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Title: Materials Data on In6Ga2PtO8 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1196361· OSTI ID:1196361

PtIn6Ga2O8 is Aluminum carbonitride-derived structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Pt2- is bonded to six equivalent In2+ atoms to form PtIn6 octahedra that share corners with twenty-four equivalent OIn3Ga tetrahedra. All Pt–In bond lengths are 2.57 Å. In2+ is bonded in a 5-coordinate geometry to one Pt2- and four equivalent O2- atoms. All In–O bond lengths are 2.30 Å. Ga3+ is bonded in a tetrahedral geometry to four equivalent O2- atoms. All Ga–O bond lengths are 1.91 Å. O2- is bonded to three equivalent In2+ and one Ga3+ atom to form distorted OIn3Ga tetrahedra that share corners with three equivalent PtIn6 octahedra, corners with six equivalent OIn3Ga tetrahedra, and edges with three equivalent OIn3Ga tetrahedra. The corner-sharing octahedral tilt angles are 62°.

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:
1196361
Report Number(s):
mp-21084
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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