerical Methods in Engineering

Lester, Brian T.; Scherzinger, William M.

Here, a new method for the solution of the non-linear equations forming the core of constitutive model integration is proposed. Specifically, the trust-region method that has been developed in the numerical optimization community is successfully modified for use in implicit integration of elastic-plastic models. Although attention here is restricted to these rate-independent formulations, the proposed approach holds substantial promise for adoption with models incorporating complex physics, multiple inelastic mechanisms, and/or multiphysics. As a first step, the non-quadratic Hosford yield surface is used as a representative case to investigate computationally challenging constitutive models. The theory and implementation are presented, discussed, and compared to other common integration schemes. Multiple boundary value problems are studied and used to verify the proposed algorithm and demonstrate the capabilities of this approach over more common methodologies. Robustness and speed are then investigated and compared to existing algorithms. Through these efforts, it is shown that the utilization of a trust-region approach leads to superior performance versus a traditional closest-point projection Newton-Raphson method and comparable speed and robustness to a line search augmented scheme.

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Trust-region based return mapping algorithm for implicit integration of elastic-plastic constitutive models

International Journal for Numerical Methods in Engineering

Lester, Brian T.; Scherzinger, William M.

A new method for the solution of the non-linear equations forming the core of constitutive model integration is proposed. Specifically, the trust-region method that has been developed in the numerical optimization community is successfully modified for use in implicit integration of elastic-plastic models. Although attention here is restricted to these rate-independent formulations, the proposed approach holds substantial promise for adoption with models incorporating complex physics, multiple inelastic mechanisms, and/or multiphysics. As a first step, the non-quadratic Hosford yield surface is used as a representative case to investigate computationally challenging constitutive models. The theory and implementation are presented, discussed, and compared to other common integration schemes. Multiple boundary value problems are studied and used to verify the proposed algorithm and demonstrate the capabilities of this approach over more common methodologies. Robustness and speed are then investigated and compared to existing algorithms. As a result through these efforts, it is shown that the utilization of a trust-region approach leads to superior performance versus a traditional closest-point projection Newton-Raphson method and comparable speed and robustness to a line search augmented scheme.

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99 Results