Materials Data on Na2Sb3O8 by Materials Project

doi:10.17188/1719668

Title: Materials Data on Na2Sb3O8 by Materials Project

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Abstract

Na2Sb3O8 crystallizes in the cubic P4_332 space group. The structure is three-dimensional. Na is bonded to four O atoms to form NaO4 tetrahedra that share corners with nine equivalent SbO6 octahedra. The corner-sharing octahedra tilt angles range from 54–60°. There are three shorter (2.32 Å) and one longer (2.33 Å) Na–O bond lengths. Sb is bonded to six O atoms to form SbO6 octahedra that share corners with six equivalent NaO4 tetrahedra and edges with four equivalent SbO6 octahedra. There are a spread of Sb–O bond distances ranging from 2.01–2.17 Å. There are two inequivalent O sites. In the first O site, O is bonded in a trigonal planar geometry to one Na and two equivalent Sb atoms. In the second O site, O is bonded to one Na and three equivalent Sb atoms to form distorted corner-sharing ONaSb3 tetrahedra.

Authors:: The Materials Project

Publication Date:: 2020-04-29

Other Number(s):: mp-1176363

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; Na2Sb3O8; Na-O-Sb

OSTI Identifier:: 1719668

DOI:: https://doi.org/10.17188/1719668

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                    The Materials Project. Materials Data on Na2Sb3O8 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1719668.

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                    The Materials Project. Materials Data on Na2Sb3O8 by Materials Project.  United States.  doi:https://doi.org/10.17188/1719668

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                    The Materials Project. 2020.  
"Materials Data on Na2Sb3O8 by Materials Project".  United States.  doi:https://doi.org/10.17188/1719668.  https://www.osti.gov/servlets/purl/1719668. Pub date:Wed Apr 29 00:00:00 EDT 2020

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@article{osti_1719668,

  title        = {Materials Data on Na2Sb3O8 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Na2Sb3O8 crystallizes in the cubic P4_332 space group. The structure is three-dimensional. Na is bonded to four O atoms to form NaO4 tetrahedra that share corners with nine equivalent SbO6 octahedra. The corner-sharing octahedra tilt angles range from 54–60°. There are three shorter (2.32 Å) and one longer (2.33 Å) Na–O bond lengths. Sb is bonded to six O atoms to form SbO6 octahedra that share corners with six equivalent NaO4 tetrahedra and edges with four equivalent SbO6 octahedra. There are a spread of Sb–O bond distances ranging from 2.01–2.17 Å. There are two inequivalent O sites. In the first O site, O is bonded in a trigonal planar geometry to one Na and two equivalent Sb atoms. In the second O site, O is bonded to one Na and three equivalent Sb atoms to form distorted corner-sharing ONaSb3 tetrahedra.},

  doi          = {10.17188/1719668},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {4}

}

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DOI: https://doi.org/10.17188/1719668

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