Hydrogen-related defects in ZnO studied by infrared absorption spectroscopy
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- 3 October 2002
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review B
- Vol. 66 (16) , 165205
- https://doi.org/10.1103/physrevb.66.165205
Abstract
Two hydrogen-related defects in ZnO are identified by a combination of local vibrational mode spectroscopy and first-principles theory. The H-I center consists of one hydrogen atom at the bond-center site oriented along the c axis of the crystal. The H-II center contains two inequivalent hydrogen atoms primarily bound to oxygen atoms. The polarized absorption data allow us to identify H-II as a zinc vacancy having two hydrogen atoms.Keywords
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