U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Y3Fe2Si3 by Materials Project
Abstract
Y3Fe2Si3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Y sites. In the first Y site, Y is bonded in a 4-coordinate geometry to four equivalent Fe and five Si atoms. All Y–Fe bond lengths are 3.20 Å. There are a spread of Y–Si bond distances ranging from 2.86–3.30 Å. In the second Y site, Y is bonded in a 2-coordinate geometry to four equivalent Fe and six Si atoms. There are a spread of Y–Fe bond distances ranging from 3.00–3.15 Å. There are a spread of Y–Si bond distances ranging from 2.95–3.15 Å. Fe is bonded in a 10-coordinate geometry to six Y and four Si atoms. There are a spread of Fe–Si bond distances ranging from 2.31–2.59 Å. There are two inequivalent Si sites. In the first Si site, Si is bonded in a 9-coordinate geometry to seven Y and two equivalent Fe atoms. In the second Si site, Si is bonded in a 10-coordinate geometry to five Y and three equivalent Fe atoms.
- Publication Date:
- Other Number(s):
- mp-1207786
- 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; Fe-Si-Y; Y3Fe2Si3; crystal structure
- OSTI Identifier:
- 1708255
- DOI:
- https://doi.org/10.17188/1708255
Citation Formats
Materials Data on Y3Fe2Si3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1708255.
Materials Data on Y3Fe2Si3 by Materials Project. United States. doi:https://doi.org/10.17188/1708255
2020.
"Materials Data on Y3Fe2Si3 by Materials Project". United States. doi:https://doi.org/10.17188/1708255. https://www.osti.gov/servlets/purl/1708255. Pub date:Wed Apr 29 00:00:00 EDT 2020
@article{osti_1708255,
title = {Materials Data on Y3Fe2Si3 by Materials Project},
abstractNote = {Y3Fe2Si3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Y sites. In the first Y site, Y is bonded in a 4-coordinate geometry to four equivalent Fe and five Si atoms. All Y–Fe bond lengths are 3.20 Å. There are a spread of Y–Si bond distances ranging from 2.86–3.30 Å. In the second Y site, Y is bonded in a 2-coordinate geometry to four equivalent Fe and six Si atoms. There are a spread of Y–Fe bond distances ranging from 3.00–3.15 Å. There are a spread of Y–Si bond distances ranging from 2.95–3.15 Å. Fe is bonded in a 10-coordinate geometry to six Y and four Si atoms. There are a spread of Fe–Si bond distances ranging from 2.31–2.59 Å. There are two inequivalent Si sites. In the first Si site, Si is bonded in a 9-coordinate geometry to seven Y and two equivalent Fe atoms. In the second Si site, Si is bonded in a 10-coordinate geometry to five Y and three equivalent Fe atoms.},
doi = {10.17188/1708255},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}