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Title: Materials Data on CeB2Ru3 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1277195· OSTI ID:1277195

CeRu3B2 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Ce is bonded in a 12-coordinate geometry to two equivalent Ce, twelve equivalent Ru, and six equivalent B atoms. Both Ce–Ce bond lengths are 3.01 Å. All Ce–Ru bond lengths are 3.16 Å. All Ce–B bond lengths are 3.20 Å. Ru is bonded in a distorted square co-planar geometry to four equivalent Ce and four equivalent B atoms. All Ru–B bond lengths are 2.20 Å. B is bonded in a 6-coordinate geometry to three equivalent Ce and six equivalent Ru atoms.

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:
1277195
Report Number(s):
mp-5940
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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