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Title: Materials Data on Fe3Sn by Materials Project

Abstract

Fe3Sn crystallizes in the tetragonal P4/mmm space group. The structure is three-dimensional. there are two inequivalent Fe sites. In the first Fe site, Fe is bonded in a 9-coordinate geometry to five Fe and four equivalent Sn atoms. There are one shorter (2.42 Å) and four longer (2.56 Å) Fe–Fe bond lengths. All Fe–Sn bond lengths are 2.77 Å. In the second Fe site, Fe is bonded in a distorted q6 geometry to eight equivalent Fe and two equivalent Sn atoms. Both Fe–Sn bond lengths are 2.82 Å. Sn is bonded in a 10-coordinate geometry to ten Fe atoms.

Publication Date:
Other Number(s):
mp-1225154
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-Sn; Fe3Sn; crystal structure
OSTI Identifier:
1698645
DOI:
https://doi.org/10.17188/1698645

Citation Formats

Materials Data on Fe3Sn by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1698645.
Materials Data on Fe3Sn by Materials Project. United States. doi:https://doi.org/10.17188/1698645
2020. "Materials Data on Fe3Sn by Materials Project". United States. doi:https://doi.org/10.17188/1698645. https://www.osti.gov/servlets/purl/1698645. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1698645,
title = {Materials Data on Fe3Sn by Materials Project},
abstractNote = {Fe3Sn crystallizes in the tetragonal P4/mmm space group. The structure is three-dimensional. there are two inequivalent Fe sites. In the first Fe site, Fe is bonded in a 9-coordinate geometry to five Fe and four equivalent Sn atoms. There are one shorter (2.42 Å) and four longer (2.56 Å) Fe–Fe bond lengths. All Fe–Sn bond lengths are 2.77 Å. In the second Fe site, Fe is bonded in a distorted q6 geometry to eight equivalent Fe and two equivalent Sn atoms. Both Fe–Sn bond lengths are 2.82 Å. Sn is bonded in a 10-coordinate geometry to ten Fe atoms.},
doi = {10.17188/1698645},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}