Materials Data on Mo5As4 by Materials Project
Abstract
Mo5As4 crystallizes in the tetragonal I4/m space group. The structure is three-dimensional. there are two inequivalent Mo+2.40+ sites. In the first Mo+2.40+ site, Mo+2.40+ is bonded in a 5-coordinate geometry to five equivalent As3- atoms. There are a spread of Mo–As bond distances ranging from 2.62–2.90 Å. In the second Mo+2.40+ site, Mo+2.40+ is bonded in a body-centered cubic geometry to eight equivalent As3- atoms. All Mo–As bond lengths are 2.66 Å. As3- is bonded in a 11-coordinate geometry to seven Mo+2.40+ atoms.
- Authors:
- Publication Date:
- Other Number(s):
- mp-569319
- 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; Mo5As4; As-Mo
- OSTI Identifier:
- 1275034
- DOI:
- https://doi.org/10.17188/1275034
Citation Formats
The Materials Project. Materials Data on Mo5As4 by Materials Project. United States: N. p., 2019.
Web. doi:10.17188/1275034.
The Materials Project. Materials Data on Mo5As4 by Materials Project. United States. doi:https://doi.org/10.17188/1275034
The Materials Project. 2019.
"Materials Data on Mo5As4 by Materials Project". United States. doi:https://doi.org/10.17188/1275034. https://www.osti.gov/servlets/purl/1275034. Pub date:Tue Jun 04 00:00:00 EDT 2019
@article{osti_1275034,
title = {Materials Data on Mo5As4 by Materials Project},
author = {The Materials Project},
abstractNote = {Mo5As4 crystallizes in the tetragonal I4/m space group. The structure is three-dimensional. there are two inequivalent Mo+2.40+ sites. In the first Mo+2.40+ site, Mo+2.40+ is bonded in a 5-coordinate geometry to five equivalent As3- atoms. There are a spread of Mo–As bond distances ranging from 2.62–2.90 Å. In the second Mo+2.40+ site, Mo+2.40+ is bonded in a body-centered cubic geometry to eight equivalent As3- atoms. All Mo–As bond lengths are 2.66 Å. As3- is bonded in a 11-coordinate geometry to seven Mo+2.40+ atoms.},
doi = {10.17188/1275034},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {6}
}