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Title: Materials Data on ErB4 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1275433· OSTI ID:1275433

ErB4 crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Er is bonded in a 8-coordinate geometry to eight B atoms. There are a spread of Er–B bond distances ranging from 2.54–2.76 Å. There are three inequivalent B sites. In the first B site, B is bonded in a 6-coordinate geometry to two equivalent Er and four B atoms. There is two shorter (1.68 Å) and two longer (1.75 Å) B–B bond length. In the second B site, B is bonded in a 5-coordinate geometry to four equivalent Er and one B atom. The B–B bond length is 1.55 Å. In the third B site, B is bonded in a 5-coordinate geometry to five B atoms. The B–B bond length is 1.61 Å.

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:
1275433
Report Number(s):
mp-570034
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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