U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Si3As by Materials Project
Abstract
Si3As is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Si sites. In the first Si site, Si is bonded in a body-centered cubic geometry to four equivalent Si and four equivalent As atoms. All Si–Si bond lengths are 2.75 Å. All Si–As bond lengths are 2.75 Å. In the second Si site, Si is bonded in a body-centered cubic geometry to eight equivalent Si atoms. As is bonded in a body-centered cubic geometry to eight equivalent Si atoms.
- Publication Date:
- Other Number(s):
- mp-972752
- 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; As-Si; Si3As; crystal structure
- OSTI Identifier:
- 1313912
- DOI:
- https://doi.org/10.17188/1313912
Citation Formats
Materials Data on Si3As by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1313912.
Materials Data on Si3As by Materials Project. United States. doi:https://doi.org/10.17188/1313912
2020.
"Materials Data on Si3As by Materials Project". United States. doi:https://doi.org/10.17188/1313912. https://www.osti.gov/servlets/purl/1313912. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1313912,
title = {Materials Data on Si3As by Materials Project},
abstractNote = {Si3As is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Si sites. In the first Si site, Si is bonded in a body-centered cubic geometry to four equivalent Si and four equivalent As atoms. All Si–Si bond lengths are 2.75 Å. All Si–As bond lengths are 2.75 Å. In the second Si site, Si is bonded in a body-centered cubic geometry to eight equivalent Si atoms. As is bonded in a body-centered cubic geometry to eight equivalent Si atoms.},
doi = {10.17188/1313912},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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