Preprints of Annual Meeting of The Ceramic Society of Japan
Preprints of Fall Meeting of The Ceramic Society of Japan
Annual Meeting of The Ceramic Society of Japan, 2011
Session ID : 1B19
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Host: The Ceramic Society of Japan

First-principles calculations of BiFeO3-PbTiO3 solid-solution system with giant c/a ratio
*Hiroki Moriwake, Kazuaki Taji, Fumiko Yoshida, Chikako Moriyashi, Yoshihiro Kuroiwa
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Keywords: Ferroelectric, Phase transition, Perovskite, First-principles calculations
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Abstract
The origin of giant c/a ratio in BiFeO3-PbTiO3 solid-solution system has been studied by First-principles calculations.
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© The Ceramic Society of Japan 2011
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