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Title: Materials Data on PrSnPt by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1195520· OSTI ID:1195520

PrPtSn crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Pr is bonded in a 11-coordinate geometry to five Pt and six equivalent Sn atoms. There are four shorter (3.12 Å) and one longer (3.15 Å) Pr–Pt bond lengths. There are two shorter (3.32 Å) and four longer (3.46 Å) Pr–Sn bond lengths. There are two inequivalent Pt sites. In the first Pt site, Pt is bonded in a 9-coordinate geometry to six equivalent Pr and three equivalent Sn atoms. All Pt–Sn bond lengths are 2.92 Å. In the second Pt site, Pt is bonded in a 9-coordinate geometry to three equivalent Pr and six equivalent Sn atoms. All Pt–Sn bond lengths are 2.85 Å. Sn is bonded in a 10-coordinate geometry to six equivalent Pr and four Pt 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:
1195520
Report Number(s):
mp-20390
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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