Presentation Information

[22p-A311-6]Tuning physical properties of ferroelectric BaTiO3 by biaxial strain

〇Hikaru Azuma1, Seiya Shimoi1, Takahiro Tsuzuki1, Ryo Kobayashi1, Masayuki Uranagase1, Genki Deguchi1, Akito Morimoto1, Shuji Ogata1 (1.Nagoya Inst. Tech.)

Keywords:

ferroelectrics,molecular dynamics,barium titanate

BaTiO3 is a ferroelectric material used in energy conversion devices such as actuators and capacitors. Although BaTiO3 has the advantage of not containing harmful lead, its piezoelectric and temperature property is inferior to these of the widely used Pb(ZrxTi1-x)O3. In order to expand the range of applications of BaTiO3, it is desirable to develop a technology to improve the Curie temperature and piezoelectric properties from their original values. In this study, a technique to add biaxial strain (a- and b-axis strain of tetragonal crystal) to improve these properties was investigated by molecular dynamics simulation.