Materials Data on Tl2O3 by Materials Project

doi:10.17188/1684477

Title: Materials Data on Tl2O3 by Materials Project

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Abstract

Tl2O3 crystallizes in the trigonal P-3m1 space group. The structure is three-dimensional. Tl3+ is bonded in a 7-coordinate geometry to seven O2- atoms. There are a spread of Tl–O bond distances ranging from 2.20–2.74 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to six equivalent Tl3+ atoms to form edge-sharing OTl6 octahedra. In the second O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to four equivalent Tl3+ atoms.

Authors:: The Materials Project

Publication Date:: 2019-01-12

Other Number(s):: mp-1216564

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; Tl2O3; O-Tl

OSTI Identifier:: 1684477

DOI:: https://doi.org/10.17188/1684477

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                    The Materials Project. Materials Data on Tl2O3 by Materials Project.  United States: N. p., 2019. 
        Web.  doi:10.17188/1684477.

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                    The Materials Project. Materials Data on Tl2O3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1684477

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                    The Materials Project. 2019.  
"Materials Data on Tl2O3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1684477.  https://www.osti.gov/servlets/purl/1684477. Pub date:Sat Jan 12 00:00:00 EST 2019

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@article{osti_1684477,

  title        = {Materials Data on Tl2O3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Tl2O3 crystallizes in the trigonal P-3m1 space group. The structure is three-dimensional. Tl3+ is bonded in a 7-coordinate geometry to seven O2- atoms. There are a spread of Tl–O bond distances ranging from 2.20–2.74 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to six equivalent Tl3+ atoms to form edge-sharing OTl6 octahedra. In the second O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to four equivalent Tl3+ atoms.},

  doi          = {10.17188/1684477},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2019},

  month        = {1}

}

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DOI: https://doi.org/10.17188/1684477

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