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Title: Materials Data on AlBiO3 by Materials Project

Abstract

BiAlO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Al3+ is bonded to six equivalent O2- atoms to form AlO6 octahedra that share corners with six equivalent AlO6 octahedra and faces with eight equivalent BiO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Al–O bond lengths are 1.89 Å. Bi3+ is bonded to twelve equivalent O2- atoms to form BiO12 cuboctahedra that share corners with twelve equivalent BiO12 cuboctahedra, faces with six equivalent BiO12 cuboctahedra, and faces with eight equivalent AlO6 octahedra. All Bi–O bond lengths are 2.68 Å. O2- is bonded in a distorted linear geometry to two equivalent Al3+ and four equivalent Bi3+ atoms.

Publication Date:
Other Number(s):
mp-23080
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
Research Org.:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; AlBiO3; Al-Bi-O
OSTI Identifier:
1199220
DOI:
https://doi.org/10.17188/1199220

Citation Formats

The Materials Project. Materials Data on AlBiO3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1199220.
The Materials Project. Materials Data on AlBiO3 by Materials Project. United States. doi:https://doi.org/10.17188/1199220
The Materials Project. 2020. "Materials Data on AlBiO3 by Materials Project". United States. doi:https://doi.org/10.17188/1199220. https://www.osti.gov/servlets/purl/1199220. Pub date:Fri Jul 24 00:00:00 EDT 2020
@article{osti_1199220,
title = {Materials Data on AlBiO3 by Materials Project},
author = {The Materials Project},
abstractNote = {BiAlO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Al3+ is bonded to six equivalent O2- atoms to form AlO6 octahedra that share corners with six equivalent AlO6 octahedra and faces with eight equivalent BiO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Al–O bond lengths are 1.89 Å. Bi3+ is bonded to twelve equivalent O2- atoms to form BiO12 cuboctahedra that share corners with twelve equivalent BiO12 cuboctahedra, faces with six equivalent BiO12 cuboctahedra, and faces with eight equivalent AlO6 octahedra. All Bi–O bond lengths are 2.68 Å. O2- is bonded in a distorted linear geometry to two equivalent Al3+ and four equivalent Bi3+ atoms.},
doi = {10.17188/1199220},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}