Materials Data on Ba2I2O by Materials Project

doi:10.17188/1267513

Title: Materials Data on Ba2I2O by Materials Project

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Abstract

Ba2OI2 crystallizes in the orthorhombic Ibam space group. The structure is three-dimensional. Ba2+ is bonded in a distorted L-shaped geometry to two equivalent O2- and five equivalent I1- atoms. Both Ba–O bond lengths are 2.55 Å. There are a spread of Ba–I bond distances ranging from 3.64–3.81 Å. O2- is bonded to four equivalent Ba2+ atoms to form distorted edge-sharing OBa4 tetrahedra. I1- is bonded in a 5-coordinate geometry to five equivalent Ba2+ atoms.

Authors:: The Materials Project

Publication Date:: 2020-07-15

Other Number(s):: mp-551835

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; Ba2I2O; Ba-I-O

OSTI Identifier:: 1267513

DOI:: https://doi.org/10.17188/1267513

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                    The Materials Project. Materials Data on Ba2I2O by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1267513.

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                    The Materials Project. Materials Data on Ba2I2O by Materials Project.  United States.  doi:https://doi.org/10.17188/1267513

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                    The Materials Project. 2020.  
"Materials Data on Ba2I2O by Materials Project".  United States.  doi:https://doi.org/10.17188/1267513.  https://www.osti.gov/servlets/purl/1267513. Pub date:Wed Jul 15 00:00:00 EDT 2020

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@article{osti_1267513,

  title        = {Materials Data on Ba2I2O by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Ba2OI2 crystallizes in the orthorhombic Ibam space group. The structure is three-dimensional. Ba2+ is bonded in a distorted L-shaped geometry to two equivalent O2- and five equivalent I1- atoms. Both Ba–O bond lengths are 2.55 Å. There are a spread of Ba–I bond distances ranging from 3.64–3.81 Å. O2- is bonded to four equivalent Ba2+ atoms to form distorted edge-sharing OBa4 tetrahedra. I1- is bonded in a 5-coordinate geometry to five equivalent Ba2+ atoms.},

  doi          = {10.17188/1267513},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1267513

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