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Title: Materials Data on CaB2Rh3 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1202774· OSTI ID:1202774

CaRh3B2 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Ca is bonded in a 12-coordinate geometry to two equivalent Ca, twelve equivalent Rh, and six equivalent B atoms. Both Ca–Ca bond lengths are 2.93 Å. All Ca–Rh bond lengths are 3.17 Å. All Ca–B bond lengths are 3.24 Å. Rh is bonded in a distorted square co-planar geometry to four equivalent Ca and four equivalent B atoms. All Rh–B bond lengths are 2.19 Å. B is bonded in a 6-coordinate geometry to three equivalent Ca and six equivalent Rh 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:
1202774
Report Number(s):
mp-28705
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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