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Materials Data on Nd4CdPt by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1655338· OSTI ID:1655338
Nd4PtCd crystallizes in the cubic F-43m space group. The structure is three-dimensional. there are three inequivalent Nd sites. In the first Nd site, Nd is bonded in a 3-coordinate geometry to three equivalent Pt and three equivalent Cd atoms. All Nd–Pt bond lengths are 2.94 Å. All Nd–Cd bond lengths are 3.57 Å. In the second Nd site, Nd is bonded in a distorted bent 150 degrees geometry to two equivalent Pt and two equivalent Cd atoms. Both Nd–Pt bond lengths are 2.94 Å. Both Nd–Cd bond lengths are 3.61 Å. In the third Nd site, Nd is bonded in a 4-coordinate geometry to two equivalent Pt and two equivalent Cd atoms. Both Nd–Pt bond lengths are 3.65 Å. Both Nd–Cd bond lengths are 3.41 Å. Pt is bonded in a 6-coordinate geometry to nine Nd atoms. Cd is bonded to nine Nd and three equivalent Cd atoms to form a mixture of distorted face and corner-sharing CdNd9Cd3 cuboctahedra. All Cd–Cd bond lengths are 3.22 Å.
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:
1655338
Report Number(s):
mp-1209989
Country of Publication:
United States
Language:
English

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