Ferroelectric surface chemistry: First-principles study of the PbTiO[subscript 3] surface

Ferroelectric surfaces provide a promising method for modifying surface reactions via an external electric field, which can potentially provide an avenue for tunable molecular binding and surface catalysis. Using first-principles density functional theory, we investigate how the properties of the Pb...

詳細記述

書誌詳細
主要な著者: Garrity, Kevin, Kakekhani, Arvin, Ismail-Beigi, Sohrab, Kolpak, Alexie M.
その他の著者: Massachusetts Institute of Technology. Department of Materials Science and Engineering
フォーマット: 論文
言語:en_US
出版事項: American Physical Society 2014
オンライン・アクセス:http://hdl.handle.net/1721.1/88743
https://orcid.org/0000-0002-4347-0139