arXiv subjects

Roger A. Sauer

Publications and source records attributed to Roger A. Sauer.

At least 19 recordsLinked to original sources

arXiv2026

Contact-based inverse analysis for nonlinear material identification in spatially heterogeneous solids

This study presents a contact-based isogeometric Finite Element Model Updating (FEMU) framework for identifying spatially varying constitutive parameters of nonlinear solids. The formulation considers large quasi-static deformations of hyperelastic 3D solids and thin shells due to mechanical contact. The proposed inverse approach utilizes full-field displacement measurements available at least on the free surface and, in the case of pure Dirichlet boundary conditions, the resultant contact forces as well. The nonuniform material parameter fields are discretized using low-order Lagrange interpolation independent of the isogeometric analysis mesh, providing control over the inverse problem size and potential discontinuities in the material. The FEMU least-squares objective is minimized using a trust-region reflective algorithm - a local gradient-based optimization approach. Computational efficiency is enhanced through the analytical derivatives of the objective and a material continuation strategy. The proposed framework is evaluated through three numerical examples based on synthetically generated data: a Canham shell strip on a rigid foundation, indentation of a Koiter shell model of the human abdominal wall, and indentation of a Neo-Hookean block. The examples verify the ability of the proposed method to reconstruct inhomogeneous material via mechanical contact. Analytical derivatives improve the computational efficiency and facilitate conducting sensitivity and identifiability analyses of the material parameters. The presented approach is non-destructive and can be used for various inverse problems, such as in-vivo biomechanics of soft tissues and laboratory material characterization.

cs.CE↗

arXiv2026

A variable-offset joint formulation for beams with arbitrary cross-sections using a null space method

In this paper, we present a variational formulation of local configurational constraints that couple multiple beams with arbitrarily shaped cross-sections. Since this formulation requires no explicit interface to rotational degrees-of-freedom, it applies to any beam kinematics and finite element discretization. Here, we define the offset coordinates in a moving frame to constrain or release the relative position between connected beams. The present method is based on a first-order approximation of the Lagrange multiplier field in the cross-section, which limits the transferability of the joint to the resultant force and moment only. The multipliers are eliminated using a discrete null space method, which provides size reduction and improved conditioning of the system matrix. Further, we apply the developed formulation to a beam element based on extensible directors and to a brick element in nonlinear elastostatics. Several numerical examples are presented.

math.NA↗

arXiv2026

A coupled finite element formulation for chemo-mechano-thermodynamical contact and its application to bonding and debonding

This work presents a finite element formulation for coupled chemo-mechano-thermodynamical large deformation contact. The formulation is based on the contact theory of Sauer et al. (2022) that contains six coupled (but separate) fields: the deformation and temperature of the two contacting bodies, as well as an interfacial bonding field and interfacial temperature. The latter is governed by the chemical and mechanical energy dissipation at the interface. Here the focus is placed on the evolution of bonding and debonding, and how it is coupled to the mechanical and thermal contact state. Several elementary models are proposed for this based on a quadratic contact potential. The resulting contact formulation becomes very general and versatile, which is illustrated by several challenging examples. They include pressure- and gap- depended bonding, exothermic bonding reactions, thermal hardening and thermal expansion, as well as simultaneous bonding and debonding. They are based on a monolithic finite element implementation using classical and isogeometric shape functions together with implicit time integration. Its full linearization, required for the Newton-Raphson solution method, is also provided. If bonding sites are material points, the bonding variable can be condensed-out locally.

cs.CE↗

arXiv2026

A survey of interlayer interaction models for graphene and other 2D materials

This work presents a survey of mechanical models describing van der Waals interactions between 2D materials, encompassing both continuous elastomer-like materials and discrete (crystalline) 2D materials such as graphene. These interactions give rise to a range of physical phenomena, including contact instabilities, Moiré patterns, surface reconstructions, and superlubricity. The underlying contact forces follow from the variation of an interfacial interaction potential. The presentation first discusses normal contact models, and then tangential contact models. Both atomistic and continuum approaches are considered. In addition, the influence of external loading and changes in length scale on the ground state configuration and frictional contact behavior are analyzed. A particular emphasis is placed on discussing strategies that reduce computational cost in multiscale modeling.

physics.comp-ph↗

arXiv2026

A computational model for short-range van der Waals interactions between beams and shells

We consider potential-based interactions between beams (or fibers) and shells (or membranes) using a coarse-grained approach with focus on van der Waals attraction and steric repulsion. The involved 6D integral over volumes of a beam and a shell is split into a 5D analytical pre-integration over the beam's cross section and a surrogate plate tangential to the closest point on the shell, and the remaining 1D numerical integration along the beam's axis. This general inverse-power interaction potential is added to the potential energies of the Bernoulli-Euler beam and the Kirchhoff-Love shell. The total potential energy is spatially discretized using isogeometric finite elements, and the nonlinear weak form of quasi-static equilibrium is solved using the continuation method. We provide error estimates and convergence analysis, together with two intriguing numerical examples. The developed approach provides excellent balance between accuracy and efficiency for small separations.

math.NA↗

arXiv2025

Nonlinear elastodynamic material identification of heterogeneous isogeometric Bernoulli-Euler beams

This paper presents a Finite Element Model Updating framework for identifying heterogeneous material distributions in planar Bernoulli-Euler beams based on a rotation-free isogeometric formulation. The procedure follows two steps: First, the elastic properties are identified from quasi-static displacements; then, the density is determined from modal data (low frequencies and mode shapes), given the previously obtained elastic properties. The identification relies on three independent discretizations: the isogeometric finite element mesh, a high-resolution grid of experimental measurements, and a material mesh composed of low-order Lagrange elements. The material mesh approximates the unknown material distributions, with its nodal values serving as design variables. The error between experiments and numerical model is expressed in a least squares manner. The objective is minimized using local optimization with the trust-region method, providing analytical derivatives to accelerate computations. Several numerical examples exhibiting large displacements are provided to test the proposed approach. To alleviate membrane locking, the B2M1 discretization is employed when necessary. Quasi-experimental data is generated using refined finite element models with random noise applied up to 4%. The method yields satisfactory results as long as a sufficient amount of experimental data is available, even for high measurement noise. Regularization is used to ensure a stable solution for dense material meshes. The density can be accurately reconstructed based on the previously identified elastic properties. The proposed framework can be straightforwardly extended to shells and 3D continua.

cs.CE↗

arXiv2025

A curvilinear surface ALE formulation for self-evolving Navier-Stokes manifolds - Stabilized finite element formulation

This work presents a stabilized finite element formulation of the arbitrary Lagrangian-Eulerian (ALE) surface theory for Navier-Stokes flow on self-evolving manifolds developed in Sauer (2025). The formulation is physically frame-invariant, applicable to large deformations, and relevant to fluidic surfaces such as soap films, capillary menisci and lipid membranes, which are complex and inherently unstable physical systems. It is applied here to area-incompressible surface flows using a stabilized pressure-velocity (or surface tension-velocity) formulation based on quadratic finite elements and implicit time integration. The unknown ALE mesh motion is determined by membrane elasticity such that the in-plane mesh motion is stabilized without affecting the physical behavior of the system. The resulting three-field system is monolithically coupled, and fully linearized within the Newton-Rhapson solution method. The new formulation is demonstrated on several challenging examples including shear flow on self-evolving surfaces and inflating soap bubbles with partial inflow on evolving boundaries. Optimal convergence rates are obtained in all cases. Particularly advantageous are C1-continuous surface discretizations, for example based on NURBS.

physics.flu-dyn↗

arXiv2025

Investigating the sliding behavior of graphene nanoribbons

This work presents a Euler-Bernoulli beam finite element (FE) model to study the interlayer interaction mechanics of graphene nanoribbon (GNR) over a graphene substrate. The FE model is calibrated using molecular dynamics (MD) simulations employing the potential of Kolmogorov and Crespi. This study focuses mainly on the effect of boundary conditions on sliding behavior and strain transfer between layers when the substrate is subjected to uniform biaxial deformations. The interlayer shearing or sliding behavior is found to depend on the presence of critical parameters, namely, the applied strain to the substrate and the length of the GNR. The FE results indicate that the applied strain transferred from the substrate to the GNR varies linearly up to a critical value ec beyond which it decreases suddenly. Further, ec is found to appear beyond a critical GNR length, Le is approximately 14 nm. Furthermore, a length parameter Ld is approximately 10 nm is computed, beyond which the sliding of GNR is dissipative. Through FE simulations, it is also found that for a GNR length is greater than or equal to 17 nm, the edge pulling force saturates. Our results also highlight the importance of the inertia of GNR on its sliding for different boundary conditions. It is also concluded that the maximum strain that can be transferred to GNR lies between 0.59% and 1.15%. The results of the FE approach align with MD simulations within an error of approximately 10% that can be attributed to the choice of material parameters and the simulation setup.

physics.comp-ph↗

arXiv2025

A curvilinear surface ALE formulation for self-evolving Navier-Stokes manifolds -- General theory and analytical solutions

A new arbitrary Lagrangian-Eulerian (ALE) formulation for Navier-Stokes flow on self-evolving surfaces is presented. It is based on a general curvilinear surface parameterization that describes the motion of the ALE frame. Its in-plane part becomes fully arbitrary, while its out-of-plane part follows the material motion of the surface. This allows for the description of flows on deforming surfaces using only surface meshes. The unknown fields are the fluid density or pressure, the fluid velocity and the surface motion, where the latter two share the same normal velocity. The corresponding field equations are the continuity equation or area-incompressibility constraint, the surface Navier-Stokes equations, and suitable surface mesh equations. Particularly advantageous are mesh equations based on membrane elasticity. The presentation focuses on the coupled set of strong and weak form equations, and presents several manufactured steady and transient solutions. These solutions are used together with numerical simulations to illustrate and discuss the properties of the proposed new ALE formulation. They also serve as basis for the development and verification of corresponding computational methods. The new formulation allows for a detailed study of fluidic membranes such as soap films, capillary menisci and lipid bilayers.

physics.flu-dyn↗

arXiv2025

A simple and efficient hybrid discretization approach to alleviate membrane locking in isogeometric thin shells

This work presents a new hybrid discretization approach to alleviate membrane locking in isogeometric finite element formulations for Kirchhoff-Love shells. The approach is simple, and requires no additional dofs and no static condensation. It does not increase the bandwidth of the tangent matrix and is effective for both linear and nonlinear problems. It combines isogeometric surface discretizations with classical Lagrange-based surface discretizations, and can thus be run with existing isogeometric finite element codes. Also, the stresses can be recovered straightforwardly. The effectiveness of the proposed approach in alleviating, if not eliminating, membrane locking is demonstrated through the rigorous study of the convergence behavior of several classical benchmark problems. Accuracy gains are particularly large in the membrane stresses. The approach is formulated here for quadratic NURBS, but an extension to other discretization types can be anticipated. The same applies to other constraints and associated locking phenomena.

cs.CE↗

arXiv2025

Efficient snap-to-contact computations for van der Waals interacting fibers

We consider van der Waals interactions between in-plane fibers, where the computational model employs the Lennard-Jones potential and the coarse-grained approach. The involved 6D integral over two interacting fibers is split into a 4D analytical pre-integration over cross sections and the remaining 2D numerical integration along the fibers' axes. Two section-section interaction laws are implemented, refined, and compared. Fibers are modeled using the Bernoulli-Euler beam theory and spatially discretized with isogeometric finite elements. We derive and solve the weak form of both quasi-static and dynamic boundary value problems. Four numerical examples involving highly nonlinear and dynamic snap-to-contact phenomena are scrutinized. We observe that the coarse-graining and pre-integration of interaction potentials enable the efficient modeling of complex phenomena at small length scales.

physics.comp-ph↗

arXiv2024

On analytical integration of interaction potentials between cylindrical and rectangular bodies with a focus on van der Waals attraction

The paper deals with the analytical integration of interaction potentials between specific geometries such as disks, cylinders, rectangles, and rectangular prisms. Interaction potentials are modeled as inverse-power laws with respect to the point-pair distance, and the complete body-body potential is obtained by pairwise summation (integration). Several exact new interaction laws are obtained, such as disk-plate and (in-plane) rectangle-rectangle for an arbitrary exponent, and disk-disk and rectangle-rectangle for van der Waals attraction. To balance efficiency and accuracy, additional approximate laws are proposed for disk-disk, point-cylinder, and disk-cylinder interactions. A brief numerical example illustrates the application of the pre-integrated Lennard-Jones disk-disk interaction potential for the interaction between elastic fibers.

physics.comp-ph↗

arXiv2024

An objective isogeometric mixed finite element formulation for nonlinear elastodynamic beams with incompatible warping strains

We present a stable mixed isogeometric finite element formulation for geometrically and materially nonlinear beams in transient elastodynamics, where a Cosserat beam formulation with extensible directors is used. The extensible directors yield a linear configuration space incorporating constant in-plane cross-sectional strains. Higher-order (incompatible) strains are introduced to correct stiffness, whose additional degrees-of-freedom are eliminated by an element-wise condensation. Further, the present discretization of the initial director field leads to the objectivity of approximated strain measures, regardless of the degree of basis functions. For physical stress resultants and strains, we employ a global patch-wise approximation using B-spline basis functions, whose higher-order continuity enables to use much less degrees-of-freedom, compared to element-wise approximation. For time-stepping, we employ an implicit energy-momentum consistent scheme, which exhibits superior numerical stability in comparison to standard trapezoidal and mid-point rules. Several numerical examples are presented to verify the present method.

math.NA↗

arXiv2024

Response to David Steigmann's discussion of our paper

We respond to David Steigmann's discussion of our paper "A general theory for anisotropic Kirchhoff-Love shells with in-plane bending of embedded fibers, Math. Mech. Solids, 28(5):1274-1317" (arXiv:2101.03122). His discussion allows us to clarify two misleading statements in our original paper, and confirm that its formulation is fully consistent with the formulation of Steigmann. We also demonstrate that some of our original statements criticized by Steigmann are not wrong.

cond-mat.mtrl-sci↗

arXiv2024

A continuum contact model for friction between graphene sheets that accounts for surface anisotropy and curvature

Understanding the interaction mechanics between graphene layers and co-axial carbon nanotubes (CNTs) is essential for modeling graphene and CNT-based nanoelectromechanical systems. This work proposes a new continuum contact model to study interlayer interactions between curved graphene sheets. The continuum model is calibrated and validated using molecular dynamics (MD) simulations. These are carried out employing the reactive empirical bond order (REBO)+Lennard-Jones (LJ) to model the interactions within a sheet, while the LJ, Kolmogorov-Crespi (KC), and Lebedeva potentials are used to model the interactions between sheets. The continuum contact model is formulated for separation distances greater than 0.29nm, when sheet deformations are sufficiently small and do not affect the sheet interactions substantially. This allows to treat the master contact surface as rigid, thus simplifying the contact formulation greatly. The model calibration is conducted systematically for a sequence of different stackings using existing and newly proposed ansatz functions. The calibrated continuum model is then implemented in a curvilinear finite element (FE) shell formulation to investigate the pull-out and twisting interactions between co-axial CNTs. The resisting pull-out forces and torques depend strongly on the chirality of the considered CNTs. The absolute differences between FE and MD results are very small, and can be attributed to model assumptions and loading conditions.

physics.comp-ph↗

arXiv2023

A selectively reduced degree basis for efficient mixed nonlinear isogeometric beam formulations with extensible directors

The effect of higher order continuity in the solution field by using NURBS basis function in isogeometric analysis (IGA) is investigated for an efficient mixed finite element formulation for elastostatic beams. It is based on the Hu-Washizu variational principle considering geometrical and material nonlinearities. Here we present a reduced degree of basis functions for the additional fields of the stress resultants and strains of the beam, which are allowed to be discontinuous across elements. This approach turns out to significantly improve the computational efficiency and the accuracy of the results. We consider a beam formulation with extensible directors, where cross-sectional strains are enriched to avoid Poisson locking by an enhanced assumed strain method. In numerical examples, we show the superior per degree-of-freedom accuracy of IGA over conventional finite element analysis, due to the higher order continuity in the displacement field. We further verify the efficient rotational coupling between beams, as well as the path-independence of the results.

math.NA↗

arXiv2023

Comparing quantum, molecular and continuum models for graphene at large deformations

In this paper, the validity and accuracy of three interatomic potentials and the continuum shell model of Ghaffari and Sauer [1] are investigated. The mechanical behavior of single-layered graphene sheets (SLGSs) under uniaxial stretching, biaxial stretching and pure bending is studied for this comparison. The validity of the molecular and continuum models is assessed by direct comparison with density functional theory (DFT) data available in the literature. The molecular simulations are carried out employing the MM3, Tersoff and REBO+LJ potentials. The continuum formulation uses an anisotropic hyperelastic material model in the framework of the geometrically exact Kirchhoff-Love shell theory and isogeometric finite elements. Results from the continuum model are in good agreement with those from DFT. The results from the MM3 potential agree well up to the point of material instability, whereas those from the REBO+LJ and Tersoff potentials agree only for small deformations. Only the Tersoff potential is found to yield auxetic response in SLGSs under uniaxial stretch. Additionally, the transverse vibration frequencies of a pre-stretched graphene sheet and a carbon nanocone are obtained using the continuum model and molecular simulations with the MM3 potential. The variations of the frequencies from these approaches agree within an error of 5%.

physics.comp-ph↗

arXiv2023

A new anisotropic bending model for nonlinear shells: Comparison with existing models and isogeometric finite element implementation

A new nonlinear hyperelastic bending model for shells formulated directly in surface form is presented, and compared to four prominently used bending models. Through an essential set of elementary nonlinear bending test cases, the stresses and moments of each model are examined analytically. Only the proposed bending model passes all the test cases while the other bending models either fail or only pass the test cases for small deformations. The proposed new bending model can handle large deformations and initially curved surfaces. It is based on the principal curvatures and their directions in the initial configuration, and it thus can have different bending moduli along those directions. These characteristics make it flexible in modeling a given material, while it does not suffer from the pathologies of existing bending models. Further, the bending models are compared computationally through four classical benchmark examples and one contact example. As the underlying shell theory is based on Kirchhoff-Love kinematics, isogeometric NURBS shape functions are used to discretize the shell surface. The linearization and efficient finite element implementation of the proposed new model are also provided.

cs.CE↗