Materials Data on BaIn by Materials Project

doi:10.17188/1205716

Title: Materials Data on BaIn by Materials Project

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Abstract

BaIn crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Ba sites. In the first Ba site, Ba is bonded in a 8-coordinate geometry to eight equivalent In atoms. There are a spread of Ba–In bond distances ranging from 3.52–3.98 Å. In the second Ba site, Ba is bonded in a 2-coordinate geometry to eight equivalent In atoms. There are a spread of Ba–In bond distances ranging from 3.60–4.11 Å. In is bonded in a 11-coordinate geometry to eight Ba and three equivalent In atoms. There are one shorter (3.33 Å) and two longer (3.49 Å) In–In bond lengths.

Authors:: The Materials Project

Publication Date:: 2020-07-15

Other Number(s):: mp-31509

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; BaIn; Ba-In

OSTI Identifier:: 1205716

DOI:: https://doi.org/10.17188/1205716

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                    The Materials Project. Materials Data on BaIn by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1205716.

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                    The Materials Project. Materials Data on BaIn by Materials Project.  United States.  doi:https://doi.org/10.17188/1205716

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                    The Materials Project. 2020.  
"Materials Data on BaIn by Materials Project".  United States.  doi:https://doi.org/10.17188/1205716.  https://www.osti.gov/servlets/purl/1205716. Pub date:Wed Jul 15 00:00:00 EDT 2020

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@article{osti_1205716,

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

  author       = {The Materials Project},

  abstractNote = {BaIn crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Ba sites. In the first Ba site, Ba is bonded in a 8-coordinate geometry to eight equivalent In atoms. There are a spread of Ba–In bond distances ranging from 3.52–3.98 Å. In the second Ba site, Ba is bonded in a 2-coordinate geometry to eight equivalent In atoms. There are a spread of Ba–In bond distances ranging from 3.60–4.11 Å. In is bonded in a 11-coordinate geometry to eight Ba and three equivalent In atoms. There are one shorter (3.33 Å) and two longer (3.49 Å) In–In bond lengths.},

  doi          = {10.17188/1205716},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1205716

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