4.5 Article

The flexoelectricity of barium and strontium titanates from first principles

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JOURNAL OF PHYSICS-CONDENSED MATTER
卷 22, 期 11, 页码 -

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IOP PUBLISHING LTD
DOI: 10.1088/0953-8984/22/11/112201

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  1. China's Scholarship Council
  2. EPSRC
  3. ICREA Funding Source: Custom

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We present ab initio calculations of the longitudinal flexoelectricity for BaTiO3 and SrTiO3 using a direct approach. The calculated value for SrTiO3 agrees with recently reported measurements. For BaTiO3, however, the theoretical values are smaller than the measured ones; possible reasons for the discrepancy are discussed.

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