U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Bi2BO5 by Materials Project
Abstract
BBi2O5 crystallizes in the orthorhombic Cmc2_1 space group. The structure is three-dimensional. B3+ is bonded in a trigonal planar geometry to three O2- atoms. There is two shorter (1.38 Å) and one longer (1.39 Å) B–O bond length. Bi+3.50+ is bonded to seven O2- atoms to form a mixture of distorted corner and edge-sharing BiO7 pentagonal bipyramids. There are a spread of Bi–O bond distances ranging from 2.27–2.52 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to one B3+ and two equivalent Bi+3.50+ atoms. In the second O2- site, O2- is bonded to four equivalent Bi+3.50+ atoms to form a mixture of corner and edge-sharing OBi4 tetrahedra. In the third O2- site, O2- is bonded in a distorted single-bond geometry to one B3+ and two equivalent Bi+3.50+ atoms.
- Publication Date:
- Other Number(s):
- mp-754692
- DOE Contract Number:
- AC02-05CH11231
- Research Org.:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Collaborations:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE; B-Bi-O; Bi2BO5; crystal structure
- OSTI Identifier:
- 1289520
- DOI:
- https://doi.org/10.17188/1289520
Citation Formats
Materials Data on Bi2BO5 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1289520.
Materials Data on Bi2BO5 by Materials Project. United States. doi:https://doi.org/10.17188/1289520
2020.
"Materials Data on Bi2BO5 by Materials Project". United States. doi:https://doi.org/10.17188/1289520. https://www.osti.gov/servlets/purl/1289520. Pub date:Mon Jul 20 04:00:00 UTC 2020
@article{osti_1289520,
title = {Materials Data on Bi2BO5 by Materials Project},
abstractNote = {BBi2O5 crystallizes in the orthorhombic Cmc2_1 space group. The structure is three-dimensional. B3+ is bonded in a trigonal planar geometry to three O2- atoms. There is two shorter (1.38 Å) and one longer (1.39 Å) B–O bond length. Bi+3.50+ is bonded to seven O2- atoms to form a mixture of distorted corner and edge-sharing BiO7 pentagonal bipyramids. There are a spread of Bi–O bond distances ranging from 2.27–2.52 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to one B3+ and two equivalent Bi+3.50+ atoms. In the second O2- site, O2- is bonded to four equivalent Bi+3.50+ atoms to form a mixture of corner and edge-sharing OBi4 tetrahedra. In the third O2- site, O2- is bonded in a distorted single-bond geometry to one B3+ and two equivalent Bi+3.50+ atoms.},
doi = {10.17188/1289520},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}