U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Si3H by Materials Project
Abstract
(Si)6H2 is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional and consists of four hydrogen molecules and one Si framework. In the Si framework, there are two inequivalent Si sites. In the first Si site, Si is bonded to four equivalent Si atoms to form a mixture of distorted edge and corner-sharing SiSi4 tetrahedra. All Si–Si bond lengths are 2.51 Å. In the second Si site, Si is bonded in a body-centered cubic geometry to eight equivalent Si atoms.
- Publication Date:
- Other Number(s):
- mp-978497
- 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; H-Si; Si3H; crystal structure
- OSTI Identifier:
- 1315916
- DOI:
- https://doi.org/10.17188/1315916
Citation Formats
Materials Data on Si3H by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1315916.
Materials Data on Si3H by Materials Project. United States. doi:https://doi.org/10.17188/1315916
2020.
"Materials Data on Si3H by Materials Project". United States. doi:https://doi.org/10.17188/1315916. https://www.osti.gov/servlets/purl/1315916. Pub date:Fri Jul 24 00:00:00 EDT 2020
@article{osti_1315916,
title = {Materials Data on Si3H by Materials Project},
abstractNote = {(Si)6H2 is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional and consists of four hydrogen molecules and one Si framework. In the Si framework, there are two inequivalent Si sites. In the first Si site, Si is bonded to four equivalent Si atoms to form a mixture of distorted edge and corner-sharing SiSi4 tetrahedra. All Si–Si bond lengths are 2.51 Å. In the second Si site, Si is bonded in a body-centered cubic geometry to eight equivalent Si atoms.},
doi = {10.17188/1315916},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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