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Materials Data on Er2InAu2 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1678203· OSTI ID:1678203
Er2Au2In crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Er is bonded in a 6-coordinate geometry to six equivalent Au and four equivalent In atoms. There are two shorter (2.91 Å) and four longer (3.02 Å) Er–Au bond lengths. All Er–In bond lengths are 3.48 Å. Au is bonded in a 9-coordinate geometry to six equivalent Er, one Au, and two equivalent In atoms. The Au–Au bond length is 2.89 Å. Both Au–In bond lengths are 3.14 Å. In is bonded to eight equivalent Er and four equivalent Au atoms to form a mixture of distorted face and corner-sharing InEr8Au4 cuboctahedra.
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:
1678203
Report Number(s):
mp-1079059
Country of Publication:
United States
Language:
English

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