Octahedral distortion and electronic properties of the antiperovskite oxide Ba3SiO: First principles study
Sign Up to like & getrecommendations! Published in 2020 at "Journal of Physics and Chemistry of Solids"
DOI: 10.1016/j.jpcs.2019.109126
Abstract: Abstract In this study, based on first principles calculations, we investigated the vibrational and electronic structure of the antiperovskite oxide Ba3SiO. The low temperature Pbnm structure was characterized in terms of the group-to-subgroup transition based… read more here.
Keywords: first principles; structure; antiperovskite oxide; ba3sio ... See more keywords
Octahedral Distortion Co-Regulation via Dual Strategies toward Luminescence Enhancement for the MA4InBr7 Perovskite Single Crystal.
Sign Up to like & getrecommendations! Published in 2022 at "ACS applied materials & interfaces"
DOI: 10.1021/acsami.2c17964
Abstract: A series of novel perovskite single crystals are innovatively grown. Aiming to enhance the luminescence performance, octahedral distortion co-regulation via dual strategies for the as-prepared perovskite single crystals is performed. The distortion of the octahedral… read more here.
Keywords: octahedral distortion; perovskite single; regulation via; dual strategies ... See more keywords
Ni/Al co-doping induces FeO6 octahedral distortion to activate lattice oxygen in Ca2Fe2O5 for enhanced chemical looping hydrogen generation
Sign Up to like & getrecommendations! Published in 2025 at "Journal of Materials Chemistry A"
DOI: 10.1039/d5ta02086g
Abstract: Ni/Al doping significantly enhances the catalytic performance and oxygen transport capability of Ca2Fe2O5 in the CLSMR process, thereby achieving higher syngas and hydrogen yields. read more here.
Keywords: oxygen; induces feo6; doping induces; feo6 octahedral ... See more keywords