Intrinsic stoichiometry and oxygen-induced p-type conductivity of pyrite FeS2
The stoichiometry and ubiquitous observation of p-type conductivity of synthetic pyrite FeS[subscript 2] thin films are investigated via first-principles computations of native (vacancies, interstitials, antisites) and extrinsic (O[subscript S], O[subscript i]) point defects. Native defects have hig...
Main Authors: | Sun, Ruoshi, Chan, Maria K., Kang, ShinYoung, Ceder, Gerbrand |
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Other Authors: | Massachusetts Institute of Technology. Department of Materials Science and Engineering |
Format: | Article |
Language: | en_US |
Published: |
American Physical Society
2011
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Online Access: | http://hdl.handle.net/1721.1/67315 https://orcid.org/0000-0002-6833-3480 https://orcid.org/0000-0003-0333-6565 |
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