Model piezoelectric

Order parameters may also refer to underlying atomic structure or symmetry. For example, a piezoelectric material cannot have a symmetry that includes an inversion center. To model piezoelectric phase transitions, an order parameter, r], could be associated with the displacement of an atom in a fixed direction away from a crystalline inversion center. Below the transition temperature Tc, the molar Gibbs free energy of a crystal can be modeled as a Landau expansion in even powers of r (because negative and positive displacements, 77, must have the same contribution to molar energy) with coefficients that are functions of fixed temperature and pressure,... 

Subdividing the body to be computed into finite elements results in a mesh composed of numerous single elements. A set of linear differential equation represents the complete finite element mesh of the modeled piezoelectric substrate. 

Modeling. The methodology for modeling piezoelectric behavior in polymers varies, depending on the targeted properties. Approaches cover the range from macroscale to micro and atomistic scales. A detailed review of compntational methods applied to electroactive polymers has been published (73). 

W. Beckert, W.S. Kreher, Modelling piezoelectric modules with interdigitated electrode structures. Comput. Mater. Sci. 26, 36-45 (2003)... 

The Champ-Sons model is a most effieient tool allowing quantitative predictions of the field radiated by arbitrary transducers and possibly complex interfaces. It allows one to easily define the complete set of transducer characteristics (shape of the piezoelectric element, planar or focused lens, contact or immersion, single or multi-element), the excitation pulse (possibly an experimentally measured signal), to define the characteristics of the testing configuration (geometry of the piece, transducer position relatively to the piece, characteristics of both the coupling medium and the piece), and finally to define the calculation to run (field-points position, acoustical quantity considered). 

Depth-sensing nanoindentation is one of the primary tools for nanomechanical mechanical properties measurements. Major advantages to this technique over AFM include (1) simultaneous measurement of force and displacement (2) perpendicular tip-sample approach and (3) well-modeled mechanics for dynamic measurements. Also, the ability to quantitatively infer contact area during force-displacement measurements provides a very useful approach to explore adhesion mechanics and models. Disadvantages relative to AFM include lower force resolution, as well as far lower spatial resolution, both from the larger tip radii employed and a lack of sample positioning and imaging capabilities provided by piezoelectric scanners. 

The determination of piezoelectric constants from current pulses is based on interpretation of wave shapes in the weak-coupling approximation. It is of interest to use the wave shapes to evaluate the degree of approximation involved in the various models of piezoelectric response. Such an evaluation is shown in Fig. 4.5, in which normalized current-time wave forms calculated from various models are shown for x-cut quartz and z-cut lithium niobate. In both cases the differences between the fully coupled and weakly coupled solutions are observed to be about 1%, which is within the accuracy limits of the calculations. Hence, for both quartz and lithium niobate, weakly coupled solutions appear adequate for interpretation of observed current-time waveforms. On the other hand, the adequacy of the uncoupled solution is significantly different for the two materials. For x-cut quartz the maximum error of about 1%-1.5% for the nonlinear-uncoupled solution is suitable for all but the most precise interpretation. For z-cut lithium niobate the maximum error of about 8% for the nonlinear-uncoupled solution is greater than that considered acceptable for most cases. The linear-uncoupled solution is seriously in error in each case as it neglects both strain and coupling. 

Changes in polarization may be caused by either the input stress profile or a relaxation of stress in the piezoelectric material. The mechanical relaxation is obviously inelastic but the present model should serve as an approximation to the inelastic behavior. Internal conduction is not treated in the theory nevertheless, if electrical relaxations in current due to conduction are not large, an approximate solution is obtained. The analysis is particularly useful for determining the signs and magnitudes of the electric fields so that threshold conditions for conduction can be established. 

Fig. 5.1. The electrostatic configurations of the Neilson-Benedick three-zone model describe a piezoelectric solid subject to elastic-inelastic shock deformation which divides the crystal into three distinct zones. Zone 1, ahead of the elastic wave, is unstressed. Zone 2 is elastically stressed at the Hugoniot elastic limit. Zone 3 is isotropically pressurized to the input pressure value (after Graham [74G01]).

The basic idea of AFM is to use a sharp tip scanning over the surface of a sample while sensing the interaction between the tip and the sample (Dufrene, 2008b). The tip with a flexible cantilever (in some AFM models the sample) is mounted on a piezoelectric scanner which can move... 

See Lead zirconate titanate ceramics Quality number 219 Quantum transmission 59 Reciprocal space 123, 353 Reciprocity principle 88 Reconstruction 14, 327 Au(lll) 327 DAS model 16 Si(lll)-2X1 14 Recursion relations 352 Repulsive atomic force 185, 192 Resonance frequency 234, 241 piezoelectric scanners 234 vibration isolation system 241 Resonance interactions 171, 177 and tunneling 177 Resonance theory of the chemical bond 172... 

From Eq, (1) it is clear that a model of crystal polarization that is adequate for the description of the piezoelectric and pyroelectric properties of the P-phase of PVDF must include an accurate description of both the dipole moment of the repeat unit and the unit cell volume as functions of temperature and applied mechanical stress or strain. The dipole moment of the repeat unit includes contributions from the intrinsic polarity of chemical bonds (primarily carbon-fluorine) owing to differences in electron affinity, induced dipole moments owing to atomic and electronic polarizability, and attenuation owing to the thermal oscillations of the dipole. Previous modeling efforts have emphasized the importance of one more of these effects electronic polarizability based on continuum dielectric theory" or Lorentz field sums of dipole lattices" static, atomic level modeling of the intrinsic bond polarity" atomic level modeling of bond polarity and electronic and atomic polarizability in the absence of thermal motion. " The unit cell volume is responsive to the effects of temperature and stress and therefore requires a model based on an expression of the free energy of the crystal. 

The high-frequency dielectric constant is determined by the effects of electronic polarization. An accurate estimate of this property lends confidence to the modeling of the electronic polarization contribution in the piezoelectric and pyroelectric responses. The constant strain dielectric constants (k, dimensionless) are computed from the normal modes of the crystal (see Table 11.1). Comparison of the zero- and high-frequency dielectric constants indicates that electronic polarization accounts for 94% of the total dielectric response. Our calculated value for k (experimental value of 1.85 estimated from the index of refraction of the P-phase of PVDF. ... 

A Model Theory of Piezoelectric Relaxation for a Two-Phase System... 

Fukada,E., Date,M. Mechanical and electrical models for piezoelectric dispersions in oriented polymers. Polymer J. 1,410 (1970). 

When the experimentalist set an ambitious objective to evaluate micromechanical properties quantitatively, he will predictably encounter a few fundamental problems. At first, the continuum description which is usually used in contact mechanics might be not applicable for contact areas as small as 1 -10 nm [116,117]. Secondly, since most of the polymers demonstrate a combination of elastic and viscous behaviour, an appropriate model is required to derive the contact area and the stress field upon indentation a viscoelastic and adhesive sample [116,120]. In this case, the duration of the contact and the scanning rate are not unimportant parameters. Moreover, bending of the cantilever results in a complicated motion of the tip including compression, shear and friction effects [131,132]. Third, plastic or inelastic deformation has to be taken into account in data interpretation. Concerning experimental conditions, the most important is to perform a set of calibrations procedures which includes the (x,y,z) calibration of the piezoelectric transducers, the determination of the spring constants of the cantilever, and the evaluation of the tip shape. The experimentalist has to eliminate surface contamination s and be certain about the chemical composition of the tip and the sample. 

Telega J.J. (1991) Piezoelectricity and Homogenization. Application to Biomechanics. Continuum Models and Discrete Systems, 220-229, Longman, Essex. 

Piezoelectric coefficients are also temperature dependent quantities. This is true for both the intrinsic and the extrinsic contributions. Typically, the piezoelectric response of a ferroelectric material increases as the transition temperature is approached from below (See Figure 2.3) [3], Where appropriate thermodynamic data are available, the increase in intrinsic dijk coefficients can be calculated on the basis of phenomenology, and reflects the higher polarizability of the lattice near the transition temperature. The extrinsic contributions are also temperature dependent because domain wall motion is a thermally activated process. Thus, extrinsic contributions are lost as the temperature approaches OK [4], As a note, while the temperature dependence of the intrinsic piezoelectric response can be calculated on the basis of phenomenology, there is currently no complete model describing the temperature dependence of the extrinsic contribution to the piezoelectric coefficients. 

This is valid under relatively small signal excitation conditions, and describes the motion of domain walls in local random fields, a describes the irreversibility of the domain wall motion. Under the conditions where the Rayleigh model holds, the hysteresis in the piezoelectric... 

The origin of the nonlinearity and hysteresis in the films is most likely due to displacement of domain walls [4], If domain walls move in a medium with a random distribution of pinning center, the response of the material can be described, in the first approximation by Rayleigh relations. We next demostrate how optical interferometry can be sued to verify whether this particular model applies to the investigated pzt thin film. In the case of the converse piezoelectric effect, when the driving field E is varied between — Eo and Eo, the piezoelectric strain x is hysteretic and can be expressed by the following Rayleigh relations ... 

The first piezoceramic to be developed commercially was BaTi03, the model ferroelectric discussed earlier (see Section 2.7.3). By the 1950s the solid solution system Pb(Ti,Zr)03 (PZT), which also has the perovskite structure, was found to be ferroelectric and PZT compositions are now the most widely exploited of all piezoelectric ceramics. The following outline description of their properties and fabrication introduces important ideas for the following discussion of the tailoring of piezoceramics, including PZT, for specific applications. It is assumed that the reader has studied Sections 2.3 and 2.7.3. 

Mason [46] first observed that the viscoelastic properties of a fluid in contact with quartz crystals can affect the resonant properties. However, Mason s work had been forgotten and for a long time there have not been studies of piezoelectric acoustic wave devices in contact with liquids until Nomura and Okuhara [15] found an empirical expression that described the changes in the quartz resonant frequency as a function of the liquid density, its viscosity and the conductivity in which the crystal was immersed. Shortly after the empirical observations of Nomura were described in terms of physical models by Kanazawa [1] and Bruckenstein [2] who derived the equation that describes the changes in resonant frequency of a loss-less quartz crystal in contact with an infinite, non conductive and perfectly Newtonian fluid ... 

Since the unloaded QCM is an electromechanical transducer, it can be described by the Butterworth-Van Dyke (BVD) equivalent electrical circuit represented in Fig. 12.3 (box) which is formed by a series RLC circuit in parallel with a static capacitance C0. The electrical equivalence to the mechanical model (mass, elastic response and friction losses of the quartz crystal) are represented by the inductance L, the capacitance C and the resistance, R connected in series. The static capacitance in parallel with the series motional RLC arm represents the electrical capacitance of the parallel plate capacitor formed by both metal electrodes that sandwich the thin quartz crystal plus the stray capacitance due to the connectors. However, it is not related with the piezoelectric effect but it influences the QCM resonant frequency. 

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