Dynamics of periodic mechanical structures containing bistable elastic elements: From elastic to solitary wave propagation

We investigate the nonlinear dynamics of a periodic chain of bistable elements consisting of masses connected by elastic springs whose constraint arrangement gives rise to a large-deformation snap-through instability. We show that the resulting negative-stiffness effect produces three different regimes of (linear and nonlinear) wave propagation in the periodic medium, depending on the wave amplitude. At small amplitudes, linear elastic waves experience dispersion that is controllable by the geometry and by the level of precompression. At moderate to large amplitudes, solitary waves arise in the weakly and strongly nonlinear regime. For each case, we present closed-form analytical solutions and we confirm our theoretical findings by specific numerical examples. The precompression reveals a class of wave propagation for a partially positive and negative potential. The presented results highlight opportunities in the design of mechanical metamaterials based on negative-stiffness elements, which go beyond current concepts primarily based on linear elastic wave propagation. Our findings shed light on the rich effective dynamics achievable by nonlinear small-scale instabilities in solids and structures

Nonlinear Dynamics of Transition Waves in Multi-Stable Discrete and Continuous Media

The concept of phase transitions, i.e., switching between two or more different equilibrium states of a system, is commonly encountered in many physical, chemical and biological phenomena. The exact mechanism of this switching is a highly nonlinear dynamical process that is accommodated by the propagation of a localized wave. The characteristics of the nonlinear wave such as its profile, velocity, energy, and width of transition are governed by the type and specifics of the system that it is propagating through which may be conservative, dissipative, or diffusive in nature. The goal of this thesis is to develop a fundamental understanding of the dynamics of such processes in general nonlinear systems capable of undergoing phase transitions and the application of new theories to elucidate the kinetic and energetic properties of transition waves in different scenarios. In conservative systems, we show that there are three different modes of stable wave propagation that we analytically solve for and validate computationally. In contrast, dissipative and diffusive systems allow the stable propagation of only the strongly nonlinear kink mode whose kinetic energy and propagation velocity are linked through a linear relation. We further validate our results in dissipative systems experimentally by fabricating and testing a strongly nonlinear lattice and show that transition waves are unidirectional in nature, as predicted by theory. Finally, as an application, we devise a strategy of using the physics of dissipative phase transitions to propagate stable mechanical signals in highly dissipative media such as soft polymers which effectively damp out small-amplitude linear waves

Universal energy transport law for dissipative and diffusive phase transitions

We present a scaling law for the energy and speed of transition waves in dissipative and diffusive media. By considering uniform discrete lattices and continuous solids, we show that—for arbitrary highly nonlinear many-body interactions and multistable on-site potentials—the kinetic energy per density transported by a planar transition wave front always exhibits linear scaling with wave speed and the ratio of energy difference to interface mobility between the two phases. We confirm that the resulting linear superposition applies to highly nonlinear examples from particle to continuum mechanics

A phase-field approach to studying the temperature-dependent ferroelectric response of bulk polycrystalline PZT

Ferroelectric ceramics are of interest for engineering applications because of their electro-mechanical coupling and the unique ability to permanently alter their atomic-level dipole structure (i.e., their polarization) and to induce large-strain actuation through applied electric fields. Although the underlying multiscale coupling mechanisms have been investigated by modeling strategies reaching from the atomic level across the polycrystalline mesoscale to the macroscopic device level, most prior work has neglected the important influence of temperature on the ferroelectric behavior. Here, we present a phase-field (diffuse-interface) constitutive model for ferroelectric ceramics, which is extended to account for the effects of finite temperature by considering thermal lattice vibrations based on statistical mechanics and by modifying the underlying Landau-Devonshire potential to depend on temperature. Results indicate that the chosen interpolation of the Landau energy coefficients is a suitable approach for predicting the temperature-dependent spontaneous polarization accurately over a broad temperature range. Lowering the energy barrier at finite temperature by the aforementioned methods also leads to better agreement with measurements of the bipolar hysteresis. Based on a numerical implementation via FFT spectral homogenization, we present simulation results of single- and polycrystals, which highlight the effect of temperature on the ferroelectric switching kinetics. We observe that thermal fluctuations (at the phase-field level realized by a thermalized stochastic noise term in the Allen-Cahn evolution equation) promote the nucleation of needle-like domains in regions of high heterogeneity or stress concentration such as grain boundaries. This, in turn, leads to a faster polarization reversal at low electric fields and a simulated domain pattern evolution comparable to experimental observations, stemming from the competition between nucleation and growth of domains. We discuss the development, implementation, validation, and application of the temperature-dependent phase-field framework for ferroelectric ceramics with a focus on tetragonal lead zirconate titanate (PZT), which we demonstrate to admit reasonable model predictions and comparison with experiments

A phase-field approach to studying the temperature-dependent ferroelectric response of bulk polycrystalline PZT

Ferroelectric ceramics are of interest for engineering applications because of their electro-mechanical coupling and the unique ability to permanently alter their atomic-level dipole structure (i.e., their polarization) and to induce large-strain actuation through applied electric fields. Although the underlying multiscale coupling mechanisms have been investigated by modeling strategies reaching from the atomic level across the polycrystalline mesoscale to the macroscopic device level, most prior work has neglected the important influence of temperature on the ferroelectric behavior. Here, we present a phase-field (diffuse-interface) constitutive model for ferroelectric ceramics, which is extended to account for the effects of finite temperature by considering thermal lattice vibrations based on statistical mechanics and by modifying the underlying Landau-Devonshire potential to depend on temperature. Results indicate that the chosen interpolation of the Landau energy coefficients is a suitable approach for predicting the temperature-dependent spontaneous polarization accurately over a broad temperature range. Lowering the energy barrier at finite temperature by the aforementioned methods also leads to better agreement with measurements of the bipolar hysteresis. Based on a numerical implementation via FFT spectral homogenization, we present simulation results of single- and polycrystals, which highlight the effect of temperature on the ferroelectric switching kinetics. We observe that thermal fluctuations (at the phase-field level realized by a thermalized stochastic noise term in the Allen-Cahn evolution equation) promote the nucleation of needle-like domains in regions of high heterogeneity or stress concentration such as grain boundaries. This, in turn, leads to a faster polarization reversal at low electric fields and a simulated domain pattern evolution comparable to experimental observations, stemming from the competition between nucleation and growth of domains. We discuss the development, implementation, validation, and application of the temperature-dependent phase-field framework for ferroelectric ceramics with a focus on tetragonal lead zirconate titanate (PZT), which we demonstrate to admit reasonable model predictions and comparison with experiments

Interplay of phase boundary anisotropy and electro-autocatalytic surface reactions on the lithium intercalation dynamics in LiX_XFePO4_4 platelet-like nanoparticles

Experiments on single crystal Li$_X$FePO$_4$ (LFP) nanoparticles indicate rich nonequilibrium phase behavior, such as suppression of phase separation at high lithiation rates, striped patterns of coherent phase boundaries, nucleation by binarysolid surface wetting and intercalation waves. These observations have been successfully predicted (prior to the experiments) by 1D depth-averaged phase-field models, which neglect any subsurface phase separation. In this paper, using an electro-chemo-mechanical phase-field model, we investigate the coherent non-equilibrium subsurface phase morphologies that develop in the $ab$- plane of platelet-like single-crystal platelet-like Li$_X$FePO$_4$ nanoparticles. Finite element simulations are performed for 2D plane-stress conditions in the $ab$- plane, and validated by 3D simulations, showing similar results. We show that the anisotropy of the interfacial tension tensor, coupled with electroautocatalytic surface intercalation reactions, plays a crucial role in determining the subsurface phase morphology. With isotropic interfacial tension, subsurface phase separation is observed, independent of the reaction kinetics, but for strong anisotropy, phase separation is controlled by surface reactions, as assumed in 1D models. Moreover, the driven intercalation reaction suppresses phase separation during lithiation, while enhancing it during delithiation, by electro-autocatalysis, in quantitative agreement with {\it in operando} imaging experiments in single-crystalline nanoparticles, given measured reaction rate constants

Unidirectional Transition Waves in Bistable Lattices

We present a model system for strongly nonlinear transition waves generated in a periodic lattice of bistable members connected by magnetic links. The asymmetry of the on-site energy wells created by the bistable members produces a mechanical diode that supports only unidirectional transition wave propagation with constant wave velocity. We theoretically justify the cause of the unidirectionality of the transition wave and confirm these predictions by experiments and simulations. We further identify how the wave velocity and profile are uniquely linked to the double-well energy landscape, which serves as a blueprint for transition wave control

Stable propogation of mechanical signals in soft media using stored elastic energy

Soft structures with rationally designed architectures capable of large, nonlinear deformation present opportunities for unprecedented, highly tunable devices and machines. However, the highly dissipative nature of soft materials intrinsically limits or prevents certain functions, such as the propagation of mechanical signals. Here we present an architected soft system composed of elastomeric bistable beam elements connected by elastomeric linear springs. The dissipative nature of the polymer readily damps linear waves, preventing propagation of any mechanical signal beyond a short distance, as expected. However, the unique architecture of the system enables propagation of stable, nonlinear solitary transition waves with constant, controllable velocity and pulse geometry over arbitrary distances. Because the high damping of the material removes all other linear, small-amplitude excitations, the desired pulse propagates with high fidelity and controllability. This phenomenon can be used to control signals, as demonstrated by the design of soft mechanical diodes and logic gates

Unidirectional Transition Waves in Bistable Lattices

We present a model system for strongly nonlinear transition waves generated in a periodic lattice of bistable members connected by magnetic links. The asymmetry of the on-site energy wells created by the bistable members produces a mechanical diode that supports only unidirectional transition wave propagation with constant wave velocity. We theoretically justify the cause of the unidirectionality of the transition wave and confirm these predictions by experiments and simulations. We further identify how the wave velocity and profile are uniquely linked to the double-well energy landscape, which serves as a blueprint for transition wave control

Stable propagation of mechanical signals in soft media using stored elastic energy

Soft structures with rationally designed architectures capable of large, nonlinear deformation present opportunities for unprecedented, highly tunable devices and machines. However, the highly dissipative nature of soft materials intrinsically limits or prevents certain functions, such as the propagation of mechanical signals. Here we present an architected soft system composed of elastomeric bistable beam elements connected by elastomeric linear springs. The dissipative nature of the polymer readily damps linear waves, preventing propagation of any mechanical signal beyond a short distance, as expected. However, the unique architecture of the system enables propagation of stable, nonlinear solitary transition waves with constant, controllable velocity and pulse geometry over arbitrary distances. Because the high damping of the material removes all other linear, small-amplitude excitations, the desired pulse propagates with high fidelity and controllability. This phenomenon can be used to control signals, as demonstrated by the design of soft mechanical diodes and logic gates