Evolutions of geometry and electronic state introduced by oxygen vacancy for CaMnO3 compound

The cell structures, locally micro-structures, combinations, electronic states as well as carrier transports induced by Oxygen vacancy for the CaMnO3 compound have been systematically investigated by pseudo-potential plane wave functions within the framework of density functional theory calculationa...

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Bibliographic Details
Main Authors: C.S. Huang, H. Fang, Z.H. Xu, X. Zheng, X.X. Ruan
Format: Article
Language:English
Published: Elsevier 2019-06-01
Series:Results in Physics
Online Access:http://www.sciencedirect.com/science/article/pii/S2211379719312112