Domain pinning near a single-grain boundary in tetragonal and rhombohedral lead zirconate titanate films

Marincel, Dan M.; Zhang, H. R.; Briston, J.; Belianinov, Alex; Jesse, Stephen; Kalinin, Sergei V.; Chen, L. Q.; Rainforth, William M.; Reaney, Ian M.; Randall, Clive A.; Trolier-McKinstry, Susan

doi:10.1103/PhysRevB.91.134113

Title: Domain pinning near a single-grain boundary in tetragonal and rhombohedral lead zirconate titanate films

Journal Article · Mon Apr 27 00:00:00 EDT 2015 · Physical Review. B, Condensed Matter and Materials Physics

DOI:https://doi.org/10.1103/PhysRevB.91.134113· OSTI ID:1286789

Marincel, Dan M. ^[1]; Zhang, H. R. ^[2]; Briston, J. ^[1]; Belianinov, Alex ^[3]; Jesse, Stephen ^[3]; Kalinin, Sergei V. ^[3]; Chen, L. Q. ^[1]; Rainforth, William M. ^[2]; Reaney, Ian M. ^[2]; Randall, Clive A. ^[1]; Trolier-McKinstry, Susan ^[1]

Pennsylvania State Univ., University Park, PA (United States). Dept of Materials Science and Engineering and Materials Research Inst.
Univ. of Sheffield (United Kingdom). Dept. of Materials Science and Engineering
Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States). Center for Nanophase Materials Science (CNMS)

The interaction of grain boundaries with ferroelectric domain walls strongly influences the extrinsic contribution to piezoelectric activity in Pb(Zr,Ti)O₃ (PZT), ubiquitous in modern transducers and actuators. However, the fundamental understanding of these phenomena has been limited by complex mechanisms originating from the interplay of atomic-level domain wall pinning, collective domain wall dynamics, and emergent mesoscopic behavior. This contribution utilizes engineered grain boundaries created by depositing epitaxial PZT films with various Zr:Ti ratio onto 24º SrTiO₃ tilt bicrystals. The nonlinear piezoelectric response and surface domain structure across the boundary are investigated using piezoresponse force microscopy whilst cross section domain structure is studied using transmission electron microscopy. The grain boundary reduces domain wall motion over a width of 800±70 nm for PZT 45:55 and 450±30 nm for PZT 52:48. Phase field modeling provides an understanding of the elastic and electric fields associated with the grain boundary and local domain configurations. In conclusion, this study demonstrates that complex mesoscopic behaviors can be explored to complement atomic-level pictures of the material system.

View Accepted Manuscript (DOE)

View Accepted Manuscript (Publisher)

Cite

Export

Save

Research Organization:: Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States). Center for Nanophase Materials Sciences (CNMS)

Sponsoring Organization:: USDOE Office of Science (SC), Basic Energy Sciences (BES); National Science Foundation (NSF)

Grant/Contract Number:: AC05-00OR22725; FG02-07ER46417; OCI-0821527; CNMS2011-022; EP/I038934/1; DMR-1005771

OSTI ID:: 1286789

Alternate ID(s):: OSTI ID: 1178776

Journal Information:: Physical Review. B, Condensed Matter and Materials Physics, Vol. 9, Issue 13; ISSN 1098-0121

Publisher:: American Physical Society (APS)Copyright Statement

Country of Publication:: United States

Language:: English

Citation Metrics:

Cited by: 28 works

Citation information provided by
Web of Science

References (56)

Microstructure and domain effects in ferroelectric ceramics Arlt, G. Ferroelectrics, Vol. 91, Issue 1 https://doi.org/10.1080/00150198908015725	journal	March 1989
Grain size and domain size relations in bulk ceramic ferroelectric materials Cao, Wenwu; Randall, Clive A. Journal of Physics and Chemistry of Solids, Vol. 57, Issue 10 https://doi.org/10.1016/0022-3697(96)00019-4	journal	October 1996
Cylinder stress in nanostructures: effect on domains in nanowires, nanotubes, and nano-disks Scott, J. F. Journal of Physics: Condensed Matter, Vol. 26, Issue 21 https://doi.org/10.1088/0953-8984/26/21/212202	journal	May 2014
Ferroelectric thin films: Review of materials, properties, and applications Setter, N.; Damjanovic, D.; Eng, L. Journal of Applied Physics, Vol. 100, Issue 5 https://doi.org/10.1063/1.2336999	journal	September 2006
Dielectric properties of fine‐grained barium titanate ceramics Arlt, G.; Hennings, D.; de With, G. Journal of Applied Physics, Vol. 58, Issue 4 https://doi.org/10.1063/1.336051	journal	August 1985
Dependence of the direct piezoelectric effect in coarse and fine grain barium titanate ceramics on dynamic and static pressure Demartin, Marlyse; Damjanovic, Dragan Applied Physics Letters, Vol. 68, Issue 21 https://doi.org/10.1063/1.115572	journal	May 1996
Intrinsic and Extrinsic Size Effects in Fine-Grained Morphotropic-Phase-Boundary Lead Zirconate Titanate Ceramics Randall, Clive A.; Kim, Namchul; Kucera, John-Paul Journal of the American Ceramic Society, Vol. 81, Issue 3 https://doi.org/10.1111/j.1151-2916.1998.tb02389.x	journal	March 1998
Contribution of the irreversible displacement of domain walls to the piezoelectric effect in barium titanate and lead zirconate titanate ceramics Damjanovic, Dragan; Demartin, Marlyse Journal of Physics: Condensed Matter, Vol. 9, Issue 23 https://doi.org/10.1088/0953-8984/9/23/018	journal	June 1997
A high energy synchrotron x-ray study of crystallographic texture and lattice strain in soft lead zirconate titanate ceramics Hall, D. A.; Steuwer, A.; Cherdhirunkorn, B. Journal of Applied Physics, Vol. 96, Issue 8 https://doi.org/10.1063/1.1787590	journal	October 2004
Extrinsic scaling effects on the dielectric response of ferroelectric thin films Ihlefeld, Jon F.; Vodnick, Aaron M.; Baker, Shefford P. Journal of Applied Physics, Vol. 103, Issue 7 https://doi.org/10.1063/1.2903211	journal	April 2008
Grain size dependence of properties in lead nickel niobate-lead zirconate titanate films Griggio, F.; Trolier-McKinstry, S. Journal of Applied Physics, Vol. 107, Issue 2 https://doi.org/10.1063/1.3284945	journal	January 2010
Phase-field simulation of polarization switching and domain evolution in ferroelectric polycrystals Choudhury, S.; Li, Y.; Krilliii, C. Acta Materialia, Vol. 53, Issue 20 https://doi.org/10.1016/j.actamat.2005.07.040	journal	December 2005
Effect of grain orientation and grain size on ferroelectric domain switching and evolution: Phase field simulations Choudhury, S.; Li, Y. L.; Krill III, C. Acta Materialia, Vol. 55, Issue 4 https://doi.org/10.1016/j.actamat.2006.09.048	journal	February 2007
A computational model of ferroelectric domains. Part II: grain boundaries and defect pinning Zhang, W.; Bhattacharya, K. Acta Materialia, Vol. 53, Issue 1 https://doi.org/10.1016/j.actamat.2004.09.015	journal	January 2005
Virtual piezoforce microscopy of polycrystalline ferroelectric films García, R. Edwin; Huey, Bryan D.; Blendell, John E. Journal of Applied Physics, Vol. 100, Issue 6 https://doi.org/10.1063/1.2336073	journal	September 2006
First-principles study of the interplay between grain boundaries and domain walls in ferroelectric PbTiO $_{3}$ Marton, Pavel; Shimada, Takahiro; Kitamura, Takayuki Physical Review B, Vol. 83, Issue 6 https://doi.org/10.1103/PhysRevB.83.064110	journal	February 2011
Atomic-scale mechanisms of ferroelastic domain-wall-mediated ferroelectric switching Gao, Peng; Britson, Jason; Jokisaari, Jacob R. Nature Communications, Vol. 4, Issue 1 https://doi.org/10.1038/ncomms3791	journal	November 2013
Ab initio study of ferroelectric domain walls in ${PbTiO}_{3}$ Meyer, B.; Vanderbilt, David Physical Review B, Vol. 65, Issue 10 https://doi.org/10.1103/PhysRevB.65.104111	journal	March 2002
Domain Wall Creep in Epitaxial Ferroelectric $P b (Z r_{0.2} T i_{0.8}) O_{3}$ Thin Films Tybell, T.; Paruch, P.; Giamarchi, T. Physical Review Letters, Vol. 89, Issue 9 https://doi.org/10.1103/PhysRevLett.89.097601	journal	August 2002
Nanoscale studies of domain wall motion in epitaxial ferroelectric thin films Paruch, Patrycja; Giamarchi, Thierry; Tybell, Thomas Journal of Applied Physics, Vol. 100, Issue 5 https://doi.org/10.1063/1.2337356	journal	September 2006
Thermal quench effects on ferroelectric domain walls Paruch, P.; Kolton, A. B.; Hong, X. Physical Review B, Vol. 85, Issue 21 https://doi.org/10.1103/PhysRevB.85.214115	journal	June 2012
High Speed SPM Applied for Direct Nanoscale Mapping of the Influence of Defects on Ferroelectric Switching Dynamics Huey, Bryan D.; Nath Premnath, Ramesh; Lee, Sungjun Journal of the American Ceramic Society, Vol. 95, Issue 4 https://doi.org/10.1111/j.1551-2916.2012.05099.x	journal	March 2012
Tip traveling and grain boundary effects in domain formation using piezoelectric force microscopy for probe storage applications Kim, Yunseok; Cho, Youngsang; Hong, Seungbum Applied Physics Letters, Vol. 89, Issue 17 https://doi.org/10.1063/1.2370502	journal	October 2006
Ferroelectric domain wall pinning at a bicrystal grain boundary in bismuth ferrite Rodriguez, Brian J.; Chu, Y. H.; Ramesh, R. Applied Physics Letters, Vol. 93, Issue 14 https://doi.org/10.1063/1.2993327	journal	October 2008
Watching domains grow: In-situ studies of polarization switching by combined scanning probe and scanning transmission electron microscopy Chang, Hyejung; Kalinin, Sergei V.; Yang, Seungyeul Journal of Applied Physics, Vol. 110, Issue 5 https://doi.org/10.1063/1.3623779	journal	September 2011
Domains Beyond the Grain Boundary Ivry, Yachin; Chu, Daping; Scott, James F. Advanced Functional Materials, Vol. 21, Issue 10 https://doi.org/10.1002/adfm.201002142	journal	March 2011
Influence of a Single Grain Boundary on Domain Wall Motion in Ferroelectrics Marincel, Daniel M.; Zhang, Huairuo; Kumar, Amit Advanced Functional Materials, Vol. 24, Issue 10 https://doi.org/10.1002/adfm.201302457	journal	October 2013
Subcoercive Cyclic Electrical Loading of Lead Zirconate Titanate Ceramics II: Time-Resolved X-Ray Diffraction Pramanick, Abhijit; Daniels, John E.; Jones, Jacob L. Journal of the American Ceramic Society, Vol. 92, Issue 10 https://doi.org/10.1111/j.1551-2916.2009.03219.x	journal	October 2009
Subcoercive Cyclic Electrical Loading of Lead Zirconate Titanate Ceramics I: Nonlinearities and Losses in the Converse Piezoelectric Effect Pramanick, Abhijit; Damjanovic, Dragan; Nino, Juan C. Journal of the American Ceramic Society, Vol. 92, Issue 10 https://doi.org/10.1111/j.1551-2916.2009.03218.x	journal	October 2009
Composition dependence of local piezoelectric nonlinearity in (0.3)Pb(Ni _0.33 Nb _0.67 )O ₃ -(0.7)Pb(Zr _x Ti _1−x )O ₃ films Griggio, F.; Jesse, S.; Qu, W. Journal of Applied Physics, Vol. 110, Issue 4 https://doi.org/10.1063/1.3622312	journal	August 2011
Contributions to the Piezoelectric Effect in Ferroelectric Single Crystals and Ceramics Damjanovic, Dragan Journal of the American Ceramic Society, Vol. 88, Issue 10 https://doi.org/10.1111/j.1551-2916.2005.00671.x	journal	October 2005
The Rayleigh law in piezoelectric ceramics Damjanovic, Dragan; Demartin, Marlyse Journal of Physics D: Applied Physics, Vol. 29, Issue 7 https://doi.org/10.1088/0022-3727/29/7/046	journal	July 1996
Phase-Field Method of Phase Transitions/Domain Structures in Ferroelectric Thin Films: A Review Chen, Long-Qing Journal of the American Ceramic Society, Vol. 91, Issue 6 https://doi.org/10.1111/j.1551-2916.2008.02413.x	journal	June 2008
Effect of substrate constraint on the stability and evolution of ferroelectric domain structures in thin films Li, Y. L.; Hu, S. Y.; Liu, Z. K. Acta Materialia, Vol. 50, Issue 2 https://doi.org/10.1016/S1359-6454(01)00360-3	journal	January 2002
Applications of semi-implicit Fourier-spectral method to phase field equations Chen, L. Q.; Shen, Jie Computer Physics Communications, Vol. 108, Issue 2-3 https://doi.org/10.1016/S0010-4655(97)00115-X	journal	February 1998
Effect of electrical boundary conditions on ferroelectric domain structures in thin films Li, Y. L.; Hu, S. Y.; Liu, Z. K. Applied Physics Letters, Vol. 81, Issue 3 https://doi.org/10.1063/1.1492025	journal	July 2002
An iterative-perturbation scheme for treating inhomogeneous elasticity in phase-field models Yu, P.; Hu, S. Y.; Chen, L. Q. Journal of Computational Physics, Vol. 208, Issue 1 https://doi.org/10.1016/j.jcp.2005.02.015	journal	September 2005
Inherent nanoscale structural instabilities near morphotropic boundaries in ferroelectric solid solutions Rossetti, George A.; Khachaturyan, Armen G. Applied Physics Letters, Vol. 91, Issue 7 https://doi.org/10.1063/1.2771095	journal	August 2007
Origin of 90° domain wall pinning in Pb(Zr _0.2 Ti _0.8 )O ₃ heteroepitaxial thin films Su, Dong; Meng, Qingping; Vaz, C. A. F. Applied Physics Letters, Vol. 99, Issue 10 https://doi.org/10.1063/1.3634028	journal	September 2011
Elastic coupling between 90° twin walls and interfacial dislocations in epitaxial ferroelectric perovskites: A quantitative high-resolution transmission electron microscopy study Chu, Ming-Wen; Szafraniak, Izabela; Hesse, Dietrich Physical Review B, Vol. 72, Issue 17 https://doi.org/10.1103/PhysRevB.72.174112	journal	November 2005
Optical Properties of PZT, PLZT, and PNZT Thin Films Peng, Chien H.; Chang, Jhing-Fang; Desu, Seshu B. MRS Proceedings, Vol. 243 https://doi.org/10.1557/PROC-243-21	journal	January 1991
Semiconducting barium titanate Heywang, W. Journal of Materials Science, Vol. 6, Issue 9 https://doi.org/10.1007/BF00550094	journal	September 1971
Piezoelectric nonlinearity due to motion of 180° domain walls in ferroelectric materials at subcoercive fields: A dynamic poling model Trolier-McKinstry, Susan; Bassiri Gharb, Nazanin; Damjanovic, Dragan Applied Physics Letters, Vol. 88, Issue 20 https://doi.org/10.1063/1.2203750	journal	May 2006
Higher order harmonic detection for exploring nonlinear interactions with nanoscale resolution Vasudevan, R. K.; Okatan, M. Baris; Rajapaksa, I. Scientific Reports, Vol. 3, Issue 1 https://doi.org/10.1038/srep02677	journal	September 2013
Domain wall contributions to the properties of piezoelectric thin films Bassiri-Gharb, Nazanin; Fujii, Ichiro; Hong, Eunki Journal of Electroceramics, Vol. 19, Issue 1 https://doi.org/10.1007/s10832-007-9001-1	journal	March 2007
Collective dynamics underpins Rayleigh behavior in disordered polycrystalline ferroelectrics Bintachitt, P.; Jesse, S.; Damjanovic, D. Proceedings of the National Academy of Sciences, Vol. 107, Issue 16 https://doi.org/10.1073/pnas.0913172107	journal	April 2010
Thermodynamic theory of the lead zirconate-titanate solid solution system, part III: Curie constant and sixth-order polarization interaction dielectric stiffness coefficients Haun, M. J.; Zhuang, Z. Q.; Furman, E. Ferroelectrics, Vol. 99, Issue 1 https://doi.org/10.1080/00150198908221438	journal	November 1989
The role of the background dielectric susceptibility in uniaxial ferroelectrics Tagantsev, A. K. Ferroelectrics, Vol. 69, Issue 1 https://doi.org/10.1080/00150198608008205	journal	July 1986
Three-dimensional phase-field simulation of domain structures in ferroelectric islands Zhang, J. X.; Wu, R.; Choudhury, S. Applied Physics Letters, Vol. 92, Issue 12 https://doi.org/10.1063/1.2903107	journal	March 2008
Theory of ferroelectrics Devonshire, A. F. Advances in Physics, Vol. 3, Issue 10 https://doi.org/10.1080/00018735400101173	journal	April 1954
Enhanced electric conductivity at ferroelectric vortex cores in BiFeO3 Balke, Nina; Winchester, Benjamin; Ren, Wei Nature Physics, Vol. 8, Issue 1 https://doi.org/10.1038/nphys2132	journal	November 2011
Phase-field simulation of domain structures in epitaxial BiFeO ₃ films on vicinal substrates Winchester, B.; Wu, P.; Chen, L. Q. Applied Physics Letters, Vol. 99, Issue 5 https://doi.org/10.1063/1.3605674	journal	August 2011
Ferroelastic domain switching dynamics under electrical and mechanical excitations Gao, Peng; Britson, Jason; Nelson, Christopher T. Nature Communications, Vol. 5, Issue 1 https://doi.org/10.1038/ncomms4801	journal	May 2014
Three-Dimensional Computer Simulation of Ferroelectric Domain Formation Hu, Hong-Liang; Chen, Long-Qing Journal of the American Ceramic Society, Vol. 81, Issue 3 https://doi.org/10.1111/j.1151-2916.1998.tb02367.x	journal	March 1998
Mesoscopic mechanism of the domain wall interaction with elastic defects in uniaxial ferroelectrics Morozovska, Anna N.; Eliseev, Eugene A.; Svechnikov, G. S. Journal of Applied Physics, Vol. 113, Issue 18 https://doi.org/10.1063/1.4801959	journal	May 2013
Dependence of electrical properties of epitaxial Pb(Zr,Ti)O3 thick films on crystal orientation and Zr∕(Zr+Ti) ratio Yokoyama, Shintaro; Honda, Yoshihisa; Morioka, Hitoshi Journal of Applied Physics, Vol. 98, Issue 9 https://doi.org/10.1063/1.2126156	journal	November 2005

Cited By (6)

Dynamical Magnetic Field Accompanying the Motion of Ferroelectric Domain Walls Juraschek, Dominik M.; Meier, Quintin N.; Trassin, Morgan Physical Review Letters, Vol. 123, Issue 12 https://doi.org/10.1103/physrevlett.123.127601	journal	September 2019
Scaling Effects in Perovskite Ferroelectrics: Fundamental Limits and Process-Structure-Property Relations Ihlefeld, Jon F.; Harris, David T.; Keech, Ryan Journal of the American Ceramic Society, Vol. 99, Issue 8 https://doi.org/10.1111/jace.14387	journal	July 2016
Lead-reduced Bi(Ni _2/3 Ta _1/3 )O ₃ -PbTiO ₃ perovskite ceramics with high Curie temperature and performance Pang, Dongfang; Liu, Xitao; Zheng, Jing Journal of the American Ceramic Society, Vol. 102, Issue 3 https://doi.org/10.1111/jace.15962	journal	August 2018
Big data and deep data in scanning and electron microscopies: deriving functionality from multidimensional data sets Belianinov, Alex; Vasudevan, Rama; Strelcov, Evgheni Advanced Structural and Chemical Imaging, Vol. 1, Issue 1 https://doi.org/10.1186/s40679-015-0006-6	journal	May 2015
Dynamical Magnetic Field Accompanying the Motion of Ferroelectric Domain Walls M., Juraschek, Dominik; N., Meier, Quintin; Morgan, Trassin, ETH Zurich https://doi.org/10.3929/ethz-b-000368237	text	January 2019
A dynamical magnetic field accompanying the motion of ferroelectric domain walls Juraschek, Dominik M.; Meier, Quintin N.; Trassin, Morgan arXiv https://doi.org/10.48550/arxiv.1904.06335	text	January 2019

Similar Records

Domain Wall Motion Across Various Grain Boundaries in Ferroelectric Thin Films

Journal Article · Sat Mar 21 00:00:00 EDT 2015 · Journal of the American Ceramic Society · OSTI ID:1286789

Marincel, Daniel M.; Zhang, Huairuo; Jesse, Stephen; +7 more

Convergent-beam electron diffraction studies of domains in Rhombohedral phase of lead zirconate titanate ceramics

Conference · Wed Jul 01 00:00:00 EDT 1987 · OSTI ID:1286789

Dass, M L.A.; Thomas, G

Influence of doping and thickness on domain avalanches in lead zirconate titanate thin films

Journal Article · Mon Mar 27 00:00:00 EDT 2023 · Applied Physics Letters · OSTI ID:1286789

Peters, Travis; Zhu, Wanlin; Checa, Marti; +2 more

Related Subjects

36 MATERIALS SCIENCE
PbZr1−x
TixO3
PZT
grain boundaries
mesoscopic behavior

Title: Domain pinning near a single-grain boundary in tetragonal and rhombohedral lead zirconate titanate films

Citation Formats

References (56)

Cited By (6)

Similar Records

Related Subjects