Phase stability and electronic structures of perovskite and organic optoelectronic materials via first-principle calculations

Mixed ionic and electronic conductor oxides, in particular La1-xSrxCoyFe1-yO3-d (LSCF), have been widely used as the cathode materials in solid oxide fuel cells for high-temperature energy applications. The focus of this thesis is primarily on constructing the instability phase diagram of Sr segreg...

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Bibliographic Details
Main Author: Luo, Heng
Language:en_US
Published: 2016
Subjects:
Online Access:https://hdl.handle.net/2144/15184