Materials Data on BaSb2 by Materials Project

doi:10.17188/1680740

Title: Materials Data on BaSb2 by Materials Project

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Abstract

BaSb2 crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Ba2+ is bonded in a 10-coordinate geometry to ten Sb1- atoms. There are a spread of Ba–Sb bond distances ranging from 3.70–3.84 Å. There are two inequivalent Sb1- sites. In the first Sb1- site, Sb1- is bonded in a 8-coordinate geometry to five equivalent Ba2+ and three Sb1- atoms. There are one shorter (2.99 Å) and two longer (3.04 Å) Sb–Sb bond lengths. In the second Sb1- site, Sb1- is bonded in a 8-coordinate geometry to five equivalent Ba2+ and three Sb1- atoms. The Sb–Sb bond length is 2.99 Å.

Authors:: The Materials Project

Publication Date:: Sun May 03 00:00:00 EDT 2020

Other Number(s):: mp-1182123

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; BaSb2; Ba-Sb

OSTI Identifier:: 1680740

DOI:: https://doi.org/10.17188/1680740

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                    The Materials Project. Materials Data on BaSb2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1680740.

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                    The Materials Project. Materials Data on BaSb2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1680740

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                    The Materials Project. 2020.  
"Materials Data on BaSb2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1680740.  https://www.osti.gov/servlets/purl/1680740. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1680740,

  title        = {Materials Data on BaSb2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {BaSb2 crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Ba2+ is bonded in a 10-coordinate geometry to ten Sb1- atoms. There are a spread of Ba–Sb bond distances ranging from 3.70–3.84 Å. There are two inequivalent Sb1- sites. In the first Sb1- site, Sb1- is bonded in a 8-coordinate geometry to five equivalent Ba2+ and three Sb1- atoms. There are one shorter (2.99 Å) and two longer (3.04 Å) Sb–Sb bond lengths. In the second Sb1- site, Sb1- is bonded in a 8-coordinate geometry to five equivalent Ba2+ and three Sb1- atoms. The Sb–Sb bond length is 2.99 Å.},

  doi          = {10.17188/1680740},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sun May 03 00:00:00 EDT 2020},

  month        = {Sun May 03 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1680740

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