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Title: Materials Data on Yb2Mg by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1316278· OSTI ID:1316278

MgYb2 crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Mg is bonded in a 9-coordinate geometry to two equivalent Mg and seven Yb atoms. Both Mg–Mg bond lengths are 3.09 Å. There are a spread of Mg–Yb bond distances ranging from 3.46–3.69 Å. There are two inequivalent Yb sites. In the first Yb site, Yb is bonded to two equivalent Mg and ten Yb atoms to form a mixture of distorted edge, face, and corner-sharing YbYb10Mg2 cuboctahedra. There are a spread of Yb–Yb bond distances ranging from 3.77–3.94 Å. In the second Yb site, Yb is bonded in a 5-coordinate geometry to five equivalent Mg and eight Yb atoms. There are one shorter (3.77 Å) and two longer (3.79 Å) Yb–Yb 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:
1316278
Report Number(s):
mp-980663
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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