Materials Data on BaWO2 by Materials Project

doi:10.17188/1740777

Title: Materials Data on BaWO2 by Materials Project

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Abstract

BaWO2 crystallizes in the tetragonal I4_1/amd space group. The structure is three-dimensional. Ba2+ is bonded to six equivalent O2- atoms to form edge-sharing BaO6 octahedra. There are four shorter (2.71 Å) and two longer (2.81 Å) Ba–O bond lengths. W2+ is bonded in a distorted square co-planar geometry to four equivalent O2- atoms. All W–O bond lengths are 2.23 Å. O2- is bonded to three equivalent Ba2+ and two equivalent W2+ atoms to form a mixture of distorted edge and corner-sharing OBa3W2 square pyramids.

Authors:: The Materials Project

Publication Date:: 2020-05-02

Other Number(s):: mp-1214266

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; BaWO2; Ba-O-W

OSTI Identifier:: 1740777

DOI:: https://doi.org/10.17188/1740777

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                    The Materials Project. Materials Data on BaWO2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1740777.

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                    The Materials Project. Materials Data on BaWO2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1740777

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                    The Materials Project. 2020.  
"Materials Data on BaWO2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1740777.  https://www.osti.gov/servlets/purl/1740777. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1740777,

  title        = {Materials Data on BaWO2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {BaWO2 crystallizes in the tetragonal I4_1/amd space group. The structure is three-dimensional. Ba2+ is bonded to six equivalent O2- atoms to form edge-sharing BaO6 octahedra. There are four shorter (2.71 Å) and two longer (2.81 Å) Ba–O bond lengths. W2+ is bonded in a distorted square co-planar geometry to four equivalent O2- atoms. All W–O bond lengths are 2.23 Å. O2- is bonded to three equivalent Ba2+ and two equivalent W2+ atoms to form a mixture of distorted edge and corner-sharing OBa3W2 square pyramids.},

  doi          = {10.17188/1740777},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1740777

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