Literature DB >> 27258883

Emergence of Long-Range Order in BaTiO_{3} from Local Symmetry-Breaking Distortions.

M S Senn1, D A Keen2, T C A Lucas3, J A Hriljac3, A L Goodwin1.   

Abstract

By using a symmetry motivated basis to evaluate local distortions against pair distribution function data, we show without prior bias, that the off-center Ti displacements in the archetypal ferroelectric BaTiO_{3} are zone centered and rhombohedral-like across its known ferroelectric and paraelectric phases. We construct a simple Monte Carlo model that captures our main experimental findings and demonstrate how the rich crystallographic phase diagram of BaTiO_{3} emerges from correlations of local symmetry-breaking distortions alone. Our results strongly support the order-disorder picture for these phase transitions, but can also be reconciled with the soft-mode theory of BaTiO_{3} that is supported by some spectroscopic techniques.

Year:  2016        PMID: 27258883     DOI: 10.1103/PhysRevLett.116.207602

Source DB:  PubMed          Journal:  Phys Rev Lett        ISSN: 0031-9007            Impact factor:   9.161


  13 in total

1.  Atomic scale symmetry and polar nanoclusters in the paraelectric phase of ferroelectric materials.

Authors:  Andreja Bencan; Emad Oveisi; Sina Hashemizadeh; Vignaswaran K Veerapandiyan; Takuya Hoshina; Tadej Rojac; Marco Deluca; Goran Drazic; Dragan Damjanovic
Journal:  Nat Commun       Date:  2021-06-09       Impact factor: 14.919

2.  Local-scale structures across the morphotropic phase boundary in PbZr1-x Ti x O3.

Authors:  Nan Zhang; Hiroko Yokota; A M Glazer; D A Keen; Semën Gorfman; P A Thomas; Wei Ren; Zuo-Guang Ye
Journal:  IUCrJ       Date:  2018-01-01       Impact factor: 4.769

3.  Role of polar nanoregions with weak random fields in Pb-based perovskite ferroelectrics.

Authors:  M A Helal; M Aftabuzzaman; S Tsukada; S Kojima
Journal:  Sci Rep       Date:  2017-03-16       Impact factor: 4.379

4.  Ellipsoidal analysis of coordination polyhedra.

Authors:  James Cumby; J Paul Attfield
Journal:  Nat Commun       Date:  2017-02-01       Impact factor: 14.919

5.  Coherent Nanotwins and Dynamic Disorder in Cesium Lead Halide Perovskite Nanocrystals.

Authors:  Federica Bertolotti; Loredana Protesescu; Maksym V Kovalenko; Sergii Yakunin; Antonio Cervellino; Simon J L Billinge; Maxwell W Terban; Jan Skov Pedersen; Norberto Masciocchi; Antonietta Guagliardi
Journal:  ACS Nano       Date:  2017-04-14       Impact factor: 15.881

6.  Recipes for improper ferroelectricity in molecular perovskites.

Authors:  Hanna L B Boström; Mark S Senn; Andrew L Goodwin
Journal:  Nat Commun       Date:  2018-06-18       Impact factor: 14.919

7.  Thermal evolution of the crystal structure and phase transitions of KNbO3.

Authors:  S L Skjærvø; K Høydalsvik; A B Blichfeld; M-A Einarsrud; T Grande
Journal:  R Soc Open Sci       Date:  2018-06-20       Impact factor: 2.963

8.  Ferroelectric order driven Eu3+ photoluminescence in BaZrxTi1-xO3 perovskite.

Authors:  Giovanna Canu; Gregorio Bottaro; Maria Teresa Buscaglia; Chiara Costa; Oana Condurache; Lavinia Curecheriu; Liliana Mitoseriu; Vincenzo Buscaglia; Lidia Armelao
Journal:  Sci Rep       Date:  2019-04-23       Impact factor: 4.379

9.  POWGEN: rebuild of a third-generation powder diffractometer at the Spallation Neutron Source.

Authors:  Ashfia Huq; Melanie Kirkham; Peter F Peterson; Jason P Hodges; Pamela S Whitfield; Katharine Page; Thomas Hűgle; Erik B Iverson; Andre Parizzi; George Rennich
Journal:  J Appl Crystallogr       Date:  2019-10-01       Impact factor: 3.304

10.  Recovering local structure information from high-pressure total scattering experiments.

Authors:  Anna Herlihy; Harry S Geddes; Gabriele C Sosso; Craig L Bull; Christopher J Ridley; Andrew L Goodwin; Mark S Senn; Nicholas P Funnell
Journal:  J Appl Crystallogr       Date:  2021-11-23       Impact factor: 3.304

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