Materials Data on In6Ge2PtO9 by Materials Project

doi:10.17188/1197411

Title: Materials Data on In6Ge2PtO9 by Materials Project

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Abstract

PtIn6Ge2O9 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 six equivalent OIn6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Pt–In bond lengths are 2.67 Å. In2+ is bonded in a 6-coordinate geometry to one Pt2- and five O2- atoms. There are four shorter (2.35 Å) and one longer (2.45 Å) In–O bond lengths. Ge4+ is bonded in a tetrahedral geometry to four equivalent O2- atoms. All Ge–O bond lengths are 1.78 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to six equivalent In2+ atoms to form OIn6 octahedra that share corners with six equivalent PtIn6 octahedra. The corner-sharing octahedral tilt angles are 0°. In the second O2- site, O2- is bonded in a 4-coordinate geometry to three equivalent In2+ and one Ge4+ atom.

Authors:: The Materials Project

Publication Date:: 2020-07-14

Other Number(s):: mp-22186

DOE Contract Number:: AC02-05CH11231; EDCBEE

Research Org.:: Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project

Sponsoring Org.:: USDOE Office of Science (SC), Basic Energy Sciences (BES)

Collaborations:: MIT; UC Berkeley; Duke; U Louvain

Subject:: 36 MATERIALS SCIENCE

Keywords:: crystal structure; In6Ge2PtO9; Ge-In-O-Pt

OSTI Identifier:: 1197411

DOI:: https://doi.org/10.17188/1197411

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                    The Materials Project. Materials Data on In6Ge2PtO9 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1197411.

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                    The Materials Project. Materials Data on In6Ge2PtO9 by Materials Project.  United States.  doi:https://doi.org/10.17188/1197411

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                    The Materials Project. 2020.  
"Materials Data on In6Ge2PtO9 by Materials Project".  United States.  doi:https://doi.org/10.17188/1197411.  https://www.osti.gov/servlets/purl/1197411. Pub date:Tue Jul 14 00:00:00 EDT 2020

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@article{osti_1197411,

  title        = {Materials Data on In6Ge2PtO9 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {PtIn6Ge2O9 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 six equivalent OIn6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Pt–In bond lengths are 2.67 Å. In2+ is bonded in a 6-coordinate geometry to one Pt2- and five O2- atoms. There are four shorter (2.35 Å) and one longer (2.45 Å) In–O bond lengths. Ge4+ is bonded in a tetrahedral geometry to four equivalent O2- atoms. All Ge–O bond lengths are 1.78 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to six equivalent In2+ atoms to form OIn6 octahedra that share corners with six equivalent PtIn6 octahedra. The corner-sharing octahedral tilt angles are 0°. In the second O2- site, O2- is bonded in a 4-coordinate geometry to three equivalent In2+ and one Ge4+ atom.},

  doi          = {10.17188/1197411},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1197411

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