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Title: Materials Data on ErPbAu by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1204792· OSTI ID:1204792

ErAuPb is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Er is bonded to four equivalent Au and six equivalent Pb atoms to form a mixture of distorted corner and face-sharing ErPb6Au4 tetrahedra. All Er–Au bond lengths are 2.95 Å. All Er–Pb bond lengths are 3.41 Å. Au is bonded in a body-centered cubic geometry to four equivalent Er and four equivalent Pb atoms. All Au–Pb bond lengths are 2.95 Å. Pb is bonded in a distorted q6 geometry to six equivalent Er and four equivalent Au 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:
1204792
Report Number(s):
mp-30377
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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