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RESEARCH PAPER · Journal of Applied Physics · 2005

Predicting morphotropic phase boundary locations and transition temperatures in Pb- and Bi-based perovskite solid solutions from crystal chemical data and first-principles calculations

Ilya Grinberg, Matthew R. Suchomel, Peter K. Davies, Andrew M. Rappe

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Predicting morphotropic phase boundary locations and transition temperatures in Pb- and Bi-based perovskite solid solutions from crystal chemical data and first-principles calculationsOriginalBridging phases at the morphotropic boundaries of lead oxide solid solutions240Enhanced tetragonality in (x)PbTiO3–(1−x)Bi(B′B″)O3 systems: Bi(Zn3∕4W1∕4)O364Low-frequency dielectric dispersion and magnetic properties of La, Gd modified Pb(Fe1/2Ta1/2)O3 multiferroics23Nonmonotonic TC Trends in Bi-Based Ferroelectric Perovskite Solid Solutions76Structure and Polarization in the High Tc Ferroelectric Bi(Zn,Ti)O3−PbTiO3 Solid Solutions142First principles calculations, crystal chemistry and properties of ferroelectric perovskites65The effect of alkali niobate addition on the phase stability and dielectric properties of Pb(Zn1∕3Nb2∕3)O3 based ceramic10Ferroelectric Properties of Pb(Zn 1/3 Nb 2/3 )O 3 –PbTiO 3 –RNbO 3 (R=Na, K) Ceramics4High spontaneous polarization in PbTiO3–BiMeO3 systems with enhanced tetragonality39Relationship between Local Structure and Relaxor Behavior in Perovskite Oxides68Modeling of Materials for Naval SONAR, Pollution Control and Nonvolatile Memory Application0Zero Thermal Expansion in PbTiO 3 -Based Perovskites213Structural evolution of a high Tc ferroelectric (x)Bi(Zn1∕2Ti1∕2)O3–(1−x)PbTiO3 solid solution37Feature of morphotropic phase boundary of yBiGaO3–(1−x−y)BiScO3–xPbTiO3 high-temperature piezoelectric ceramics12Piezoelectric and ferroelectric properties of Bi-compensated (Bi1/2Na1/2)TiO3–(Bi1/2K1/2)TiO3 lead-free piezoelectric ceramics135Combinatorial discovery of a lead-free morphotropic phase boundary in a thin-film piezoelectric perovskite284Microstructure–Property Relationships in Liquid Phase‐Sintered High‐Temperature Bismuth Scandium Oxide‐Lead Titanate Piezoceramics40Growth and structural characterization of (0.2)Bi(Zn1∕2Ti1∕2)O3–(0.8)PbTiO3 epitaxial thin films by off-axis rf sputtering7Structure and negative thermal expansion of Pb1−xBixTiO321Phase structure and electrical properties of La2O3-doped BiInO3-PbTiO3 ceramics with high curie temperature1Zero thermal expansion in (1−x)PbTiO3–xBi(Mg,Ti)1/2O3 piezoceramics39Structure and lattice dynamics in PbTiO3–Bi(Zn1/2Ti1/2)O3 solid solutions30First-principles investigation of the highly tetragonal ferroelectric material Bi(Zn1/2Ti1/2)O358Competing A-site and B-site driven ferroelectric instabilities in the (1−x)PbTiO3-(x)BiAlO3 system23Perspective on the Development of Lead‐free Piezoceramics2998New Prospects for High Performance SONAR, Chemical Sensor, and Communication Device Materials4Structural transitions and complex domain structures across a ferroelectric-to-antiferroelectric phase boundary in epitaxial Sm-doped BiFeO3 thin films192Temperature dependence of piezoelectric properties of high-TC Bi(Mg1/2Ti1/2)O3–PbTiO397Formation of Morphotropic Phase Boundary and Electrical Properties of (Bi1/2Na1/2)TiO3–Ba(Al1/2Nb1/2)O3Solid Solution Ceramics79Growth and properties of chemical solution deposited BiInO3–PbTiO3 films19Thermal Expansion, Ferroelectric and Magnetic Properties in (1 − x )PbTiO 3 − x Bi(Ni 1/2 Ti 1/2 )O 391Morphotropic phase boundary and electrical properties of lead-free (1−x)BaTiO3−xBi(Li1/3Ti2/3)O3 ceramics14Stability of the various crystallographic phases of the multiferroic (1−x)BiFeO3–xPbTiO3 system as a function of composition and temperature92Structural evidence for the nonmonotonic trend of TC in tetragonal PbTiO3BiScO3 solid solutions24Materials Design and Characterization of (Bi1/2Na1/2)TiO3-Bi(B’,B”)O3 Ceramics3Structure and Piezoelectric Properties Near the Bismuth Scandium Oxide–Lead Zirconate–Lead Titanate Ternary Morphotropic Phase Boundary16Bi(Zn0.5Ti0.5)O3Substitution Effects in Pb(Zr,Ti)O3Piezoelectric Ceramics Around Morphotropic Phase Boundary Region12Domain structure-dielectric property relationship in lead-free (1−x)(Bi1/2Na1/2)TiO3xBaTiO3 ceramics427BiFeO3–PbZrO3–PbTiO3 ternary system for high Curie temperature piezoceramics46Magnetic enhancement and low thermal expansion of (1−x−y)PbTiO3-xBi(Ni1/2Ti1/2)O3-yBiFeO312Identifying the ‘inorganic gene’ for high-temperature piezoelectric perovskites through statistical learning98Pb-free ferroelectrics investigated with density functional theory: SnAI ₁/₂ Hb ₁/₂ O₃ perovskites0Pb-free ferroelectrics investigated with density functional theory: SnAl 1/2 Nb 1/2 O 3 perovskites22Combinatorial and High-Throughput Screening of Materials Libraries: Review of State of the Art511B‐site Dopant Effect on the Thermal Expansion in the (1‐ x )PbTiO 3 ‐ x BiMeO 3 Solid Solution ( Me = Fe , In , Sc )13The Role of Spontaneous Polarization in the Negative Thermal Expansion of Tetragonal PbTiO 3 -Based Compounds177Structural Percolation in the PbM1–xMx′O3 (M, M′ =Ti, Cr, and V) Perovskites17Band-gap engineering via local environment in complex oxides89Phase Transformation Behavior and Electrical Properties of Pb(Zr 0.56 Ti 0.44 )O 3 –Bi(Zn 0.5 Ti 0.5 )O 3 Solid Solution Ceramics15Morphotropic phase boundary and high temperature dielectric, piezoelectric, and ferroelectric properties of (1−x)Bi(Sc3/4In1/4)O3-xPbTiO3 ceramics31Multiple dielectric transitions in the PbTiO3-Bi(Zn1/2Ti1/2)O3-Bi(Mg1/2Ti1/2)O3 system11Nonstoichiometry in (Bi0.5Na0.5)TiO3 Ceramics3First-principles study of band gap engineering via oxygen vacancy doping in perovskite A B B ′ O 3 solid solutions32First-principles study of band gap engineering via oxygen vacancy doping in perovskite ABB'O₃ solid solutions0Fabrication and Properties of High Curie Temperature x BiZn 1/2 Ti 1/2 O 3 –(1− x ) PbTiO 3 Piezoelectric Films by a Sol–Gel Process10High piezoelectric and mechanical performances in multiferroic (1−x−y)PbTiO3-xBi(Ni1/2Ti1/2)O3-yBiScO37Progress in lead-based ferroelectric and antiferroelectric single crystals: composition modification, crystal growth and properties69High temperature electronic properties of BaTiO3 – Bi(Zn1/2Ti1/2)O3 – BiInO3 for capacitor applications31PREDICTION OF DIELECTRIC DISPERSION FOR LEAD BASED PEROVSKITES AND STUDY OF LOCAL DIELECTRIC RESPONSE IN 0.75Pb(Mg1/3Nb2/3)O3–0.25PbTiO36Nucleation‐Growth Mode of Cubic‐Tetragonal Transition with Coexistence of Phases over a Wide Temperature Interval in the High Temperature Ferroelectric Systems PbTiO 3 – BiMeO 3 : Me = Sc , and Zn 1/2 Ti 1/24Phase Diagram, Temperature Stability, and Electrical Properties of (0.85− x ) Pb ( Mg 1/3 Nb 2/3 ) O 3 –0.10 Pb ( Fe 1/2 Nb 1/2 ) O 3 –0.05 PbZrO 3 – x PbTiO 3 System36Structural, microstructural and electrical properties of BiFeO3–BaTiO3 ceramics with high thermal stability94Enhanced piezoelectric and antiferroelectric properties of high-TC perovskite of Zr-substituted Bi(Mg1/2Ti1/2)O3-PbTiO327Structural change in polar nanoregion in alkali niobate added Pb(Zn1/3Nb2/3)0.95Ti0.05O3 single crystal and its effect on ferroelectric properties0Smart Materials and Active Structures11High-temperature piezoelectirc thin films of 0.20BiInO3-0.80PbTiO3 deposited by pulsed laser deposition（Retracted Article)0Structural Stability of Antiferroelectric Pb(Mg1/2W1/2)O3-Based Complex Perovskite Solid Solutions4Enhanced piezoelectric and ferroelectric properties in the BaZrO3 substituted BiFeO3-PbTiO372Bi(Zn 1/2 Ti 1/2 )O 3 modified BiFeO 3 –BaTiO 3 lead-free piezoelectric ceramics with high temperature stability77Competing structural phase transition scenarios in the giant tetragonality ferroelectric BiFeO3-PbTiO3: Isostructural vs multiphase transition48Synthesis and characterization of Pb(Mg1/3Nb2/3)O3–PbTiO3 relaxor ferroelectrics modified by Ba(Mg1/3Nb2/3)O36Crystal Structure and Electrical Properties of Lead‐Free (1 − x ) BaTiO 3 – x ( Bi 1/2 A 1/2 ) TiO 3 (A = Ag , Li , Na , K , Rb , Cs ) Ceramics13Effectively control negative thermal expansion of single-phase ferroelectrics of PbTiO3-(Bi,La)FeO3 over a giant range112Temperature-independent ferroelectric property and characterization of high-TC 0.2Bi(Mg1/2Ti1/2)O3-0.8PbTiO3 thin films14Structure and electrical properties of (1− x )(0.1BiYbO 3 –0.9PbTiO 3 )– x Pb(Zn 1/3 Nb 2/3 )O 3 high-temperature ternary piezoelectric ceramics15Characterization of the High‐Temperature Ferroelectric (100− x − y ) BiScO 3 –( x ) Bi ( Zr 0.5 Zn 0.5 ) O 3 –( y ) PbTiO 3 Perovskite Ternary Solid Solution24Band gap modification and ferroelectric properties of Bi0.5(Na,K)0.5TiO3-based by Li substitution52High piezoelectric performance and temperature dependence of ferroelectric and piezoelectric properties of Bi(Mg0.5Zr0.5)O3–PbTiO3 near morphotropic phase boundary11Ab-initio study of the dielectric response of high-permittivity perovskites for energy storage0Dielectric Relaxor Evolution and Frequency‐Insensitive Giant Strains in ( Bi 0.5 Na 0.5 ) TiO 3 ‐Modified Bi ( Mg 0.5 Ti 0.5 ) O 3 – PbTiO 3 Ferroelectric Ceramics54Microstructure, Ferroelectric, Piezoelectric, and Ferromagnetic Properties of Sc‐Modified BiFeO 3 – BaTiO 3 Multiferroic Ceramics with MnO 2 Addition88Theoretical prediction of morphotropic compositions in Na1/2 Bi1/2 TiO3 -based solid solutions from transition pressures10A new Bi0.5Na0.5TiO3 based lead-free piezoelectric system with calculated end-member Bi(Zn0.5Hf0.5)O321New Antiferroelectric Solid Solution of Pb ( Mg 1/2 W 1/2 ) O 3 – Pb ( Zn 1/2 W 1/2 ) O 3 as Dielectric Ceramics4Study of Antiferroelectric PbZrO3-Pb(M1/2W1/2)O3(M = Mg, Zn & Mn) Complex Perovskite Solid Solutions4Mn doped hard type perovskite high-temperature BYPT–PZN ternary piezoelectric ceramics23Bi(Ni1/2Zr1/2)O3-PbTiO3 relaxor-ferroelectric films for piezoelectric energy harvesting and electrostatic storage45High temperature Bi-based ferroelectric solid-solution with enhanced dielectric properties and magnetic order2Structural, ferroelectric, optical properties of A-site-modified Bi0.5(Na0.78K0.22)0.5Ti0.97Zr0.03O3 lead-free piezoceramics27Large strain response based on relaxor-antiferroelectric coherence in Bi0.5Na0.5TiO3–SrTiO3–(K0.5Na0.5)NbO3 solid solutions125Negative thermal expansion in functional materials: controllable thermal expansion by chemical modifications715High-sensitivity piezoelectric perovskites for magnetoelectric composites32Potassium–Sodium Niobate Lead-Free Piezoelectric Materials: Past, Present, and Future of Phase Boundaries1608Effects of sintering temperature on structure and properties of BY-PT-PMN ternary piezoelectric ceramics3Growth and characterization of high-Curie temperature Pb(Lu1/2Nb1/2)O3–Pb(Mg1/3Nb2/3)O3–PbTiO3 ternary single crystal by modified Bridgman technique8Effect of Li2CO3 addition on the structural, optical, ferroelectric, and electric-field-induced strain of lead-free BNKT-based ceramics25Tuning of dielectric, pyroelectric and ferroelectric properties of 0.715Bi0.5Na0.5TiO3-0.065BaTiO3-0.22SrTiO3 ceramic by internal clamping64Synthesis and Electrical Properties of (Pb,Bi)TiO 3 Ceramics10Structural and electrical properties of (1− x )(Na 0.5 Bi 0.5 )TiO 3 –x Bi(Mg 0.5 Zr 0.5 )O 3 lead-free piezoelectric ceramics13Role of strain and lattice distortion on ferroelectric and piezoelectric properties of bismuth magnesium zirconate substituted sodium bismuth titanate ceramics10Phase evolution and correlation between tolerance factor and electromechanical properties in BNT-based ternary perovskite compounds with calculated end-member Bi(Me 0.5 Ti 0.5 )O 3 (Me = Zn, Mg, Ni, Co)53Phase transition and domain configuration of poled rhombohedral PIN–PZ–PMN–PT single crystals11Phase Transition, Dielectric and Piezoelectric Properties of Lead-Free Piezoelectric (K 1/2 Na 1/2 )NbO 3 – Bi(Zn 2/3 Nb 1/3 )O 3 Ceramics14Investigation on structural, Mössbauer and ferroelectric properties of (1−x)PbFe0.5Nb0.5O3–(x)BiFeO3 solid solution42Structural and electrical properties of bismuth magnesium titanate substituted lead-free sodium bismuth titanate ceramics3New Pb(Mg1/3Nb2/3)O3–Pb(In1/2Nb1/2)O3–PbZrO3–PbTiO3 Quaternary Ceramics: Morphotropic Phase Boundary Design and Electrical Properties96Temperature dependence of dielectric and ferroelectric properties for (1−x)Bi0.5(Na0.8K0.2)0.5TiO3-xBaZn0.5W0.5O3lead-free piezoelectric ceramics5Phase transition and tolerance factor relationship of lead-free (Bi0.5K0.5)TiO3-Bi(Mg0.5Ti0.5)O3 piezoelectric ceramics26Relaxor-like behavior and ferroelectric evolution in(1-x)[0.5BZT−0.5PT]−(x)BKT ternary system1Average vs. local structure and composition-property phase diagram of K0.5Na0.5NbO3-Bi½Na½TiO3 system142Ferroelectric, piezoelectric properties and thermal expansion of new Bi(Ni 3/4 W 1/4 )O 3 –PbTiO 3 solid solutions10Preparation and characterization of high Curie-temperature piezoelectric ceramics in a new Bi-based perovskite of (1 − x)PbTiO 3 -xBi(Zn 1/2 Hf 1/2 )O 311Structural and ferroelectric properties of perovskite Pb (1−x) (K 0.5 Sm 0.5 ) x TiO 3 ceramics38Synthesis, structure and piezo-/ferroelectric properties of a novel bismuth-containing ternary complex perovskite solid solution44Anisotropic domain structures of Pb(Mg 1/3 Nb 2/3 )O 3 –PbZrO 3 –PbTiO 3 single crystals with high ferroelectric phase transition temperature7Investigation of morphotropic phase boundaries in PIN–PSN–PT relaxor ferroelectric ternary systems with high T r-t and T c phase transition temperatures47Atomic-level structural correlations across the morphotropic phase boundary of a ferroelectric solid solution: xBiMg1/2Ti1/2O3-(1 − x)PbTiO326Relaxor dielectric behavior in BaTiO3 substituted BiFeO3–PbTiO3 multiferroic system11High Curie-temperature (TC) piezo-/ferroelectric single crystals with bismuth-based complex perovskites: Growth, structures and properties20Effects of Bi(Zn2/3Nb1/3)O3 Modification on the Relaxor Behavior and Piezoelectricity of Pb(Mg1/3Nb2/3)O3–PbTiO3 Ceramics17Large piezoelectric responses of Bi(Fe,Mg,Ti)O3-BaTiO3 lead-free piezoceramics near the morphotropic phase boundary28Predicting displacements of octahedral cations in ferroelectric perovskites using machine learning32Delayed thermal depolarization of Bi0.5Na0.5TiO3-BaTiO3 by doping acceptor Zn2+ with large ionic polarizability65Temperature stability and electrical properties of MnO‐doped KNN ‐based ceramics sintered in reducing atmosphere47Thermal stability of xBiScO3–(1-x-y)PbZrO3–yPbTiO3 ternary piezoelectric system with enhanced piezoelectric and dielectric properties16Investigation of La and Al substitution on the spontaneous polarization and lattice dynamics of the Pb(1-x)LaxTi(1-x)AlxO3 ceramics32Improving piezoelectric properties and temperature stability for KNN‐based ceramics sintered in a reducing atmosphere29Optimized electrical properties of (Bi1/2K1/2)TiO3- bi(Mn2/3Sb1/3)O3 lead-free ceramics in mixing phase region6Experimental search for high-temperature ferroelectric perovskites guided by two-step machine learning277First-principles studies of the local structure and relaxor behavior of Pb(Mg1/3Nb2/3)O3−PbTiO3 -derived ferroelectric perovskite solid solutions24Structural and electrical properties of cation and anion doped BiScO3-PbTiO3 ceramics10Anomalously large lattice strain contributions from rhombohedral phases in BiFeO3-based high-temperature piezoceramics estimated by means of in-situ synchrotron x-ray diffraction37Lead‐reduced Bi(Ni 2/3 Ta 1/3 )O 3 ‐PbTiO 3 perovskite ceramics with high Curie temperature and performance12Effects of Ba(Zr0.25Ti0.75)O3 substituent on ferroelectric properties in the BiFeO3-PbTiO3 high temperature ceramics15Dielectric Properties of (Bi0.5K0.5)ZrO3 Modified (K0.5Na0.5)NbO3 Ceramics as High-Temperature Ceramic Capacitors14Effects of LiNbO3 doping on the microstructures and electrical properties of BiScO3–PbTiO3 piezoelectric system11Synthesis and structural characterization of a novel perovskite solid solution (1-x)PbTiO3-xBi(Zn2/3Ta1/3)O31Synthesis, structure, dielectric properties and relaxor behavior of a novel solid solution (1-x)Pb(Mg1/3Nb2/3)O3-xBi(Zn2/3Nb1/3)O34Structure and Electrical Properties of Morphotropic Phase Boundary (Na1/2Bi1/2)TiO3‐PbTiO3‐Bi(Mg1/2Ti1/2)O3 Ternary System0Construction of high Tc BiScO3-BiFeO3-PbTiO3 and its enhanced piezoelectric properties by sintering in oxygen atmosphere27High Ferroelectricities and High Curie Temperature of BiInO 3 PbTiO 3 Thin Films Deposited by RF Magnetron Sputtering Method0Remarkable piezoelectric activity and high electrical resistivity in Cu/Nb co-doped Bi4Ti3O12 high temperature piezoelectric ceramics83High rhombohedral to tetragonal phase transition temperature and electromechanical response in Pb(Yb1/2Nb1/2)O3-Pb(Sc1/2Nb1/2)O3-PbTiO3 ferroelectric system near the morphotropic phase boundary13Mechanisms of enhanced thermal stability of polarization in lead-free (Bi1/2Na1/2)0.94Ba0.06TiO3 /ZnO ceramic composites38Large Piezoelectric Stability and Low Polarization Fatigue in 6Pb(Sc1/2Nb1/2)O3-70Pb(Mg1/3Nb2/3)O3-24PbTiO3 Crystals6Effect of electric poling on structural, magnetic and ferroelectric properties of 0.8PbFe0.5Nb0.5O3-0.2BiFeO3 multiferroic solid solution10Ferroelectric, Optical, and Photovoltaic Properties of Morphotropic Phase Boundary Compositions in the PbTiO3–BiFeO3–Bi(Ni1/2Ti1/2)O3 System51Phase evolution and electric properties of 5 mol. % LiNbO3 doped xBiScO3–(95-x)PbTiO3 ceramics10Large enhancement of piezoelectric properties and resistivity in Cu/Ta co‐doped Bi 4 Ti 3 O 12 high‐temperature piezoceramics51Pronounced Negative Thermal Expansion in Lead-Free BiCoO3-Based Ferroelectrics Triggered by the Stabilized Perovskite Structure21

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  1. Bridging phases at the morphotropic boundaries of lead oxide solid solutions

    Phase Transitions · 2006-01-01

    Beatriz Noheda, D. E. Cox

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  2. Enhanced tetragonality in (x)PbTiO3–(1−x)Bi(B′B″)O3 systems: Bi(Zn3∕4W1∕4)O3

    Applied Physics Letters · 2006-09-25

    David M. Stein, Matthew R. Suchomel, Peter K. Davies

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  3. Low-frequency dielectric dispersion and magnetic properties of La, Gd modified Pb(Fe1/2Ta1/2)O3 multiferroics

    Journal of Magnetism and Magnetic Materials · 2007-01-18

    R. N. P. Choudhury, C. Rodríguez, P. Bhattacharya, Ram S. Katiyar, Carlos Rinaldi

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  4. Nonmonotonic TC Trends in Bi-Based Ferroelectric Perovskite Solid Solutions

    Physical Review Letters · 2007-01-19

    Ilya Grinberg, Andrew M. Rappe

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  5. Structure and Polarization in the High Tc Ferroelectric Bi(Zn,Ti)O3−PbTiO3 Solid Solutions

    Physical Review Letters · 2007-03-05

    Ilya Grinberg, Matthew R. Suchomel, Wojciech Dmowski, Sara Elizabeth Mason, Hui Wu, Peter K. Davies, Andrew M. Rappe

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  6. First principles calculations, crystal chemistry and properties of ferroelectric perovskites

    Phase Transitions · 2007-04-01

    Ilya Grinberg, Andrew M. Rappe

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  7. The effect of alkali niobate addition on the phase stability and dielectric properties of Pb(Zn1∕3Nb2∕3)O3 based ceramic

    Journal of Applied Physics · 2007-06-01

    Jong‐Sung Park, Jung‐Kun Lee, Kug Sun Hong

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  8. Ferroelectric Properties of Pb(Zn 1/3 Nb 2/3 )O 3 –PbTiO 3 –RNbO 3 (R=Na, K) Ceramics

    Journal of the American Ceramic Society · 2007-09-13

    Jong‐Sung Park, Jung‐Kun Lee, Hyunmin Park, Kug Sun Hong

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  9. High spontaneous polarization in PbTiO3–BiMeO3 systems with enhanced tetragonality

    Applied Physics Letters · 2007-10-22

    Jun Chen, Penghao Hu, Xueyi Sun, Ce Sun, Xianran Xing

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  10. Relationship between Local Structure and Relaxor Behavior in Perovskite Oxides

    Physical Review Letters · 2007-12-27

    Ilya Grinberg, Pavol Juhás, Peter K. Davies, Andrew M. Rappe

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  11. Modeling of Materials for Naval SONAR, Pollution Control and Nonvolatile Memory Application

    Unknown journal · 2008-01-01

    Joseph W. Bennett, Ilya Grinberg, Young‐Han Shin, Andrew M. Rappe

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  12. Zero Thermal Expansion in PbTiO 3 -Based Perovskites

    Journal of the American Chemical Society · 2008-01-09

    Jun Chen, Xianran Xing, Ce Sun, Penghao Hu, Ranbo Yu, Xiaowei Wang, Lihong Li

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  13. Structural evolution of a high Tc ferroelectric (x)Bi(Zn1∕2Ti1∕2)O3–(1−x)PbTiO3 solid solution

    Applied Physics Letters · 2008-02-25

    X. D. Zhang, Dae‐Young Kwon, Bog G. Kim

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  14. Feature of morphotropic phase boundary of yBiGaO3–(1−x−y)BiScO3–xPbTiO3 high-temperature piezoelectric ceramics

    Journal of Applied Physics · 2008-04-01

    Yihang Jiang, Baoquan Qin, Yue Xi, Yi Zhao, Yuzhi Jiang, Dingquan Xiao, Jianguo Zhu

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  15. Piezoelectric and ferroelectric properties of Bi-compensated (Bi1/2Na1/2)TiO3–(Bi1/2K1/2)TiO3 lead-free piezoelectric ceramics

    Journal of Applied Physics · 2008-04-01

    Yaru Zhang, Jing‐Feng Li, Bo‐Ping Zhang, Chune Peng

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  16. Combinatorial discovery of a lead-free morphotropic phase boundary in a thin-film piezoelectric perovskite

    Applied Physics Letters · 2008-05-19

    S. Fujino, Makoto Murakami, Varatharajan Anbusathaiah, S. H. Lim, V. Nagarajan, Craig J. Fennie, Matthias Wuttig, L. Salamanca‐Riba, Ichiro Takeuchi

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  17. Microstructure–Property Relationships in Liquid Phase‐Sintered High‐Temperature Bismuth Scandium Oxide‐Lead Titanate Piezoceramics

    Journal of the American Ceramic Society · 2008-07-24

    Alp Sehirlioglu, Ali Sayir, Frederick W. Dynys

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  18. Growth and structural characterization of (0.2)Bi(Zn1∕2Ti1∕2)O3–(0.8)PbTiO3 epitaxial thin films by off-axis rf sputtering

    Applied Physics Letters · 2008-07-28

    Dae‐Young Kwon, Bongju Kim, P. Tong, Bog G. Kim

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  19. Structure and negative thermal expansion of Pb1−xBixTiO3

    Materials Letters · 2008-08-25

    Penghao Hu, Zhanmin Cao, Jun Chen, Jinxia Nancy Deng, Ce Sun, Ranbo Yu, Xianran Xing

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  20. Phase structure and electrical properties of La2O3-doped BiInO3-PbTiO3 ceramics with high curie temperature

    Journal of Wuhan University of Technology-Mater Sci Ed · 2008-12-01

    Zhaofeng Li

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  21. Zero thermal expansion in (1−x)PbTiO3–xBi(Mg,Ti)1/2O3 piezoceramics

    Journal of Materials Chemistry · 2009-01-01

    Penghao Hu, Jun Chen, Xueyi Sun, Jinxia Nancy Deng, Xi Chen, Ranbo Yu, Lijie J. Qiao, Xianran Xing

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  22. Structure and lattice dynamics in PbTiO3–Bi(Zn1/2Ti1/2)O3 solid solutions

    Journal of Applied Physics · 2009-02-15

    Jun Chen, Xueyi Sun, Jinxia Nancy Deng, Yong Zu, Yuntao Liu, Junhong Li, Xianran Xing

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  23. First-principles investigation of the highly tetragonal ferroelectric material Bi(Zn1/2Ti1/2)O3

    Physical Review B · 2009-03-24

    Tingting Qi, Ilya Grinberg, Andrew M. Rappe

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  24. Competing A-site and B-site driven ferroelectric instabilities in the (1−x)PbTiO3-(x)BiAlO3 system

    Applied Physics Letters · 2009-05-18

    Ajay Kumar Kalyani, Rohini Garg, Rajeev Ranjan

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  25. Perspective on the Development of Lead‐free Piezoceramics

    Journal of the American Ceramic Society · 2009-05-21

    Jürgen Rödel, Wook Jo, Klaus T. P. Seifert, E.-M. Anton, Torsten Granzow, Dragan Damjanović

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  26. New Prospects for High Performance SONAR, Chemical Sensor, and Communication Device Materials

    DoD High Performance Computing Modernization Program Users Group Conference (HPCMP-UGC) · 2009-06-01

    Tingting Qi, Sergey V. Levchenko, Joseph W. Bennett, Ilya Grinberg, Andrew M. Rappe

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  27. Structural transitions and complex domain structures across a ferroelectric-to-antiferroelectric phase boundary in epitaxial Sm-doped BiFeO3 thin films

    Physical Review B · 2009-07-21

    C.-J. Cheng, Daisuke Kan, S. H. Lim, Warren McKenzie, Paul Richard Munroe, L. Salamanca‐Riba, Ray Leslie Withers, Ichiro Takeuchi, V. Nagarajan

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  28. Temperature dependence of piezoelectric properties of high-TC Bi(Mg1/2Ti1/2)O3–PbTiO3

    Journal of Applied Physics · 2009-08-01

    Jun Chen, Xiaoli Tan, Wook Jo, Jürgen Rödel

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  29. Formation of Morphotropic Phase Boundary and Electrical Properties of (Bi1/2Na1/2)TiO3–Ba(Al1/2Nb1/2)O3Solid Solution Ceramics

    Japanese Journal of Applied Physics · 2009-09-24

    Yuji Hiruma, Hajime Nagata, Tadashi Takenaka

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  30. Growth and properties of chemical solution deposited BiInO3–PbTiO3 films

    Applied Physics Letters · 2009-10-19

    Song Won Ko, H. G. Yeo, Susan E. Trolier-McKinstry

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  31. Thermal Expansion, Ferroelectric and Magnetic Properties in (1 − x )PbTiO 3 − x Bi(Ni 1/2 Ti 1/2 )O 3

    Journal of the American Chemical Society · 2010-01-22

    Penghao Hu, Jun Chen, Jinxia Nancy Deng, Xianran Xing

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  32. Morphotropic phase boundary and electrical properties of lead-free (1−x)BaTiO3−xBi(Li1/3Ti2/3)O3 ceramics

    Journal of Applied Physics · 2010-06-15

    Cai-Bing Ma, Xiaoli Tan

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  33. Stability of the various crystallographic phases of the multiferroic (1−x)BiFeO3–xPbTiO3 system as a function of composition and temperature

    Journal of Applied Physics · 2010-06-15

    Shuvrajyoti Bhattacharjee, Dhananjai Pandey

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  34. Structural evidence for the nonmonotonic trend of TC in tetragonal PbTiO3BiScO3 solid solutions

    Applied Physics Letters · 2010-06-21

    Jun Chen, Krishna Nittala, Jacob L. Jones, Penghao Hu, Xianran Xing

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  35. Materials Design and Characterization of (Bi1/2Na1/2)TiO3-Bi(B’,B”)O3 Ceramics

    Key engineering materials · 2010-07-01

    Yumiko Oshima, Yuuki Kitanaka, Yuji Noguchi, Masaru Miyayama

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  36. Structure and Piezoelectric Properties Near the Bismuth Scandium Oxide–Lead Zirconate–Lead Titanate Ternary Morphotropic Phase Boundary

    Journal of the American Ceramic Society · 2010-10-07

    Alp Sehirlioglu, Ali Sayir, Frederick W. Dynys, Krishna Nittala, Jacob L. Jones

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  37. Bi(Zn0.5Ti0.5)O3Substitution Effects in Pb(Zr,Ti)O3Piezoelectric Ceramics Around Morphotropic Phase Boundary Region

    Ferroelectrics · 2010-10-29

    S. C. Lee, L. Wang, Myang Hwan Lee, Y. S. Sung, M. H. Kim, Tae Kwon Song, S. S. Kim, J. H. Cho, Byung Chun Choi, K. S. Choi, Yoshio Sakka

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  38. Domain structure-dielectric property relationship in lead-free (1−x)(Bi1/2Na1/2)TiO3xBaTiO3 ceramics

    Journal of Applied Physics · 2010-11-15

    C. Ma, Xiaoli Tan, Evgeniy Dul'kin, M. Roth

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  39. BiFeO3–PbZrO3–PbTiO3 ternary system for high Curie temperature piezoceramics

    Journal of the European Ceramic Society · 2010-12-16

    Wei Hu, Xiaoli Tan, Krishna Rajan

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  40. Magnetic enhancement and low thermal expansion of (1−x−y)PbTiO3-xBi(Ni1/2Ti1/2)O3-yBiFeO3

    Journal of Materials Chemistry · 2011-01-01

    Penghao Hu, Huajun Kang, Jun Chen, Jinxia Nancy Deng, Xianran Xing

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  41. Identifying the ‘inorganic gene’ for high-temperature piezoelectric perovskites through statistical learning

    Proceedings of the Royal Society A Mathematical Physical and Engineering Sciences · 2011-03-02

    Prasanna V. Balachandran, Scott Broderick, Krishna Rajan

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  42. Pb-free ferroelectrics investigated with density functional theory: SnAI ₁/₂ Hb ₁/₂ O₃ perovskites

    Maryland Shared Open Access Repository (USMAI Consortium) · 2011-04-26

    Joseph Bennett, Grinberg, Ilya, Peter K. Davies, Andrew M. Rappe

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  43. Pb-free ferroelectrics investigated with density functional theory: SnAl 1/2 Nb 1/2 O 3 perovskites

    Physical Review B · 2011-04-26

    Joseph W. Bennett, Ilya Grinberg, Peter K. Davies, Andrew M. Rappe

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  44. Combinatorial and High-Throughput Screening of Materials Libraries: Review of State of the Art

    ACS Combinatorial Science · 2011-06-06

    Radislav A. Potyrailo, Krishna Rajan, Klaus Stoewe, Ichiro Takeuchi, Bret J. Chisholm, Hubert Lam

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  45. B‐site Dopant Effect on the Thermal Expansion in the (1‐ x )PbTiO 3 ‐ x BiMeO 3 Solid Solution ( Me = Fe , In , Sc )

    Journal of the American Ceramic Society · 2011-06-07

    Penghao Hu, Jun Chen, Ce Sun, Jinxia Nancy Deng, Xianran Xing

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  46. The Role of Spontaneous Polarization in the Negative Thermal Expansion of Tetragonal PbTiO 3 -Based Compounds

    Journal of the American Chemical Society · 2011-06-22

    Jun Chen, Krishna Nittala, Jennifer S. Forrester, Jacob L. Jones, Jinxia Nancy Deng, Ranbo Yu, Xianran Xing

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  47. Structural Percolation in the PbM1–xMx′O3 (M, M′ =Ti, Cr, and V) Perovskites

    Inorganic Chemistry · 2011-06-23

    Ángel M. Arévalo‐López, Miguel Ángel Alario Franco

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  48. Band-gap engineering via local environment in complex oxides

    Physical Review B · 2011-06-24

    Tingting Qi, Ilya Grinberg, Andrew M. Rappe

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  49. Phase Transformation Behavior and Electrical Properties of Pb(Zr 0.56 Ti 0.44 )O 3 –Bi(Zn 0.5 Ti 0.5 )O 3 Solid Solution Ceramics

    Journal of the American Ceramic Society · 2011-07-07

    Ruzhong Zuo, Yi Liu, Shi Chen Su, Xiangcheng Chu, Xiaohui Wang

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  50. Morphotropic phase boundary and high temperature dielectric, piezoelectric, and ferroelectric properties of (1−x)Bi(Sc3/4In1/4)O3-xPbTiO3 ceramics

    Journal of Applied Physics · 2011-09-15

    Zhongqiang Hu, Jianguo Chen, Meiya Li, Xiaotian Li, Guoxi Liu, Shuxiang Dong

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