Materials Data on BiSbWO6 by Materials Project

doi:10.17188/1741626

Title: Materials Data on BiSbWO6 by Materials Project

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Abstract

WBiSbO6 crystallizes in the monoclinic C2 space group. The structure is three-dimensional. there are two inequivalent W6+ sites. In the first W6+ site, W6+ is bonded to six O2- atoms to form corner-sharing WO6 octahedra. The corner-sharing octahedra tilt angles range from 23–24°. There are a spread of W–O bond distances ranging from 1.88–2.07 Å. In the second W6+ site, W6+ is bonded to six O2- atoms to form corner-sharing WO6 octahedra. The corner-sharing octahedra tilt angles range from 23–24°. There are a spread of W–O bond distances ranging from 1.87–2.08 Å. Bi3+ is bonded in a 7-coordinate geometry to seven O2- atoms. There are a spread of Bi–O bond distances ranging from 2.23–3.05 Å. Sb3+ is bonded in a 5-coordinate geometry to six O2- atoms. There are a spread of Sb–O bond distances ranging from 2.04–2.77 Å. There are six inequivalent O2- sites. In the first O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Bi3+ and two equivalent Sb3+ atoms. In the second O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Bi3+ and two equivalent Sb3+ atoms. In the third O2- site, O2- is bonded in a distorted bent 150 degreesmore »« less

Authors:: The Materials Project

Publication Date:: 2020-04-30

Other Number(s):: mp-1227556

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; BiSbWO6; Bi-O-Sb-W

OSTI Identifier:: 1741626

DOI:: https://doi.org/10.17188/1741626

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                    The Materials Project. Materials Data on BiSbWO6 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1741626.

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                    The Materials Project. Materials Data on BiSbWO6 by Materials Project.  United States.  doi:https://doi.org/10.17188/1741626

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                    The Materials Project. 2020.  
"Materials Data on BiSbWO6 by Materials Project".  United States.  doi:https://doi.org/10.17188/1741626.  https://www.osti.gov/servlets/purl/1741626. Pub date:Thu Apr 30 00:00:00 EDT 2020

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@article{osti_1741626,

  title        = {Materials Data on BiSbWO6 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {WBiSbO6 crystallizes in the monoclinic C2 space group. The structure is three-dimensional. there are two inequivalent W6+ sites. In the first W6+ site, W6+ is bonded to six O2- atoms to form corner-sharing WO6 octahedra. The corner-sharing octahedra tilt angles range from 23–24°. There are a spread of W–O bond distances ranging from 1.88–2.07 Å. In the second W6+ site, W6+ is bonded to six O2- atoms to form corner-sharing WO6 octahedra. The corner-sharing octahedra tilt angles range from 23–24°. There are a spread of W–O bond distances ranging from 1.87–2.08 Å. Bi3+ is bonded in a 7-coordinate geometry to seven O2- atoms. There are a spread of Bi–O bond distances ranging from 2.23–3.05 Å. Sb3+ is bonded in a 5-coordinate geometry to six O2- atoms. There are a spread of Sb–O bond distances ranging from 2.04–2.77 Å. There are six inequivalent O2- sites. In the first O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Bi3+ and two equivalent Sb3+ atoms. In the second O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Bi3+ and two equivalent Sb3+ atoms. In the third O2- site, O2- is bonded in a distorted bent 150 degrees geometry to two W6+ and one Bi3+ atom. In the fourth O2- site, O2- is bonded in a bent 150 degrees geometry to two W6+ atoms. In the fifth O2- site, O2- is bonded in a 3-coordinate geometry to one W6+, one Bi3+, and one Sb3+ atom. In the sixth O2- site, O2- is bonded in a 3-coordinate geometry to one W6+, one Bi3+, and one Sb3+ atom.},

  doi          = {10.17188/1741626},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {4}

}

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DOI: https://doi.org/10.17188/1741626

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