Materials Data on Cs2Te3 by Materials Project

doi:10.17188/1262670

Title: Materials Data on Cs2Te3 by Materials Project

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Abstract

Cs2Te3 crystallizes in the orthorhombic Cmc2_1 space group. The structure is three-dimensional. there are two inequivalent Cs sites. In the first Cs site, Cs is bonded in a 8-coordinate geometry to eight Te atoms. There are a spread of Cs–Te bond distances ranging from 3.90–4.20 Å. In the second Cs site, Cs is bonded in a 7-coordinate geometry to seven Te atoms. There are a spread of Cs–Te bond distances ranging from 3.89–4.04 Å. There are two inequivalent Te sites. In the first Te site, Te is bonded in a 5-coordinate geometry to three Cs and two equivalent Te atoms. Both Te–Te bond lengths are 2.83 Å. In the second Te site, Te is bonded to six Cs and one Te atom to form a mixture of distorted face, edge, and corner-sharing TeCs6Te pentagonal bipyramids.

Authors:: The Materials Project

Publication Date:: 2020-07-14

Other Number(s):: mp-505634

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; Cs2Te3; Cs-Te

OSTI Identifier:: 1262670

DOI:: https://doi.org/10.17188/1262670

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                    The Materials Project. Materials Data on Cs2Te3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1262670.

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                    The Materials Project. Materials Data on Cs2Te3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1262670

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                    The Materials Project. 2020.  
"Materials Data on Cs2Te3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1262670.  https://www.osti.gov/servlets/purl/1262670. Pub date:Tue Jul 14 00:00:00 EDT 2020

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@article{osti_1262670,

  title        = {Materials Data on Cs2Te3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Cs2Te3 crystallizes in the orthorhombic Cmc2_1 space group. The structure is three-dimensional. there are two inequivalent Cs sites. In the first Cs site, Cs is bonded in a 8-coordinate geometry to eight Te atoms. There are a spread of Cs–Te bond distances ranging from 3.90–4.20 Å. In the second Cs site, Cs is bonded in a 7-coordinate geometry to seven Te atoms. There are a spread of Cs–Te bond distances ranging from 3.89–4.04 Å. There are two inequivalent Te sites. In the first Te site, Te is bonded in a 5-coordinate geometry to three Cs and two equivalent Te atoms. Both Te–Te bond lengths are 2.83 Å. In the second Te site, Te is bonded to six Cs and one Te atom to form a mixture of distorted face, edge, and corner-sharing TeCs6Te pentagonal bipyramids.},

  doi          = {10.17188/1262670},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1262670

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