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Title: Materials Data on Nd(SiAu)2 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1262704· OSTI ID:1262704

NdAu2Si2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Nd2+ is bonded in a 8-coordinate geometry to eight equivalent Au1- and eight equivalent Si atoms. All Nd–Au bond lengths are 3.37 Å. All Nd–Si bond lengths are 3.28 Å. Au1- is bonded to four equivalent Nd2+ and four equivalent Si atoms to form a mixture of distorted edge, face, and corner-sharing AuNd4Si4 tetrahedra. All Au–Si bond lengths are 2.59 Å. Si is bonded in a 5-coordinate geometry to four equivalent Nd2+, four equivalent Au1-, and one Si atom. The Si–Si bond length is 2.35 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:
1262704
Report Number(s):
mp-5057
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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