First‐principles study of the atomic structures, electronic properties, and surface stability of BaTiO3 (001) and (011) surfaces
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DOI: 10.1002/sia.6688
Abstract: The atomic structures, electronic properties, and surface stability of (001) and (011) surfaces of BaTiO3 are studied by first‐principles calculations. Four differently terminated BaTiO3 surfaces are considered in this study, including (001)‐BaO, (001)‐TiO2, (011)‐BaTiO, and… read more here.
Keywords: 011 surfaces; 001 011; surface; atomic structures ... See more keywords