Materials Data on FeSe by Materials Project
Abstract
FeSe is Modderite-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Fe2+ is bonded to six equivalent Se2- atoms to form a mixture of distorted edge, face, and corner-sharing FeSe6 octahedra. The corner-sharing octahedral tilt angles are 51°. All Fe–Se bond lengths are 2.53 Å. Se2- is bonded in a 6-coordinate geometry to six equivalent Fe2+ atoms.
- Authors:
- Publication Date:
- Other Number(s):
- mp-1090
- 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; FeSe; Fe-Se
- OSTI Identifier:
- 1187442
- DOI:
- https://doi.org/10.17188/1187442
Citation Formats
The Materials Project. Materials Data on FeSe by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1187442.
The Materials Project. Materials Data on FeSe by Materials Project. United States. doi:https://doi.org/10.17188/1187442
The Materials Project. 2020.
"Materials Data on FeSe by Materials Project". United States. doi:https://doi.org/10.17188/1187442. https://www.osti.gov/servlets/purl/1187442. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1187442,
title = {Materials Data on FeSe by Materials Project},
author = {The Materials Project},
abstractNote = {FeSe is Modderite-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Fe2+ is bonded to six equivalent Se2- atoms to form a mixture of distorted edge, face, and corner-sharing FeSe6 octahedra. The corner-sharing octahedral tilt angles are 51°. All Fe–Se bond lengths are 2.53 Å. Se2- is bonded in a 6-coordinate geometry to six equivalent Fe2+ atoms.},
doi = {10.17188/1187442},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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