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Michael Ortiz

Publications and source records attributed to Michael Ortiz.

At least 19 recordsLinked to original sources

Existence of thermodynamically consistent solutions for data-driven porous media problems

Data-Driven Computational Mechanics (DDCM) replaces traditional phenomenological constitutive models by directly reformulating boundary-value problems in terms of local material state data obtained from experiments or fine-scale simulations. Standard DDCM formulations, only enforcing equilibrium and compatibility, do not inherently guarantee compliance with the second law of thermodynamics. This breakdown occurs particularly when input material data sets are subject to noise or local physical non-admissibility. In this work, we present a variational DDCM framework specifically tailored to diffusion--reaction problems. Taking advantage of the simplicity of the thermodynamic constraint in gradient-flux systems, we propose an augmented formulation that explicitly enforces the second law of thermodynamics as a hard constraint within the energy-minimization problem. Although the set of thermodynamically admissible states is non-convex and fails to be weakly closed in the ambient phase space, we establish existence of minimizers by proving that the intersection of the admissible set with the subspace of fields that are compatible and in equilibrium is weakly sequentially closed via a compensated compactness argument. To enable practical computations, we analyze both a Lagrange multiplier formulation and a penalization scheme. We prove the $\Gamma$-convergence of the penalized functionals to the exact constrained problem and establish a fully discrete convergence framework incorporating spatial finite-element discretization and empirical data-set approximations. Numerical experiments confirm that the proposed penalty scheme effectively restores thermodynamic consistency even in the presence of severely corrupted material data.

math.AP

Microstructure evolution as a game

We develop a whole-trajectory relaxation framework for dissipative evolutions with non-convex, state- and history-dependent kinetics. The framework arises naturally from a game-theoretical formulation of energy--dissipation evolution. State--rate consistency is eliminated by causal Volterra reconstruction, reducing the problem to a diagonal equilibrium condition on complete rate trajectories. We establish a direct method based on vanishing-defect approximability, compactness, and complementary semicontinuity. The relaxation mechanism is computed exactly for a reduced simple-shear model with a non-convex kinetic potential and a local memory variable. The enriched state is a Young measure on complete local histories. We identify explicitly the sequential lower-semicontinuous envelope of the pure diagonal defect, characterize its zero set, construct pure recovery sequences for every relaxed zero, and prove existence through a frozen-best-response time discretization. The resulting coexistence of distinct rate populations with distinct memories provides a reduced mechanism for kinetic shear banding and connects naturally with negative strain-rate sensitivity and dynamic strain aging such as underlie the Portevin--Le Chatelier effect.

math.CA

A variational framework for bond-based peridynamics with spatially varying horizons and its asynchronous time integration

Bond-based peridynamics provides a non-local framework for modelling fracture without requiring spatial derivatives of the displacement field. However, when spatially varying horizons are used together with non-uniform discretisations, the classical single-horizon bond-based peridynamics formulation leads to asymmetric interactions between material points. These asymmetric interactions violate balance laws and can introduce non-physical artefacts such as ghost forces and spurious wave reflections. In this work, we develop a variational formulation for bond-based peridynamics with spatially varying horizons. Starting from the Lagrange-d'Alembert principle, we derive the governing equations of motion and show that the dual-horizon peridynamics formulation emerges naturally from the variation of the internal energy. Building on this variational structure, we construct asynchronous variational integrators that allow different time step sizes in different regions of the domain. This is particularly useful for dynamic fracture simulations with local refinement, where small time steps are required only near regions of high resolution or expected crack growth. Numerical examples involving wave propagation, a pre-cracked plate under tension, and the Kalthoff-Winkler impact experiment demonstrate that the proposed framework removes spurious reflections caused by non-uniform horizons, preserves physically consistent fracture patterns, and achieves results comparable to uniformly refined simulations. At the same time, the asynchronous variational integrator reduces the number of internal force evaluations compared to the standard velocity-Verlet method. The proposed approach therefore provides a consistent variational foundation and an efficient time-integration strategy for bond-based peridynamic simulations with spatially varying horizons.

cs.CE

Optimal history encoding for elastic-plastic hereditary laws: Sharp input and constitutive approximation

We formulate rate-independent elastic-ideally-plastic response directly in hereditary form and study its approximation by finite history surrogates. At the material-point level, the constitutive law is the vector play operator generated by metric projection onto a closed convex elastic domain in stress space. Starting from the closest-point return mapping for step inputs, we pass to absolutely continuous driving histories, for which the constitutive law admits a differential form: the stress remains in the elastic domain and the difference of rates belongs almost everywhere to the normal cone. In this $W^{1,1}$ setting, the hereditary law is causal, contracts variation, and satisfies a $BV$-to-$L^\infty$ stability estimate. We then approximate histories by right-continuous step surrogates with at most $N$ constant pieces. For absolutely continuous inputs, we prove a sharp minimax theorem for input approximation in $L^\infty$, normalized by the $BV$ norm: the optimal encoder is given by equal-variation sampling. For constitutive approximation, the correct vector-valued minimax statement is obtained by allowing the encoder to be material-law aware: it may compress the exact stress history $\mathcal P(\pi)$ rather than only the driving history $\pi$. The resulting stress-aware encoder, followed by the same discrete hereditary decoder, gives the sharp value $(2N)^{-1}$ under the natural nondegeneracy assumption $0\in\operatorname{int}C$. The scalar complementary-variable case is also recorded: there the input equal-variation encoder is sharp because the scalar stop/play operator is $L^\infty$-nonexpansive in the complementary variable. The results identify cumulative variation as the natural variable for sampling and compressing both driving and constitutive histories.

math.NA

A Quantum Spectral Solver for Periodic Incompressible Stokes Flow

We present a quantum spectral solver for the steady incompressible Stokes equations on a two-dimensional periodic domain. The method uses the Quantum Fourier Transform as a coherent change of basis and exploits the resulting spectral structure of the Stokes operator: the Laplacian becomes diagonal, while incompressibility is enforced mode by mode through a Helmholtz projection. In two dimensions, this projection is realized by a mode-dependent rotation from Cartesian velocity components to longitudinal--transverse coordinates, followed by component-conditioned inverse-Laplacian scaling. The velocity and pressure fields are encoded as quantum states over Fourier modes and physical components, and the corresponding spectral factors are implemented through polynomially encoded amplitude blocks. The construction extends recent quantum spectral methods in computational mechanics to an incompressible flow operator with explicit pressure--velocity splitting and divergence-free projection. The approach is also compatible with multiscale finite-element architectures in which quantum parallelism can simultaneously update all representative volume element (RVE) states. Numerical verification includes a steady vortex, a regularized periodic force-dipole benchmark, and an RVE-inspired Kolmogorov-like fluctuation benchmark. The latter illustrates how the circuit can recover a homogenized kinetic-energy observable without reconstructing the full velocity field, consistent with the role of averaged quantities in multiscale flow calculations. Under the standard assumptions of efficient state preparation and observable estimation, the circuit has polylogarithmic dependence on the grid resolution, with the polynomial degree and tile count appearing as explicit approximation and implementation parameters.

math.NA

Minmax neural-network architectures for data-to-solution value maps in nonlinear elasticity with generalized loads and variable Dirichlet data

We study the data-to-solution value map for quasistatic nonlinear elasticity in the linearized-kinematics regime, allowing both generalized loads and variable Dirichlet data. Under standard direct-method hypotheses, the negative minimum potential energy is finite and locally Lipschitz, convex in the load variable, and concave in the Dirichlet datum. Its supporting slopes, and its first variations at differentiability points, are the equilibrium displacement and the Dirichlet reaction. This convex--concave structure leads to a mechanics-preserving saddle minmax architecture in which displacement atoms generate load slopes, reaction atoms generate Dirichlet slopes, and the coupling coefficients are the corresponding trace-reaction pairings. Manufactured samples are produced by prescribing displacement--reaction pairs and computing the associated ambient data and exact value labels. The resulting architecture directly approximates the negative minimum-potential-energy value map and provides mechanical subgradient readouts. Immersed representations and cell-center quadrature make the construction implementable on background grids and geometry-rich domains. We prove uniform convergence on compact data sets with respect to atom enrichment and quadrature refinement, and illustrate the method on elementary examples.

math.NA

Identification of optimal history variables and corresponding hereditary laws in linear viscoelasticity

We develop an operator-theoretic formulation of hereditary constitutive models and characterize optimal finite-rank internal-variable approximations in the sense of Kolmogorov $N$-widths. The history operator is shown to be compact under natural assumptions on the relaxation kernel, thereby admitting optimal low-rank approximations. The resulting reduced models inherit thermodynamic consistency, stability, and provable approximation bounds. An analysis clarifies the structural relation between hereditary representations and internal-variable theories and provides a rigorous basis for reduced-order modeling in computational mechanics. Selected numerical examples showcase optimal convergence of approximations with respect to rank and sampling.

math-ph

Phase-Field Peridynamics

Peridynamics formulates the balance of linear momentum as an integro-differential equation, making it naturally suited for fracture modeling without special treatment of discontinuities. The bond-associated correspondence formulation provides a highly accurate peridynamic framework by computing bond-wise deformation gradients that are free of zero-energy modes and yield accurate results even near boundaries. However, the traditional fracture approach based on irreversible bond deletion can compromise this formulation, as the progressive removal of bonds degrades the nonlocal approximation of the deformation gradient and can lead to numerical instabilities. In this work, a novel phase-field peridynamics approach is introduced that avoids these instabilities. Instead of deleting bonds, the energetic contribution of each bond is continuously degraded through a bond phase-field parameter, while a separate kinematic degradation function preserves the accuracy of the nonlocal deformation gradient approximation. The normalization constant ensuring thermodynamic consistency with Griffith's fracture theory is derived analytically for general spherical kernel functions as a ratio of two one-dimensional integrals. Numerical examples including mode I and mode II fracture, the boundary tension test with different kernel functions and horizon ratios, and the Kalthoff-Winkler experiment demonstrate the stability, accuracy, and consistency of the proposed approach.

cs.CE

QAFE$^2$: Quantum accelerated multiscale finite element analysis

The computational cost of concurrent multiscale finite element methods is dominated by the repeated solution of microscopic representative volume element (RVE) problems at macroscopic quadrature points. In this work, we introduce a quantum-classical framework for multiscale finite element analysis (QAFE$^2$) that leverages quantum parallelism to fundamentally alter the scaling of RVE-based homogenisation. At the single-RVE level, the proposed quantum solver attains polylogarithmic complexity with respect to the microscopic discretisation size, yielding an exponential asymptotic speedup over the best available classical solvers. More importantly, QAFE$^2$ exploits quantum superposition and entanglement to evaluate, in a single quantum execution, the entire ensemble of RVE problems associated with all macroscopic quadrature points. This capability is a form of intrinsic quantum concurrency with no classical analogue. Numerical experiments on one- and two-dimensional model problems with known analytical solutions confirm the accuracy of the proposed formulation and verify the theoretical computational scaling and parallel performance.

math.NA

A variational critical-state theory of friction

Friction plays a fundamental role in many natural processes, including earthquakes, landslides, and volcanic eruptions. Earthquakes occur when highly compressed fault surfaces accumulate large enough shear stresses, causing the faults to move relative to one another, or slip. The slip is accommodated within a thin layer of comminuted granular material -- called fault gouge -- between the fault surfaces. As a result, characterizing the mechanical behavior of fault gouge in response to shear is a major open problem in earthquake source physics. Modeling gouge is complicated by large deformations, inelasticity, rate dependence, and volumetric changes. As such, researchers typically rely on empirical formulations to capture the effective response. Here, we systematically develop a variational, finite-kinematics framework for fault gouge. We first describe a general theory for a rigid-viscoplastic, pressure-sensitive material, where the plasticity evolution follows from the principle of maximum dissipation. Then, we specialize the governing equations for a Cam-Clay material within a shearing and dilating layer. We rely on convexity considerations and experimental observations from consolidation tests of granular layers to calibrate the model and develop explicit solutions for the rate- and state- dependent response of the model to shear tests under constant compressive normal stress and prescribed shearing rate. To validate the model, we select common rate functions and compare numerical material point tests and theoretical solutions to standard laboratory experiments of shearing granular layers. Lastly, we discuss connections of the model to empirical rate-and-state friction laws.

cond-mat.mtrl-sci

Linear viscoelasticity: Mechanics, analysis and approximation

The aim of this review is to highlight the connection between well-established physical and mathematical principles as they pertain to the theory of linear viscoelasticity. We begin by examining the physical foundations of Boltzmann and Volterra's hereditary law formalism, and how those principles restrict the form of the hereditary law. We then turn to questions of material stability and continuous dependence on the stress history within the framework of the Lax-Milgram theorem, which we find to set forth rigorous and unequivocal conditions for the well-posedness of the linear viscoelastic problem. The outcome of this analysis is remarkable in that it gives precise meaning to fundamental physical properties such as fading memory. Finally, we turn to the question of best representation of viscoelastic materials by finite-rank hereditary operators or, equivalently, by a finite set of history or internal variables. We note that the theory of Hilbert-Schmidt operators and $N$-widths supplies the answer to the question.

math-ph

A Quantum Spectral Method for Non-Periodic Boundary Value Problems

Quantum computing holds the promise of solving computational mechanics problems in polylogarithmic time, meaning computational time scales as $\mathscr{O}((\log N)^c)$, where $N$ is the problem size and $c$ a constant. We propose a quantum spectral method with polylogarithmic complexity for solving non-periodic boundary value problems with arbitrary Dirichlet boundary conditions. Our method extends the recently proposed approach by Liu et al. (2025), in which periodic problems are discretised using truncated Fourier series. In such spectral methods, the discretisation of boundary value problems with constant coefficients leads to a set of algebraic equations in the Fourier space. We implement the respective diagonal solution operator by first approximating it with a polynomial and then quantum encoding the polynomial. The mapping between the physical and Fourier spaces is accomplished using the quantum Fourier transform (QFT). To impose zero Dirichlet boundary conditions, we double the domain size and reflect all physical fields antisymmetrically. The respective reflection matrix defines the quantum sine transform (QST) by pre- and post-multiplying with the QFT. For non-zero Dirichlet boundary conditions, the solution is decomposed into a boundary-conforming and a homogeneous part. The homogenous part is determined by solving a problem with a suitably modified forcing vector. We illustrate the basic approach with a Dirichlet-Poisson problem and demonstrate its generality by applying it to a fractional stochastic PDE for modelling spatial random fields. We discuss the circuit implementation of the proposed approach and provide numerical evidence confirming its polylogarithmic complexity.

math.NA

An optimal-transport finite-particle method for driven mass diffusion

We formulate a finite-particle method of mass transport that accounts for general mixed boundary conditions. The particle method couples a geometrically-exact treatment of advection; Wasserstein gradient-flow dynamics; and a Kullback-Leibler representation of the entropy. General boundary conditions are enforced by introducing an adsorption/depletion layer at the boundary wherein particles are added or removed as dictated by the boundary conditions. We demonstrate the range and scope of the method through a number of examples of application, including absorption of particles into a sphere and flow through pipes of square and circular cross section, with and without occlusions. In all cases, the solution is observed to converge weakly, or in the sense of local averages.

math.NA

Data-driven micromorphic mechanics for materials with strain localization

This paper explores the role of generalized continuum mechanics, and the feasibility of model-free data-driven computing approaches thereof, in solids undergoing failure by strain localization. Specifically, we set forth a methodology for capturing material instabilities using data-driven mechanics without prior information regarding the failure mode. We show numerically that, in problems involving strain localization, the standard data-driven framework for Cauchy/Boltzmann continua fails to capture the length scale of the material, as expected. We address this shortcoming by formulating a generalized data-driven framework for micromorphic continua that effectively captures both stiffness and length-scale information, as encoded in the material data, in a model-free manner. These properties are exhibited systematically in a one-dimensional softening bar problem and further verified through selected plane-strain problems.

math.NA

A well-posed variational approach to the identification and convergent approximation of material laws from boundary data

We formulate the problem of material identification as a problem of optimal control in which the deformation of the specimen is the state variable and the unknown material law is the control variable. We assume that the material obeys finite elasticity and that the deformation of the specimen is in static equilibrium with prescribed boundary displacements. We further assume that the attendant total energy of the specimen can be measured, e.g., with the aid of the work-energy identity. In particular, no full-field measurements, such as DIC, are required. The cost function measures the maximum discrepancy between the total elastic energy corresponding to a trial material law and the measured total elastic energy over a range of prescribed boundary displacements. The question of material identifiability is thus reduced to the question of existence and uniqueness of controls. We propose a specific functional framework, prove existence of optimal controls and show that the question of material identifiability hinges on the separating properties of the boundary data. The proposed framework naturally suggests and supports approximation by maxout neural networks, i.e., neural networks of piecewise affine or polyaffine functions and a maximum, or join, activation function. We show that maxout neural networks have the requisite density property in the space of energy densities and result in convergent approximations as the number of neurons increases to infinity. Simple examples are also presented that illustrate the minimax structure of the identification problem.

math.FA

Towards Quantum Computational Mechanics

The advent of quantum computers, operating on entirely different physical principles and abstractions from those of classical digital computers, sets forth a new computing paradigm that can potentially result in game-changing efficiencies and computational performance. Specifically, the ability to simultaneously evolve the state of an entire quantum system leads to quantum parallelism and interference. Despite these prospects, opportunities to bring quantum computing to bear on problems of computational mechanics remain largely unexplored. In this work, we demonstrate how quantum computing can indeed be used to solve representative volume element (RVE) problems in computational homogenisation with polylogarithmic complexity of $\mathcal{O}((\log N)^c)$, compared to $\mathcal{O}(N^c)$ in classical computing. Thus, our quantum RVE solver attains exponential acceleration with respect to classical solvers, bringing concurrent multiscale computing closer to practicality. The proposed quantum RVE solver combines conventional algorithms such as a fixed-point iteration for a homogeneous reference material and the Fast Fourier Transform (FFT). However, the quantum computing reformulation of these algorithms requires a fundamental paradigm shift and a complete rethinking and overhaul of the classical implementation. We employ or develop several techniques, including the Quantum Fourier Transform (QFT), quantum encoding of polynomials, classical piecewise Chebyshev approximation of functions and an auxiliary algorithm for implementing the fixed-point iteration and show that, indeed, an efficient implementation of RVE solvers on quantum computers is possible. We additionally provide theoretical proofs and numerical evidence confirming the anticipated $\mathcal{O} \left ((\log N)^c \right)$ complexity of the proposed solver.

quant-ph

A discrete crystal model in three dimensions: the line-tension limit for dislocations

We propose a discrete lattice model of the energy of dislocations in three-dimensional crystals which properly accounts for lattice symmetry and geometry, arbitrary harmonic interatomic interactions, elastic deformations and discrete crystallographic slip on the full complement of slip systems of the crystal class. Under the assumption of diluteness, we show that the discrete energy converges, in the sense of $Γ$-convergence, to a line-tension energy defined on Volterra line dislocations, regarded as integral vector-valued currents supported on rectifiable curves. Remarkably, the line-tension limit is of the same form as that derived from semi-discrete models of linear elastic dislocations based on a core cutoff regularization. In particular, the line-tension energy follows from a cell relaxation and differs from the classical ansatz, which is quadratic in the Burgers vector.

math.AP

Point collocation with mollified piecewise polynomial approximants for high-order partial differential equations

The solution approximation for partial differential equations (PDEs) can be substantially improved using smooth basis functions. The recently introduced mollified basis functions are constructed through mollification, or convolution, of cell-wise defined piecewise polynomials with a smooth mollifier of certain characteristics. The properties of the mollified basis functions are governed by the order of the piecewise functions and the smoothness of the mollifier. In this work, we exploit the high-order and high-smoothness properties of the mollified basis functions for solving PDEs through the point collocation method. The basis functions are evaluated at a set of collocation points in the domain. In addition, boundary conditions are imposed at a set of boundary collocation points distributed over the domain boundaries. To ensure the stability of the resulting linear system of equations, the number of collocation points is set larger than the total number of basis functions. The resulting linear system is overdetermined and is solved using the least square technique. The presented numerical examples confirm the convergence of the proposed approximation scheme for Poisson, linear elasticity, and biharmonic problems. We study in particular the influence of the mollifier and the spatial distribution of the collocation points.

math.NA