A Predictive Theory for Domain Walls in Oxide Ferroelectrics Based on Interatomic Interactions and its Implications for Collective Material Properties.

Samanta, Atanu; Yadav, Suhas; Gu, Zongquan; Meyers, Cedric J G; Wu, Liyan; Chen, Dongfang; Pandya, Shishir; York, Robert A; Martin, Lane W; Spanier, Jonathan E; Grinberg, Ilya

Samanta, Atanu; Yadav, Suhas; Gu, Zongquan; Meyers, Cedric J G; Wu, Liyan; Chen, Dongfang; Pandya, Shishir; York, Robert A; Martin, Lane W; Spanier, Jonathan E; Grinberg, Ilya.

Afiliação

Samanta A; Department of Chemistry, Bar-Ilan University, Ramat Gan, 5290002, Israel.
Yadav S; Department of Chemistry, Bar-Ilan University, Ramat Gan, 5290002, Israel.
Gu Z; Department of Mechanical Engineering and Mechanics, Drexel University, Philadelphia, PA, 19104, USA.
Meyers CJG; Department of Mechanical Engineering and Mechanics, Drexel University, Philadelphia, PA, 19104, USA.
Wu L; Department of Electrical and Computer Engineering, University of California at Santa Barbara, Santa Barbara, CA, 93106, USA.
Chen D; Department of Mechanical Engineering and Mechanics, Drexel University, Philadelphia, PA, 19104, USA.
Pandya S; Department of Mechanical Engineering and Mechanics, Drexel University, Philadelphia, PA, 19104, USA.
York RA; Department of Materials Science and Engineering, University of California at Berkeley, Berkeley, CA, 94720, USA.
Martin LW; Department of Electrical and Computer Engineering, University of California at Santa Barbara, Santa Barbara, CA, 93106, USA.
Spanier JE; Department of Materials Science and Engineering, University of California at Berkeley, Berkeley, CA, 94720, USA.
Grinberg I; Materials Sciences Division, Lawrence Berkeley National Laboratory, Berkeley, CA, 94720, USA.

Adv Mater ; 34(7): e2106021, 2022 Feb.

Article em En | MEDLINE | ID: mdl-34695263

Palavras-chave

density functional theory (DFT); discrete microscopic Landau-Ginzburg-Devonshire (dmLGD) approach; ferroelectric domain walls, ferroelectric perovskites, order parameters

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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Tipo de estudo: Prognostic_studies / Risk_factors_studies Idioma: En Revista: Adv Mater Assunto da revista: BIOFISICA / QUIMICA Ano de publicação: 2022 Tipo de documento: Article País de afiliação: Israel

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