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Materials Data on Ge2Pt3 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1197108· OSTI ID:1197108
Ge2Pt3 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are four inequivalent Pt2- sites. In the first Pt2- site, Pt2- is bonded in a 5-coordinate geometry to five Ge3+ atoms. There are a spread of Pt–Ge bond distances ranging from 2.57–2.69 Å. In the second Pt2- site, Pt2- is bonded in a 5-coordinate geometry to five Ge3+ atoms. There are a spread of Pt–Ge bond distances ranging from 2.59–2.67 Å. In the third Pt2- site, Pt2- is bonded in a 5-coordinate geometry to five Ge3+ atoms. There are a spread of Pt–Ge bond distances ranging from 2.57–2.65 Å. In the fourth Pt2- site, Pt2- is bonded in a 5-coordinate geometry to five Ge3+ atoms. There are a spread of Pt–Ge bond distances ranging from 2.58–2.71 Å. There are three inequivalent Ge3+ sites. In the first Ge3+ site, Ge3+ is bonded in a 7-coordinate geometry to seven Pt2- atoms. In the second Ge3+ site, Ge3+ is bonded in a 7-coordinate geometry to seven Pt2- atoms. In the third Ge3+ site, Ge3+ is bonded in a body-centered cubic geometry to eight Pt2- atoms.
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:
1197108
Report Number(s):
mp-21673
Country of Publication:
United States
Language:
English

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