Article ID Journal Published Year Pages File Type
7962242 Computational Materials Science 2012 5 Pages PDF
Abstract
► We determined via DFT the band edge positions of BiOX for the first time. ► We found the strong anisotropy of the band edge positions. ► The anisotropy can be correlated with the atomic planar density in these species.
Related Topics
Physical Sciences and Engineering Engineering Computational Mechanics
Authors
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