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Title: Materials Data on Th(GePt)2 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1745257· OSTI ID:1745257

Th(PtGe)2 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Th is bonded in a 12-coordinate geometry to eight Pt and eight Ge atoms. There are four shorter (3.32 Å) and four longer (3.36 Å) Th–Pt bond lengths. There are four shorter (3.29 Å) and four longer (3.39 Å) Th–Ge bond lengths. There are two inequivalent Pt sites. In the first Pt site, Pt is bonded in a 4-coordinate geometry to four equivalent Th and four equivalent Ge atoms. All Pt–Ge bond lengths are 2.58 Å. In the second Pt site, Pt is bonded in a 9-coordinate geometry to four equivalent Th and five Ge atoms. There are one shorter (2.46 Å) and four longer (2.53 Å) Pt–Ge bond lengths. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 4-coordinate geometry to four equivalent Th and four equivalent Pt atoms. In the second Ge site, Ge is bonded in a 9-coordinate geometry to four equivalent Th and five 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:
1745257
Report Number(s):
mp-1078793
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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