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Investigation of piezoelectricity in perovskite (LaFeO3): A theoretical study

✍ Scribed by C.C. dos Santos; J.P. Barbosa; M.A.B. dos Santos; F.A.M. Lira; F.J.B. Cardoso; J.C. Pinheiro; O. Treu Filho; R.T. Kondo

Book ID
116374763
Publisher
Elsevier Science
Year
2007
Tongue
English
Weight
224 KB
Volume
39
Category
Article
ISSN
0927-0256

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## Abstract Hybrid‐DFT calculations were performed to clarify the hydrogen transport mechanism in SrTiO~3~ perovskite. From a molecular‐orbital analysis, we discussed the changes of the chemical bonding between conductive hydrogen and others, and the proton conduction paths. It is concluded that th