Materials Data on In7Te10 by Materials Project

doi:10.17188/1281567

Title: Materials Data on In7Te10 by Materials Project

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Abstract

In7Te10 crystallizes in the trigonal R32 space group. The structure is three-dimensional. there are three inequivalent In+2.86+ sites. In the first In+2.86+ site, In+2.86+ is bonded to four Te2- atoms to form a mixture of edge and corner-sharing InTe4 tetrahedra. There are a spread of In–Te bond distances ranging from 2.78–2.91 Å. In the second In+2.86+ site, In+2.86+ is bonded to four Te2- atoms to form corner-sharing InTe4 tetrahedra. There are a spread of In–Te bond distances ranging from 2.78–2.88 Å. In the third In+2.86+ site, In+2.86+ is bonded in a trigonal non-coplanar geometry to three equivalent Te2- atoms. All In–Te bond lengths are 2.89 Å. There are five inequivalent Te2- sites. In the first Te2- site, Te2- is bonded in a 3-coordinate geometry to three In+2.86+ atoms. In the second Te2- site, Te2- is bonded in an L-shaped geometry to two equivalent In+2.86+ atoms. In the third Te2- site, Te2- is bonded in a distorted trigonal non-coplanar geometry to three In+2.86+ atoms. In the fourth Te2- site, Te2- is bonded in a water-like geometry to two equivalent In+2.86+ atoms. In the fifth Te2- site, Te2- is bonded in a distorted trigonal non-coplanar geometry to three equivalent In+2.86+ atoms.

Authors:: The Materials Project

Publication Date:: Sat May 02 00:00:00 EDT 2020

Other Number(s):: mp-669311

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; In7Te10; In-Te

OSTI Identifier:: 1281567

DOI:: https://doi.org/10.17188/1281567

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                    The Materials Project. Materials Data on In7Te10 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1281567.

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                    The Materials Project. Materials Data on In7Te10 by Materials Project.  United States.  doi:https://doi.org/10.17188/1281567

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                    The Materials Project. 2020.  
"Materials Data on In7Te10 by Materials Project".  United States.  doi:https://doi.org/10.17188/1281567.  https://www.osti.gov/servlets/purl/1281567. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1281567,

  title        = {Materials Data on In7Te10 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {In7Te10 crystallizes in the trigonal R32 space group. The structure is three-dimensional. there are three inequivalent In+2.86+ sites. In the first In+2.86+ site, In+2.86+ is bonded to four Te2- atoms to form a mixture of edge and corner-sharing InTe4 tetrahedra. There are a spread of In–Te bond distances ranging from 2.78–2.91 Å. In the second In+2.86+ site, In+2.86+ is bonded to four Te2- atoms to form corner-sharing InTe4 tetrahedra. There are a spread of In–Te bond distances ranging from 2.78–2.88 Å. In the third In+2.86+ site, In+2.86+ is bonded in a trigonal non-coplanar geometry to three equivalent Te2- atoms. All In–Te bond lengths are 2.89 Å. There are five inequivalent Te2- sites. In the first Te2- site, Te2- is bonded in a 3-coordinate geometry to three In+2.86+ atoms. In the second Te2- site, Te2- is bonded in an L-shaped geometry to two equivalent In+2.86+ atoms. In the third Te2- site, Te2- is bonded in a distorted trigonal non-coplanar geometry to three In+2.86+ atoms. In the fourth Te2- site, Te2- is bonded in a water-like geometry to two equivalent In+2.86+ atoms. In the fifth Te2- site, Te2- is bonded in a distorted trigonal non-coplanar geometry to three equivalent In+2.86+ atoms.},

  doi          = {10.17188/1281567},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sat May 02 00:00:00 EDT 2020},

  month        = {Sat May 02 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1281567

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