Static disorder in the crystal structure of perovskite-type proton-conducting oxide BaSn $_{0.5}$ In $_{0.5}$ O $_{2.75}$

Hayakawa, Kazutaka*; Nagasaki, Takanori*; Yamada, Tomoaki*; Yoshino, Masahito*; Igawa, Naoki ; Hoshikawa, Akinori*; Ishigaki, Toru*

Static disorder in the crystal structure of perovskite-type proton conducting oxide BaSn $_{0.5}$ In $_{0.5}$ O $_{2.75}$ is investigated by atomistic simulation based on empirical potentials. The neutron scattering length density distribution for Ba and O obtained by the simulation is similar to that obtained by analyzing the neutron powder diffraction data using maximum entropy method.

Language	:	Japanese
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Meeting title	:	日本セラミックス協会第25回秋季シンポジウム
Held date	:	2012/09
Location (city)	:	名古屋
Location (country)	:	日本
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Keywords	:	no keyword
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Cooperating Institute	:	名古屋大学

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Registration No. : BB20121291
JAEA Abstracts No. :
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Static disorder in the crystal structure of perovskite-type proton-conducting oxide BaSnInO

Static disorder in the crystal structure of perovskite-type proton-conducting oxide BaSn $_{0.5}$ In $_{0.5}$ O $_{2.75}$