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Title: Materials Data on AlFe2 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1316700· OSTI ID:1316700

Fe2Al crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Fe is bonded in a distorted q6 geometry to five equivalent Fe and six equivalent Al atoms. There are three shorter (2.39 Å) and two longer (2.55 Å) Fe–Fe bond lengths. All Fe–Al bond lengths are 2.71 Å. Al is bonded in a 12-coordinate geometry to twelve equivalent Fe and two equivalent Al atoms. Both Al–Al bond lengths are 2.55 Å.

Research Organization:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Contributing Organization:
MIT; UC Berkeley; Duke; U Louvain
DOE Contract Number:
AC02-05CH11231; EDCBEE
OSTI ID:
1316700
Report Number(s):
mp-985579
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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