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Title: Materials Data on SrAl9Co2 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1191902· OSTI ID:1191902

SrCo2Al9 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Sr is bonded to twelve equivalent Al atoms to form face-sharing SrAl12 cuboctahedra. All Sr–Al bond lengths are 3.53 Å. Co is bonded in a 9-coordinate geometry to nine Al atoms. There are three shorter (2.28 Å) and six longer (2.55 Å) Co–Al bond lengths. There are two inequivalent Al sites. In the first Al site, Al is bonded in a linear geometry to two equivalent Co and eight equivalent Al atoms. All Al–Al bond lengths are 2.82 Å. In the second Al site, Al is bonded in a 2-coordinate geometry to two equivalent Sr, two equivalent Co, and eight Al atoms. There are two shorter (2.83 Å) and two longer (2.93 Å) Al–Al bond lengths.

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:
1191902
Report Number(s):
mp-16491
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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