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Materials Data on Cr by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1192280· OSTI ID:1192280
Cr crystallizes in the cubic Pm-3n space group. The structure is three-dimensional. there are two inequivalent Cr sites. In the first Cr site, Cr is bonded to twelve equivalent Cr atoms to form a mixture of edge and face-sharing CrCr12 cuboctahedra. All Cr–Cr bond lengths are 2.54 Å. In the second Cr site, Cr is bonded in a 2-coordinate geometry to fourteen Cr atoms. There are two shorter (2.27 Å) and eight longer (2.78 Å) Cr–Cr bond lengths.
Research Organization:
LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Contributing Organization:
The Materials Project; MIT; UC Berkeley; Duke; U Louvain
DOE Contract Number:
AC02-05CH11231
OSTI ID:
1192280
Report Number(s):
mp-17
Country of Publication:
United States
Language:
English

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