Density functional theory investigation of surface defects in Sn-doped ZnO

• Main Authors: Supatutkul C., Pramchu S., Jaroenjittichai A., Laosiritaworn Y.
• 格式: 雜誌
• 出版: 2017
• 在線閱讀: https://www.scopus.com/inward/record.uri?partnerID=HzOxMe3b&scp=84994012269&origin=inward; http://cmuir.cmu.ac.th/jspui/handle/6653943832/41296

© 2016 In this work, the first principle density functional theory calculation was used to investigate the Sn-doped ZnO on both non-polar (101̅0) and polar (0001) surfaces. The incorporation of Sn dopant in host material was modeled as ZnO with surface and bulk defects. The surface defect has Sn dop...