Materials Data on BaPbO3 by Materials Project
BaPbO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Ba2+ is bonded to twelve equivalent O2- atoms to form BaO12 cuboctahedra that share corners with twelve equivalent BaO12 cuboctahedra, faces with six equivalent BaO12 cuboctahedra, and faces with eight equivalent PbO6 octahedra. All Ba–O bond lengths are 3.08 Å. Pb4+ is bonded to six equivalent O2- atoms to form PbO6 octahedra that share corners with six equivalent PbO6 octahedra and faces with eight equivalent BaO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Pb–O bond lengths are 2.18 Å. O2- is bonded to four equivalent Ba2+ and two equivalent Pb4+ atoms to form a mixture of distorted corner, edge, and face-sharing OBa4Pb2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°.
- Research Organization:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Organization:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Contributing Organization:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- DOE Contract Number:
- AC02-05CH11231
- OSTI ID:
- 1196592
- Report Number(s):
- mp-21280
- Country of Publication:
- United States
- Language:
- English
Similar Records
Materials Data on Ba4Pb3O10 by Materials Project
Materials Data on BaPbO3 by Materials Project
Materials Data on Ba2UPbO6 by Materials Project
Dataset
·
Sat May 02 00:00:00 EDT 2020
·
OSTI ID:1288843
Materials Data on BaPbO3 by Materials Project
Dataset
·
Fri Jul 17 00:00:00 EDT 2020
·
OSTI ID:1196224
Materials Data on Ba2UPbO6 by Materials Project
Dataset
·
Sun May 03 00:00:00 EDT 2020
·
OSTI ID:1736550