arXiv subjects

Michele Ruggeri

Publications and source records attributed to Michele Ruggeri.

At least 19 recordsLinked to original sources

arXiv2026

A decoupled, stable, and second-order integrator for the Landau--Lifshitz--Gilbert equation with magnetoelastic effects

We consider the numerical approximation of a nonlinear system of partial differential equations modeling magnetostriction in the small-strain regime consisting of the Landau--Lifshitz--Gilbert equation for the magnetization and the conservation of linear momentum law for the displacement. We propose a fully discrete numerical scheme based on first-order finite elements for the spatial discretization. The time discretization employs a combination of the classical Newmark-$β$ scheme for the displacement and the midpoint scheme for the magnetization, applied in a decoupled fashion. The resulting method is fully linear and formally of second order in time. We derive the discrete energy law satisfied by the approximations and prove the stability of the scheme. Finally, we assess the performance of the proposed method in a collection of numerical experiments.

math.NA↗

arXiv2026

Projection-free approximation of flows of harmonic maps with quadratic constraint accuracy and variable step sizes

We construct and analyze a projection-free linearly implicit method for the approximation of flows of harmonic maps into spheres. The proposed method is unconditionally energy stable and, under a sharp discrete regularity condition, achieves second-order accuracy with respect to the constraint violation. Furthermore, the method accommodates variable step sizes to speed up the convergence to stationary points and to improve the accuracy of the numerical solutions near singularities, without affecting the unconditional energy stability and the constraint violation property. We illustrate the accuracy in approximating the unit-length constraint and the performance of the method through a series of numerical experiments, and compare it with the linearly implicit Euler and two-step BDF methods.

math.NA↗

arXiv2025

Goal-oriented adaptivity for multilevel stochastic Galerkin FEM with nonlinear goal functionals

This paper is concerned with the numerical approximation of quantities of interest associated with solutions to parametric elliptic partial differential equations (PDEs). The key novelty of this work is in its focus on the quantities of interest represented by continuously Gâteaux differentiable nonlinear functionals. We consider a class of parametric elliptic PDEs where the underlying differential operator has affine dependence on a countably infinite number of uncertain parameters. We design a goal-oriented adaptive algorithm for approximating nonlinear functionals of solutions to this class of parametric PDEs. In the algorithm, the approximations of parametric solutions to the primal and dual problems are computed using the multilevel stochastic Galerkin finite element method (SGFEM) and the adaptive refinement process is guided by reliable spatial and parametric error reduction indicators. We prove that the proposed algorithm generates multilevel SGFEM approximations for which the estimates of the error in the goal functional converge to zero. Numerical experiments for a selection of test problems and nonlinear quantities of interest illustrate and underpin our theoretical findings.

math.NA↗

arXiv2025

A decoupled, convergent and fully linear algorithm for the Landau--Lifshitz--Gilbert equation with magnetoelastic effects

We consider the coupled system of the Landau--Lifshitz--Gilbert equation and the conservation of linear momentum law to describe magnetic processes in ferromagnetic materials including magnetoelastic effects in the small-strain regime. For this nonlinear system of time-dependent partial differential equations, we present a decoupled integrator based on first-order finite elements in space and an implicit one-step method in time. We prove unconditional convergence of the sequence of discrete approximations towards a weak solution of the system as the mesh size and the time-step size go to zero. Compared to previous numerical works on this problem, for our method, we prove a discrete energy law that mimics that of the continuous problem and, passing to the limit, yields an energy inequality satisfied by weak solutions. Moreover, our method does not employ a nodal projection to impose the unit length constraint on the discrete magnetisation, so that the stability of the method does not require weakly acute meshes. Furthermore, our integrator and its analysis hold for a more general setting, including body forces and traction, as well as a more general representation of the magnetostrain. Numerical experiments underpin the theory and showcase the applicability of the scheme for the simulation of the dynamical processes involving magnetoelastic materials at submicrometer length scales.

math.NA↗

arXiv2025

Optimal convergence rates of an adaptive hybrid FEM-BEM method for full-space linear transmission problems

We consider a hybrid FEM-BEM method to compute approximations of full-space linear elliptic transmission problems. First, we derive a priori and a posteriori error estimates. Then, building on the latter, we present an adaptive algorithm and prove that it converges at optimal rates with respect to the number of mesh elements. Finally, we provide numerical experiments, demonstrating the practical performance of the adaptive algorithm.

math.NA↗

arXiv2023

Convergent finite element methods for antiferromagnetic and ferrimagnetic materials

We consider the numerical approximation of a continuum model of antiferromagnetic and ferrimagnetic materials. The state of the material is described in terms of two unit-length vector fields, which can be interpreted as the magnetizations averaging the spins of two sublattices. For the static setting, which requires the solution of a constrained energy minimization problem, we introduce a discretization based on first-order finite elements and prove its $Γ$-convergence. Then, we propose and analyze two iterative algorithms for the computation of low-energy stationary points. The algorithms are obtained from (semi-)implicit time discretizations of gradient flows of the energy. Finally, we extend the algorithms to the dynamic setting, which consists of a nonlinear system of two Landau-Lifshitz-Gilbert equations solved by the two fields, and we prove unconditional stability and convergence of the finite element approximations toward a weak solution of the problem. Numerical experiments assess the performance of the algorithms and demonstrate their applicability for the simulation of physical processes involving antiferromagnetic and ferrimagnetic materials.

math.NA↗

arXiv2023

A time splitting method for the three-dimensional linear Pauli equation

We analyze a numerical method to solve the time-dependent linear Pauli equation in three space dimensions. The Pauli equation is a semi-relativistic generalization of the Schrödinger equation for 2-spinors which accounts both for magnetic fields and for spin, with the latter missing in preceding numerical work on the linear magnetic Schrödinger equation. We use a four operator splitting in time, prove stability and convergence of the method and derive error estimates as well as meshing strategies for the case of given time-independent electromagnetic potentials, thus providing a generalization of previous results for the magnetic Schrödinger equation.

math.NA↗

arXiv2022

Rational-approximation-based model order reduction of Helmholtz frequency response problems with adaptive finite element snapshots

We introduce several spatially adaptive model order reduction approaches tailored to non-coercive elliptic boundary value problems, specifically, parametric-in-frequency Helmholtz problems. The offline information is computed by means of adaptive finite elements, so that each snapshot lives in a different discrete space that resolves the local singularities of the analytical solution and is adjusted to the considered frequency value. A rational surrogate is then assembled adopting either a least-squares or an interpolatory approach, yielding function-valued version of the standard rational interpolation method ($\mathcal{V}$-SRI) and the minimal rational interpolation method (MRI). In the context of building an approximation for linear or quadratic functionals of the Helmholtz solution, we perform several numerical experiments to compare the proposed methodologies. Our simulations show that, for interior resonant problems (whose singularities are encoded by poles on the real axis), the spatially adaptive $\mathcal{V}$-SRI and MRI work comparably well. Instead, when dealing with exterior scattering problems, whose frequency response is mostly smooth, the $\mathcal{V}$-SRI method seems to be the best-performing one.

math.NA↗

arXiv2022

The mass-lumped midpoint scheme for computational micromagnetics: Newton linearization and application to magnetic skyrmion dynamics

We discuss a mass-lumped midpoint scheme for the numerical approximation of the Landau-Lifshitz-Gilbert equation, which models the dynamics of the magnetization in ferromagnetic materials. In addition to the classical micromagnetic field contributions, our setting covers the non-standard Dzyaloshinskii-Moriya interaction, which is the essential ingredient for the enucleation and stabilization of magnetic skyrmions. Our analysis also includes the inexact solution of the arising nonlinear systems, for which we discuss both a constraint preserving fixed-point solver from the literature and a novel approach based on the Newton method. We numerically compare the two linearization techniques and show that the Newton solver leads to a considerably lower number of nonlinear iterations. Moreover, in a numerical study on magnetic skyrmions, we demonstrate that, for magnetization dynamics that are very sensitive to energy perturbations, the midpoint scheme, due to its conservation properties, is superior to the dissipative tangent plane schemes from the literature.

math.NA↗

arXiv2021

Multi-scale simulation of the adsorption of lithium ion on graphite surface: from Quantum Monte Carlo to Molecular Density Functional Theory

The structure of the double-layer formed at the surface of carbon electrodes is governed by the interactions between the electrode and the electrolyte species. However, carbon is notoriously difficult to simulate accurately, even with well-established methods such as electronic Density Functional Theory and Molecular Dynamics. Here we focus on the important case of a lithium ion in contact with the surface of graphite, and we perform a series of reference Quantum Monte Carlo calculations that allow us to benchmark various electronic Density Functional Theory functionals. We then fit an accurate carbon--lithium pair potential, which is used in molecular Density Functional Theory calculations to determine the free energy of the adsorption of the ion on the surface in the presence of water. The adsorption profile in solution differs markedly from the gas phase results, which emphasize the role of the solvent on the properties of the double-layer.

cond-mat.mtrl-sci↗

arXiv2021

Unconditional well-posedness and IMEX improvement of a family of predictor-corrector methods in micromagnetics

Recently, Kim & Wilkening (Convergence of a mass-lumped finite element method for the Landau-Lifshitz equation, Quart. Appl. Math., 76, 383-405, 2018) proposed two novel predictor-corrector methods for the Landau-Lifshitz-Gilbert equation (LLG) in micromagnetics, which models the dynamics of the magnetization in ferromagnetic materials. Both integrators are based on the so-called Landau-Lifshitz form of LLG, use mass-lumped variational formulations discretized by first-order finite elements, and only require the solution of linear systems, despite the nonlinearity of LLG. The first(-order in time) method combines a linear update with an explicit projection of an intermediate approximation onto the unit sphere in order to fulfill the LLG-inherent unit-length constraint at the discrete level. In the second(-order in time) integrator, the projection step is replaced by a linear constraint-preserving variational formulation. In this paper, we extend the analysis of the integrators by proving unconditional well-posedness and by establishing a close connection of the methods with other approaches available in the literature. Moreover, the new analysis also provides a well-posed integrator for the Schrödinger map equation (which is the limit case of LLG for vanishing damping). Finally, we design an implicit-explicit strategy for the treatment of the lower-order field contributions, which significantly reduces the computational cost of the schemes, while preserving their theoretical properties.

math.NA↗

arXiv2021

Numerical analysis of the Landau-Lifshitz-Gilbert equation with inertial effects

We consider the numerical approximation of the inertial Landau-Lifshitz-Gilbert equation (iLLG), which describes the dynamics of the magnetization in ferromagnetic materials at subpicosecond time scales. We propose and analyze two fully discrete numerical schemes: The first method is based on a reformulation of the problem as a linear constrained variational formulation for the linear velocity. The second method exploits a reformulation of the problem as a first order system in time for the magnetization and the angular momentum. Both schemes are implicit, based on first-order finite elements, and generate approximations satisfying the unit-length constraint of iLLG at the vertices of the underlying mesh. For both methods, we prove convergence of the approximations towards a weak solution of the problem. Numerical experiments validate the theoretical results and show the applicability of the methods for the simulation of ultrafast magnetic processes.

math.NA↗

arXiv2021

Gamma-convergent projection-free finite element methods for nematic liquid crystals: The Ericksen model

The Ericksen model for nematic liquid crystals couples a director field with a scalar degree of orientation variable, and allows the formation of various defects with finite energy. We propose a simple but novel finite element approximation of the problem that can be implemented easily within standard finite element packages. Our scheme is projection-free and thus circumvents the use of weakly acute meshes, which are quite restrictive in 3D but are required by recent algorithms for convergence. We prove stability and $Γ$-convergence properties of the new method in the presence of defects. We also design an effective nested gradient flow algorithm for computing minimizers that controls the violation of the unit-length constraint of the director. We present several simulations in 2D and 3D that document the performance of the proposed scheme and its ability to capture quite intriguing defects.

math.NA↗

arXiv2021

Two-level a posteriori error estimation for adaptive multilevel stochastic Galerkin FEM

The paper considers a class of parametric elliptic partial differential equations (PDEs), where the coefficients and the right-hand side function depend on infinitely many (uncertain) parameters. We introduce a two-level a posteriori estimator to control the energy error in multilevel stochastic Galerkin approximations for this class of PDE problems. We prove that the two-level estimator always provides a lower bound for the unknown approximation error, while the upper bound is equivalent to a saturation assumption. We propose and empirically compare three adaptive algorithms, where the structure of the estimator is exploited to perform spatial refinement as well as parametric enrichment. The paper also discusses implementation aspects of computing multilevel stochastic Galerkin approximations.

math.NA↗

arXiv2020

Micromagnetics of thin films in the presence of Dzyaloshinskii-Moriya interaction

In this paper, we study the thin-film limit of the micromagnetic energy functional in the presence of bulk Dzyaloshinskii-Moriya interaction (DMI). Our analysis includes both a stationary $Γ$-convergence result for the micromagnetic energy, as well as the identification of the asymptotic behavior of the associated Landau-Lifshitz-Gilbert equation. In particular, we prove that, in the limiting model, part of the DMI term behaves like the projection of the magnetic moment onto the normal to the film, contributing this way to an increase in the shape anisotropy arising from the magnetostatic self-energy. Finally, we discuss a convergent finite element approach for the approximation of the time-dependent case and use it to numerically compare the original three-dimensional model with the two-dimensional thin-film limit.

math.AP↗

arXiv2020

Quantum Monte Carlo determination of the principal Hugoniot of deuterium

We present Coupled Electron-Ion Monte Carlo results for the principal Hugoniot of deuterium together with an accurate study of the initial reference state of shock wave experiments. We discuss the influence of nuclear quantum effects, thermal electronic excitations, and the convergence of the energy potential surface by wave function optimization within Variational Monte Carlo and Projection Quantum Monte Carlo methods. Compared to a previous study, the new calculations also include low pressure-temperature (P,T) conditions resulting in close agreement with experimental data, while our revised results at higher (P,T) conditions still predict a more compressible Hugoniot than experimentally observed.

physics.comp-ph↗

arXiv2019

The saturation assumption yields optimal convergence of two-level adaptive BEM

We consider the convergence of adaptive BEM for weakly-singular and hypersingular integral equations associated with the Laplacian and the Helmholtz operator in 2D and 3D. The local mesh-refinement is driven by some two-level error estimator. We show that the adaptive algorithm drives the underlying error estimates to zero. Moreover, we prove that the saturation assumption already implies linear convergence of the error with optimal algebraic rates.

math.NA↗

arXiv2019

Convergent tangent plane integrators for the simulation of chiral magnetic skyrmion dynamics

We consider the numerical approximation of the Landau-Lifshitz-Gilbert equation, which describes the dynamics of the magnetization in ferromagnetic materials. In addition to the classical micromagnetic contributions, the energy comprises the Dzyaloshinskii-Moriya interaction, which is the most important ingredient for the enucleation and the stabilization of chiral magnetic skyrmions. We propose and analyze three tangent plane integrators, for which we prove (unconditional) convergence of the finite element solutions towards a weak solution of the problem. The analysis is constructive and also establishes existence of weak solutions. Numerical experiments demonstrate the applicability of the methods for the simulation of practically relevant problem sizes.

math.NA↗