The Piezoelectric Effect - an Indispensable Solid State Effect for Contemporary Actuator and Sensor Technologies - IOPscience
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Journal of Physics: Conference Series PAPER • OPEN ACCESS The Piezoelectric Effect – an Indispensable Solid State Effect for Contemporary Actuator and Sensor Technologies To cite this article: Rüdiger G. Ballas 2021 J. Phys.: Conf. Ser. 1775 012012 View the article online for updates and enhancements. This content was downloaded from IP address 46.4.80.155 on 15/05/2021 at 01:30
ICOEO 2020 IOP Publishing Journal of Physics: Conference Series 1775 (2021) 012012 doi:10.1088/1742-6596/1775/1/012012 The Piezoelectric Effect – an Indispensable Solid State Effect for Contemporary Actuator and Sensor Technologies Rüdiger G. Ballas Professor for Electrical Engineering, Wilhelm Büchner Hochschule – Mobile University of Technology, Department of Engineering Sciences, D 64295 Darmstadt, Germany E-mail: ruediger.ballasl@wb-fernstudium.de Abstract. The piezoelectric effect, which was discovered for the first time by the brothers Pierre and Jacques Curie, combines electrical with mechanical quantities and vice versa. If piezoelectric materials (e.g. quartz, turmaline) are subjected to electrical signals along certain crystal orientations, deformations along well-defined crystal orientations appear. Contrary, a mechanical deformation results in a generation of polarization charges. Even if there exist numerous publications on this so-called direct and reciprocal piezoelectric effect, the aim of this paper is to convey a clear and easy understanding of this essential solid body effect in particular for the non-specialist, since a large number of publications is rather superficial and unfortunately sometimes incorrect. A variety of ionic crystals show the direct and reciprocal piezoelectric effect. In this paper, an illustrative representation of both effects is given by the molecular structure of alpha-quartz, a stable modification of the silicon dioxide, the second most common mineral of the earth’s crust. Both effects always involve an important physical quantity, the so-called electrical polarization, which represents an Euclidean vector being defined as the quotient of the total dipole moment resulting from the deformation of the hexagonal unit cell of alpha-quartz and the volume of the unit cell. Based on the physical explanation of the dipole moment, it is shown how the directions of the electrical polarization can be calculated in a simple manner. This finally enables the physical understanding of both effects that are nowadays used in numerous technical applications in the broad field of sensor and actuator technologies. 1. Introduction The common characteristic of all piezoelectric crystals is the existence of one or more polar axes. In crystallography, a polar axis is characterized by the fact that its front and rear ends are not equivalent, i. e. a rotation around an axis perpendicular to the polar axis by an angle of 180◦ does not match the original position of the respective crystal [1]. Figure 1 illustrates this fact on the macroscopic scale by means of the typical crystal form of quartz, also called low-quartz or alpha-quartz. In its low-temperature modification occurring below 573 °C (hence the term low- quartz ), the quartz crystal belongs to the trigonal crystal system, one of seven crystal systems in crystallography serving for the three-dimensional classification of crystals [2]. There are three polar axes, which are marked with X1 , X2 and X3 . Each axis connects two opposing edges of the hexagonal prism. However, the opposing edges are not equivalent, which becomes obvious by the fact, that for example the small surfaces marked with a and b are present at the rear edge which is assigned to the axis X2 , but these are missing at the opposite edge. The axis marked Content from this work may be used under the terms of the Creative Commons Attribution 3.0 licence. Any further distribution of this work must maintain attribution to the author(s) and the title of the work, journal citation and DOI. Published under licence by IOP Publishing Ltd 1
ICOEO 2020 IOP Publishing Journal of Physics: Conference Series 1775 (2021) 012012 doi:10.1088/1742-6596/1775/1/012012 Figure 1. Alpha-quartz crystal (low-quartz) and corresponding crystal axes. with Z represents the so-called crystallographic main axis (often referred to as the optical axis) and is non-polar. This is because after a 180◦ rotation around one of the X-axes, the quartz crystal matches its original position [3]. 2. Macroscopic Generation of Piezoelectricity Figure 2a shows a hexagonal prism, which can be assumed to be cut out from the quartz crystal parallel to the plane of the polar axes X1 , X2 and X3 shown in Fig. 2. Now, a mechanical pressure load is applied to the prism along its X1 -axis (see Fig. 2b). In case of an applied mechanical pressure load it can be observed, that electric charges of equal magnitude and opposite sign occur at the ends of the respective polar axes, in other words, piezoelectricity is generated. The mechanical pressure load does not necessarily have to act directly along the Figure 2. Generation of piezoelectricity: (a) unloaded hexagonal quartz prism; (b) occurrence of equal electric charges of opposite sign at the edges of the quartz prism generated by a mechanical pressure load. 2
ICOEO 2020 IOP Publishing Journal of Physics: Conference Series 1775 (2021) 012012 doi:10.1088/1742-6596/1775/1/012012 polar axis direction. An existing pressure load component acting along the direction of the polar axis is already sufficient. In order to be able to explain physically the piezoelectric phenomenon occurring on the prism, it is necessary to discuss the structure of alpha-quartz and the chemical bonding properties at the molecular level. 3. Molecular Structure of Alpha-Quartz Alpha-quartz represents the most important modification of silicon dioxide (SiO2), the second most common mineral of the earth’s crust. At the molecular level, alpha quartz consists of a network of continuously connected [SiO4]4– tetrahedra [4]. In silicates, including alpha-quartz, [SiO4]4– tetrahedra are the most important structuring coordination polyhedra. As illustrated in Fig. 3a, the silicon atom is surrounded by four oxygen atoms. With regard to the Si–O bond and thus to the bonding properties within the [SiO4]4– tetrahedron, neither a pure covalent bond (see Fig. 3b) nor a pure ionic bond is present (see Fig. 3c). The truth about the real bonding properties is somewhere in between. 2 O O 2 4+ 2 O Si O O Si O 2 O O Figure 3. Structuring coordination polyhedron of alpha-quartz and its bonding boundaries (valence electron pairs are indicated by dashes as usual): (a) [SiO4]4– tetrahedron; (b) pure covalent bond (atomic bond); (c) pure ionic bond. By means of the electronegativities of silicon (χSi = 1,8) and oxygen (χO = 3,5) – the electronegativity of a chemical element is a measure of its ability to gain electrons in a molecule – the difference of electronegativity results in ∆χ = 1,7. For such a value, a partial ionic character of 50 % can be assumed for the Si–O bond [5][6]. In the following, it is assumed that there is a pure ionic bond within the [SiO4]4– tetrahedron. This assumption allows for a very clear explanation of the piezoelectric effect. In a first approximation, the alpha-quartz-specific spatial cross-linking of [SiO4]4– tetrahedra results in a hexagonal unit cell, as shown in Fig. 4. The unit cell is composed of three formula units SiO2. The assumption of ionic bonding properties is associated with the fact that the silicon ion (cation) occupies a smaller volume of space than the oxygen ion (anion). By representing the different sizes of the silicon and oxygen ions in Fig. 4, this fact is taken into account. The crystallographic main axis Z is perpendicular to the plane defined by the polar axes X1 , X2 and X3 and points into the drawing plane. With respect to the drawing plane, the silicon ion 1 is located over the silicon ion 2 and this again over the silicon ion 3. The arrangement of the oxygen ions a, b and c respectively turned by 60◦ with respect to the polar axes is equivalent [7]. Thus, it appears that the position of the silicon ions and the oxygen ions continues helically in counterclockwise direction into the drawing plane. The direction of rotation of the spiral corresponds to the direction of optical rotation of the present crystal structure — thus, it is a left-handed alpha-quartz crystal. The unit cell of alpha-quartz according to Fig. 4 is electrically neutral towards the outside. Each of the three silicon ions carries 4 positive and each of the six oxygen ions carries 2 negative unit charges, therefore all charges are saturated each other [1]. For reasons of simplicity, in a next step the oxygen ions located below the anions a and b and the 3
ICOEO 2020 IOP Publishing Journal of Physics: Conference Series 1775 (2021) 012012 doi:10.1088/1742-6596/1775/1/012012 Figure 4. Unit cell of alpha-quartz with corresponding polar axes (the crystallographic main axis Z points perpendicularly into the drawing plane) [according to [7]]. oxygen ion located above the anion c are combined into a single oxygen ion – each consisting of two O2– ions – with 4 unit charges. This results in the simplified unit cell of alpha-quartz shown in Fig. 5. It shows a regular hexagonal basic structure, where the negatively charged O2– and the positively charged Si4+ ions are arranged at its corners. The polar axes X1 , X2 and X3 represent 2-fold axes of rotation, the crystallographic main axis Z, which points perpendicularly into the drawing plane, represents a 3-fold axis of rotation. In crystallography, an axis is called an n-fold axis of rotation, if a crystal lattice already results in a configuration which does not differ from the initial configuration of the crystal lattice after a rotation around 360◦ /n. If the structure cell as shown in Fig.5b is rotated for example around the polar axis X1 , a configuration is obtained which is identical to the initial configuration when rotated by 180◦ . Thus, the rotation by 180◦ is a symmetry operation and the 2-fold axis of rotation (360◦ /2 = 180◦ ) represents the symmetry element. If this symmetry operation is executed twice in succession, all the ions of the unit cell are in the original position [8]. In the same way, the 3-fold characteristics of the crystallographic main axis Z can be explained. Figure 5. Simplified unit cell of alpha-quartz with corresponding polar axes: (a) Arrangement of the Si4+ and O2– ions in a regular hexagon; (b) 2 and 3-fold axes of rotation as symmetry elements. 4
ICOEO 2020 IOP Publishing Journal of Physics: Conference Series 1775 (2021) 012012 doi:10.1088/1742-6596/1775/1/012012 4. The direct piezoelectric effect If the simplified unit cell is subjected to a mechanical pressure load along the direction of the polar axis X1 (see Fig. 6a), the upper silicon ion shifts between the two upper oxygen ions and the lower oxygen ion shifts between the two lower silicon ions. The displacement of the positively and negatively charged ions of the structure cell against each another causes an electric polarization P along the polar axis X1 and thus along the direction of the mechanical pressure load. As a consequence, positive charges are induced on the upper electrode A and positive charges are induced on the lower electrode A′ resulting in an external electric polarization voltage. This effect is referred to as a direct longitudinal piezoelectric effect, which explains the piezoelectric phenomenon along the polar axis X1 of the quartz prism in Fig. 2b at the macroscopic level. Figure 6. Direct piezoelectric effect within the simplified unit cell of alpha-quartz. (a) longitudinal piezoelectric effect; (b) transversal piezoelectric effect. If, on the other hand, the unit cell is subjected to a mechanical pressure load acting perpendicularly to the polar axis X1 , the silicon and oxygen ions on the left and right sides of the structure cell shift uniformly inwards and their charges cancel each other. Thus, no charges are influenced on both external electrodes B and B′ (see Fig. 6b). However, the upper silicon and lower oxygen ion of the unit cell are shifted outwards, thus an electric polarization P is generated along the direction of the polar axis X1 , but rotated by 180◦ and is now perpendicular to the mechanical pressure load. On the upper electrode A positive charges and on the lower electrode A′ negative charges are induced resulting in an external electric polarization voltage with reversed sign. This effect is called direct transversal piezoelectric effect. 5. The reciprocal piezoelectric effect Both effects are reversible, under the influence of suitably oriented electric fields a contraction or dilatation of the unit cell of alpha-quartz can be observed. This behavior is commonly termed reciprocal piezoelectric effect. If an external electric DC voltage is applied between the upper electrode A and the lower electrode A′ such that the upper electrode A is negatively and the lower electrode A′ is positively charged, an electric field with the field strength E develops between the electrodes. Just like the electric polarization P, the electric field strength E represents a vector quantity. In contrast to the electric polarization vector P, the field strength vector E points from the positive to the negative charge (see Fig. 7a). As a result, the two upper oxygen ions are somewhat attracted towards the lower electrode A′ and the two lower silicon ions are attracted towards the upper electrode A. Thus, the unit cell is compressed along the direction of the polar axis X1 . The displacement of the positively and negatively charged ions causes an 5
ICOEO 2020 IOP Publishing Journal of Physics: Conference Series 1775 (2021) 012012 doi:10.1088/1742-6596/1775/1/012012 Figure 7. Reciprocal piezoelectric effect within the simplified unit cell of alpha-quartz. (a) longitudinal piezoelectric effect; (b) transversal piezoelectric effect. electric polarization P along the polar axis X1 and thus in parallel to the compression direction of the unit cell. This effect is called reciprocal longitudinal piezoelectric effect. If the voltage source is connected to the electrodes such that the upper electrode A is positively and the lower electrode A′ is negatively charged, the direction of the electric field strength E turns 180◦ . As a result, the two upper oxygen ions are attracted towards the upper electrode A and the two lower silicon ions are attracted towards the lower electrode A′ . At the same time, the silicon and oxygen ions on the left and right side of the unit cell shift uniformly inwards (see Fig. 7b). The displacement of the positively and negatively charged ions, causes an electric polarization P along the polar axis X1 again, but rotated by 180◦ and being perpendicular to the compression direction of the unit cell. This effect is called reciprocal transversal piezoelectric effect. 6. Electric Dipole and Electric Polarization The introduced quantity electric polarization P is defined as the quotient of the total dipole moment p resulting from the deformation of the hexagonal unit cell and the volume V of the unit cell. In the following, the physical explanation of the dipole moment p shows the way for the calculation of the directions of the electric polarization P shown in Fig. 6 and in Fig. 7 in a simple manner. An electric dipole consists of two equal charges ±Q of opposite sign separated by a distance d (see Fig. 8a). Since the opposing charges compensate each other, a dipole is always electrically neutral. The electric dipole is characterized by its dipole moment p: p = Qd (1) Thus, the dipole moment represents a vector with the magnitude |p| = Qd and is directed from the negative charge to the positive one. If there is a system of n electrically active dipoles within a given spatial volume V , the total dipole moment pΣ results from the vector sum of all individual dipoles pi : X n pΣ = pi (2) i=1 6
ICOEO 2020 IOP Publishing Journal of Physics: Conference Series 1775 (2021) 012012 doi:10.1088/1742-6596/1775/1/012012 Figure 8. (a) Electric dipole with dipole moment p; (b) electric polarization P defind as the quotient of total dipole moment p and the volume V of the unit cell. The ratio between total dipole moment pΣ and spatial volume V defines the electric polarization P (see Fig. 8b): n pΣ 1 X P= = pi (3) V V i=1 The defining equation (3) serves as the basis for calculating the direction of the electric polarization P arising within the simplified unit cell of alpha-quartz in combination with the direct or reciprocal piezoelectric effect. First, the non-deformed configuration of the simplified unit cell of alpha-quartz is taken into account (see Fig. 9a). For reasons of simplicity, the negative total charge of the two O2– ions combined into a single oxygen ion and the positive total charge of the respective Si4+ ions are represented by the quantities −Q and +Q, respectively. An illustrative representation of this fact is shown in Fig. 9b. The respective charges ±Q of equal quantity and opposite sign, which are arranged on the polar axes X1 , X2 and X3 , constitute an electric dipole and can be characterized by an electric dipole moment p1 , p2 or p3 , respectively, since they are spatially separated from each other in accordance with Fig. 9a. As shown in Fig. 9b, the respective dipole moment vector coincides with the direction of the corresponding polar axis and is directed, by definition, from the negative charge to the positive one. For the purpose of calculating the direction of electric polarization P in general, it is necessary to go into detail about the geometric conditions within the hexagonal basic structure of the Figure 9. Simplified unit cell of alpha-quartz in non-deformed configuration: (a) regular hexagonal arrangement of the Si4+ and O2– ions; (b) representation of the total charge of the respective Si4+ and combined O2– ions by the quantities +Q and −Q, respectively, and resulting dipole moments p1 , p2 and p3 . 7
ICOEO 2020 IOP Publishing Journal of Physics: Conference Series 1775 (2021) 012012 doi:10.1088/1742-6596/1775/1/012012 simplified unit cell in a non-deformed configuration. First, the regular hexagon according to Fig. 9 is represented enlarged showing the geometric quantities being necessary for the later calculation (see Fig. 10). Furthermore, the polar axes X1 , X2 and X3 are replaced by a Cartesian coordinate system. Figure 10. Geometric quantities within the hexagonal structure of the simplified unit cell of alpha-quartz with corresponding distance vectors between the opposing charges ±Q (non- deformed configuration). The quantities ex und ey represent the unit vectors associated with the coordinate axes x and y. Instead of applying the dipole moment vectors p1 , p2 and p3 as shown in Fig. 9b, in Fig. 10 the respective distance vectors d1 , d2 and d3 between the opposing charges ±Q are used taking the physical relationship according to (1) into account. The quantity a illustrated in Fig. 10 denotes the edge length of the regular hexagon. A comparison with Fig. 9a obviously shows that the edge length a can be represented as the sum of the radius of a Si4+ and an O2– ion. Since the Si4+ and O2– ions are arranged concentrically around the unit cell’s corners even in its deformed configuration —- e.g. caused by a mechanical pressure load along the x or y axis – the edge length a can be understood as a constant quantity. The angle α and thus, the geometric auxiliary quantities h and b depend on the deformation state of the unit cell, i.e. they are variable quantities. On the basis of Fig. 10, following correlation for the geometric auxiliary quantities h and b can be formulated using the edge length a: h = a sin α, b = a cos α (4) Using the correlations (1) and (2), the general conditional equation for the total dipole moment pΣ within the simplified unit cell of alpha-quartz can be formulated. It can be written: 3 X 3 X 3 X pΣ = pi = Q di = Q (dix ex + diy ey ) (5) i=1 i=1 i=1 Subsequent evaluation of the sum results in following expression: pΣ = Q [(d1x + d2x + d3x ) ex + (d1y + d2y + d3y ) ey ] (6) The vector components dix and diy of the respective distance vectors di presented in (6) can be expressed by the geometric quantities according to Fig. 10. The vector components in x-direction result in: d1x = 0, d2x = 2b, d3x = −2b (7) 8
ICOEO 2020 IOP Publishing Journal of Physics: Conference Series 1775 (2021) 012012 doi:10.1088/1742-6596/1775/1/012012 The vector components in y-direction result in: d1y = a + 2h, d2y = −a, d3y = −a (8) By inserting the equations from (4) into the obtained expressions (7) and (8), the vector components in x- and y-directions can be reformulated as follows: d1x = 0, d2x = 2a cos α, d3x = −2a cos α (9) d1y = a + 2a sin α, d2y = −a, d3y = −a (10) If the relations (9) and (10) are inserted into the (6), the calculation rule for the total dipole moment pΣ and thus referring to the definition (3) also for the electric polarization P within the simplified unit cell of alpha-quartz is obtained: pΣ = Qa (2 sin α − 1) ey (11) and Qa P= (2 sin α − 1) ey (12) V The total dipole moment pΣ or the electric polarization P are only defined by a y component (see Fig. 6 - assuming the X1 -axis is replaced by the y-axis). Whether the y-component of the electric polarization vector P shows the value zero or a negative or positive value results from the fact, whether the structure cell is subjected to a mechanical pressure load, and if so, along which coordinate axis the pressure load acts. In the following, these statements are verified mathematically. 6.1. non-deformed configuration of the unit cell If the unit cell shows a non-deformed configuration as illustrated in Fig. 10, the angle within the hexagonal structure of the unit cell equals α0 = π/6. The resulting vector of the electric polarization P yields according to the conditional equation (12) Qa π P= 2 sin −1 ey = 0, (13) V | {z 6 } =1 i.e. without any external mechanical pressure load, no electric polarization within the unit cell of alpha-quartz can be observed. 6.2. mechanical pressure load acting along the y-axis If the unit cell is subjected by a mechanical pressure load acting along the y-axis (i.e. along the direction of the polar axis X1 ) (see Fig. 6a), the upper silicon ion shifts between the two upper oxygen ions and the lower oxygen ion shifts between the two lower silicon ions, i.e the angle within the hexagonal structure of the unit cell according to Fig. 10 yields α < π/6. Thus, the resulting vector of the electric polarization P results in Qa P= 2 sin (α) −1 ey = −Py ey , (14) V |{z} | {z } >0
ICOEO 2020 IOP Publishing Journal of Physics: Conference Series 1775 (2021) 012012 doi:10.1088/1742-6596/1775/1/012012 6.3. mechanical pressure load acting along the x-axis If the unit cell is subjected by a mechanical pressure load acting along the x-axis (i.e perpendicularly to the polar axis X1 ), the silicon and oxygen ions on the left and right side of the unit cell shift uniformly inwards, while the upper silicon and lower oxygen ions of the unit cell shift outwards (see Fig. 6b). Thus, the angle within the hexagonal structure of the unit cell according to Figure 10 yields α > π/6. In this case, the resulting vector of the electric polarization P yields Qa P= 2 sin (α) −1 ey = +Py ey , (15) V |{z} | {z } >0 >1 | {z } >0 i.e. due to the external mechanical pressure load acting along the x-axis, an electric polarization P is generated within the unit cell of alpha-quartz. The y-component of the polarization vector is now positive and thus compared to the direction of the polar axis X1 , it points in the same direction. 7. Conclusion In this paper, the direct and reciprocal piezoelectric effect were represented illustratively by means of the hexagonal unit cell of alpha quartz, a stable modification of the silicon dioxide and the second most common mineral of the earth’s crust. Common to both effects is the occurring vector of the electric polarization, which is defined as the quotient of the total dipole moment resulting from the deformation of the hexagonal unit cell of alpha-quartz and the volume of the unit cell. On the basis of the physical explanation of the dipole moment, it was shown how the directions of the electric polarization occurring within the unit cell of alpha-quartz can be calculated in a simple manner. This finally reveals the physical understanding of the direct and reciprocal piezoelectric effect. Nowadays, both effects are used in numerous technical applications in the broad field of sensor and actuator technologies. About the Author Prof. Dr.-Ing. Rüdiger G. Ballas holds the professorship for electrical engineering at Wilhelm Büchner Hochschule - Mobile University of Technology, Darmstadt, Germany. In addition to his activity as vice dean of the department of engineering sciences, his research activities focus in particular on piezoelectric materials, sensors and actuators as well as on piezoelectric energy harvesting and (micro)electromechanical systems (MEMS). Before his university career he held leading positions in research and development at different companies concerned with piezoelectric sensors and actuators. He earned his doctorate degree at Technical University Darmstadt, Germany for his research work in the field of piezoelectric multilayered bending actuators. During his pre-doctoral studies he already received several awards for outstanding work in the field of microstructuring of quartz crystals for high-frequency applications in modern telecommunications technologies. Furthermore, in 2017 he received the IAAM Medal due to notable and outstanding contribution in the field of ”New Age Technology & Innovations”, Stockholm, Sweden. In 2020 he was nominated as ”Fellow of the International Association of Advanced Materials (FIAAM), Sweden” as well as ”VSET Fellow (Vebleo - International Scientific Organization for Materials Science, Engineering and Technology), Sweden”. He is author of various publications and author/co-author of several textbooks published by the renowned publisher Springer Nature. References [1] W. Raith, L. Bergmann, C. Schaefer, Lehrbuch der Experimentalphysik, Bd. 2: Elektromagnetismus, 9th ed., Berlin, Walter de Gruyter, 2006. 10
ICOEO 2020 IOP Publishing Journal of Physics: Conference Series 1775 (2021) 012012 doi:10.1088/1742-6596/1775/1/012012 [2] M. Okrusch, S. Matthes, Mineralogie: Eine Einführung in die spezielle Mineralogie, Petrologie und Lagerstättenkunde, 7th ed., Berlin, Springer, 2005 [3] W. G. Cady, Piezoelectricity: An Introduction to the Theory and Applications of Electromechanical Phenomena in Crystals, London, McGraw-Hill, 1946 [4] L. P. Davila, S. H. Risbud, J. F. Shackelford, Quartz and Silicas. In: Ceramic and Glass Materials, New York, Springer, 2008 [5] H. Salmang, H. Scholze, R. Telle, Keramik, Dordrecht, Springer, 2007 [6] C. E. Mortimer, U. Müller, Chemie: Das Basiswissen der Chemie, 10th ed., Stuttgart, Thieme, 2010 [7] H. Gobrecht, Elektrizität und Magnetismus, Lehrbuch der Experimentalphysik, vol. 2, 6th ed., Berlin, de Gruyter, 1971 Vieweg+Teubner, 1975 [8] W. Borchardt-Ott, Kristallographie: Eine Einführung für Naturwissenschaftler, 7th ed., Berlin, Springer, 2009 11
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