Nonstoichiometry and the Electrical Activity of Grain Boundaries inSrTiO3

作者: Miyoung Kim , Gerd Duscher , Nigel D. Browning , Karl Sohlberg , Sokrates T. Pantelides

DOI: 10.1103/PHYSREVLETT.86.4056

关键词: ElectronCondensed matter physicsMaterials scienceSchottky diodeGrain boundaryDirect evidenceCrystalliteSpectral line

摘要: … , fully occupied Sr column instead of two half-occupied columns … the alternative of having a single fully occupied Ti-O column has … In our supercell, there are only two O atoms per column …

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