Materials Data on Ba3Sn2 by Materials Project

doi:10.17188/1676545

Title: Materials Data on Ba3Sn2 by Materials Project

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Abstract

Ba3Sn2 crystallizes in the tetragonal P4_32_12 space group. The structure is three-dimensional. there are two inequivalent Ba sites. In the first Ba site, Ba is bonded in a 6-coordinate geometry to six equivalent Sn atoms. There are a spread of Ba–Sn bond distances ranging from 3.55–3.97 Å. In the second Ba site, Ba is bonded in a 6-coordinate geometry to six equivalent Sn atoms. There are a spread of Ba–Sn bond distances ranging from 3.71–3.85 Å. Sn is bonded in a 10-coordinate geometry to nine Ba and one Sn atom. The Sn–Sn bond length is 3.00 Å.

Authors:: The Materials Project

Publication Date:: 2020-05-02

Other Number(s):: mp-1190176

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; Ba3Sn2; Ba-Sn

OSTI Identifier:: 1676545

DOI:: https://doi.org/10.17188/1676545

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                    The Materials Project. Materials Data on Ba3Sn2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1676545.

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                    The Materials Project. Materials Data on Ba3Sn2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1676545

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                    The Materials Project. 2020.  
"Materials Data on Ba3Sn2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1676545.  https://www.osti.gov/servlets/purl/1676545. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1676545,

  title        = {Materials Data on Ba3Sn2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Ba3Sn2 crystallizes in the tetragonal P4_32_12 space group. The structure is three-dimensional. there are two inequivalent Ba sites. In the first Ba site, Ba is bonded in a 6-coordinate geometry to six equivalent Sn atoms. There are a spread of Ba–Sn bond distances ranging from 3.55–3.97 Å. In the second Ba site, Ba is bonded in a 6-coordinate geometry to six equivalent Sn atoms. There are a spread of Ba–Sn bond distances ranging from 3.71–3.85 Å. Sn is bonded in a 10-coordinate geometry to nine Ba and one Sn atom. The Sn–Sn bond length is 3.00 Å.},

  doi          = {10.17188/1676545},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1676545

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