U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Bi14MoO24 by Materials Project
Abstract
Bi14MoO24 crystallizes in the tetragonal I4/m space group. The structure is three-dimensional. Mo6+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All Mo–O bond lengths are 1.89 Å. There are three inequivalent Bi3+ sites. In the first Bi3+ site, Bi3+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of Bi–O bond distances ranging from 2.13–2.67 Å. In the second Bi3+ site, Bi3+ is bonded in a 7-coordinate geometry to seven O2- atoms. There are a spread of Bi–O bond distances ranging from 2.27–2.71 Å. In the third Bi3+ site, Bi3+ is bonded in a distorted body-centered cubic geometry to eight O2- atoms. There are four shorter (2.37 Å) and four longer (2.71 Å) Bi–O bond lengths. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a 4-coordinate geometry to four Bi3+ atoms. In the second O2- site, O2- is bonded to four Bi3+ atoms to form a mixture of corner and edge-sharing OBi4 tetrahedra. In the third O2- site, O2- is bonded in a distorted bent 150 degrees geometry to one Mo6+ and one Bi3+ atom. In the fourth O2- site, O2- is bondedmore »
- Authors:
- Publication Date:
- Other Number(s):
- mp-1227628
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- 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)
- Collaborations:
- MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE
- Keywords:
- crystal structure; Bi14MoO24; Bi-Mo-O
- OSTI Identifier:
- 1677396
- DOI:
- https://doi.org/10.17188/1677396
Citation Formats
The Materials Project. Materials Data on Bi14MoO24 by Materials Project. United States: N. p., 2019.
Web. doi:10.17188/1677396.
The Materials Project. Materials Data on Bi14MoO24 by Materials Project. United States. doi:https://doi.org/10.17188/1677396
The Materials Project. 2019.
"Materials Data on Bi14MoO24 by Materials Project". United States. doi:https://doi.org/10.17188/1677396. https://www.osti.gov/servlets/purl/1677396. Pub date:Sun Jan 13 00:00:00 EST 2019
@article{osti_1677396,
title = {Materials Data on Bi14MoO24 by Materials Project},
author = {The Materials Project},
abstractNote = {Bi14MoO24 crystallizes in the tetragonal I4/m space group. The structure is three-dimensional. Mo6+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All Mo–O bond lengths are 1.89 Å. There are three inequivalent Bi3+ sites. In the first Bi3+ site, Bi3+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of Bi–O bond distances ranging from 2.13–2.67 Å. In the second Bi3+ site, Bi3+ is bonded in a 7-coordinate geometry to seven O2- atoms. There are a spread of Bi–O bond distances ranging from 2.27–2.71 Å. In the third Bi3+ site, Bi3+ is bonded in a distorted body-centered cubic geometry to eight O2- atoms. There are four shorter (2.37 Å) and four longer (2.71 Å) Bi–O bond lengths. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a 4-coordinate geometry to four Bi3+ atoms. In the second O2- site, O2- is bonded to four Bi3+ atoms to form a mixture of corner and edge-sharing OBi4 tetrahedra. In the third O2- site, O2- is bonded in a distorted bent 150 degrees geometry to one Mo6+ and one Bi3+ atom. In the fourth O2- site, O2- is bonded in a 4-coordinate geometry to four Bi3+ atoms.},
doi = {10.17188/1677396},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {1}
}